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RNA cytidine acetyltransferase

RNA cytidine acetyltransferase with specificity toward both 18S rRNA and tRNAs. Catalyzes the formation of N(4)-acetylcytidine (ac4C) in 18S rRNA. Required for early nucleolar cleavages of precursor rRNA at sites A0, A1 and A2 during 18S rRNA synthesis. Catalyzes the formation of ac4C in serine and leucine tRNAs. Requires a tRNA-binding adapter protein for full tRNA acetyltransferase activity but not for 18S rRNA acetylation.

AlphaFold DB , UniProt , Accession X2JD07, Species DROME (Drosophila melanogaster, Fruit fly), Gene l(1)G0020, Length 967 aa.

						>X2JD07_DROME|X2JD07|l(1)G0020
MVKKKIDNRIRVMIENGVKLGHRTMFIVIGDKARDQVPILYDILTKSTVKARPTVLWCYKNKDEAISNHGKKRAKKIAVGKVDVNEADLFDSFRVATTIHGRYYSETHAVLGRTYGVCVLQDFEALTPNLLARTVETVEGGGLIILLLKTLQSLKQLYTMSMDVHKRFRTEAHQTVTCRFNERLILSLADCKRCLVVNDDLTVLPLSSKTINVEPVNPAGAGRSPNEASLKELKESLLTVQPAGALVNLCKTYDQANAVAQFIEALVDKQLKPPMSLTAARGRGKSAALGLSIAAAVAFGYVNIYVTSPHPENLITLFEFVLKGFDALEYQEHADYTIIRSTNADYKKAIIRINITRSSRQTIQYIAPSDTHLLNAADLLLIDEAAAIPLPLVKKMIGPYLVFMASTINGYEGTGRSLSLKLISQLQKDNNARPPLKLEESIRYQENDDIEKWLINLLCLDASTVPSISSGCPTPDACELYYVDRDALFSYHKAAEAFLHRLVSIYVSSHYKNTPNDLQMMSDAPAHHLFCLLGPVQRMDALPEILVVIQVALEGQISAQSISDSLGRGKKAAGDLIPWNVAEQYGDRDFPKLCGVRIVRVATHPNYQRMGYGKRAIQLLKDYYARKHTNLEDGPVASKDAGKGIEEVEEEELSLLKEQIRPRSRIPTLLQRLHERVPEHVDYIGTSYGLTTELLKFWKNAGFVPVYLSQKSNELTAEHSCIMLHTPNATPWLGLYYQDFRRRVLKLMGKTFREFETKLCLALLKNKSVDTEGSALKVLDKPMLDVYFLPHDLQRLESYARQQSEFRLIIDLLTDIAQLYFQGRIDGLQLDLVQQGILLALGVQGKTVDALGLELNMPGNQLLAKFFDAMKRCNQCFRSVLEEHIEGGMLREADLSKGEELQPLTLSLDKELDQTAQKLSKQQRKELKRLKAEQLDEFQIKGTEEDWSKALETNGTGGGSGLLSVKR
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.8	Very low	74.1	Confident	229 Å²	229	120.5 Å²	120.5	100%	1.128	57%	0.567	S	S	*	*				0	115.1	0	-81.9	179.7	169.3	0	0	109.9	K3	M1-K3 PolarHBondContact O-N 3.12Å
2	V	48.8	Very low	75.4	Confident	145 Å²	145	111.3 Å²	111.3	88%	0.879	53%	0.525	S	S	*	.			trans	-74.2	116.8	171.2	179.9	0	0	0	0	107.5	K4	V2-K4 PolarHBondContact O-N 3.48Å
3	K	59.7	Low	76.4	Confident	210 Å²	210	103.4 Å²	103.4	91%	0.913	49%	0.488	S	S	*	.			trans	-75.4	93.3	176.5	-72.9	-177.3	179.1	177.6	0	109.2	M1	M1-K3 PolarHBondContact O-N 3.12Å
4	K	69.9	Low	77.4	Confident	118 Å²	118	96 Å²	96	51%	0.513	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-83.6	133.6	174.5	-161.1	177.3	-173.7	-176.2	0	109.4	V2 I6 D200	V2-K4 PolarHBondContact O-N 3.48Å; K4-I6 PolarHBondContact O-N 3.2Å; K4-D200 IonicContact NZ-OD2 3.17Å; K4-D200 PolarHBondContact NZ-OD2 3.22Å
5	K	77.4	Confident	78.2	Confident	202 Å²	202	92.3 Å²	92.3	88%	0.878	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-72.1	121.8	175.3	-173.4	177.9	178.8	-178.4	0	108.7
6	I	82.3	Confident	78.9	Confident	71 Å²	71	87 Å²	87	36%	0.364	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-66.3	142.6	175	-59.4	173.1	0	0	0	108.9	K4 N8 I10 I39 L201	K4-I6 PolarHBondContact O-N 3.2Å; I6-N8 PolarHBondContact O-N 3.4Å; I6-I10 HydrophobicContact CG2-CD1 4.06Å; I6-I39 HydrophobicContact CD1-CG2 3.89Å; I6-L201 HydrophobicContact CD1-CD1 4.13Å; I6-L201 HydrophobicContact CG1-CD1 4.44Å; I6-L201 HydrophobicContact CG2-CB 4.41Å
7	D	82.4	Confident	79.4	Confident	47 Å²	47	81.9 Å²	81.9	25%	0.251	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-59.5	127.9	175.4	-166.1	-38.6	0	0	0	110.8	R9 I10 V203	D7-R9 PolarHBondContact O-N 3.47Å; D7-R9 VanDerWaalsContact O-N 3.15Å; D7-R9 WeakPolarHBondContact OD1-CB 3.28Å; D7-R9 WeakPolarHBondContact OD1-CG 3.36Å; D7-R9 PolarHBondContact OD1-N 3.02Å; D7-R9 IonicContact OD1-NE 3.25Å; D7-R9 PolarHBondContact OD1-NE 3.01Å; D7-R9 IonicContact OD2-CZ 3.32Å; D7-R9 VanDerWaalsContact OD2-CZ 3.25Å; D7-R9 IonicContact OD2-NE 2.74Å; D7-R9 PolarHBondContact OD2-NE 3.29Å; D7-R9 IonicContact OD2-NH2 3.02Å; D7-R9 PolarHBondContact OD2-NH2 2.99Å; D7-I10 PolarHBondContact O-N 3.2Å; D7-V203 HydrophobicContact CB-CG2 4.18Å
8	N	85.9	Confident	80	Confident	104 Å²	104	79.7 Å²	79.7	56%	0.556	38%	0.379	S	S	*	.	H	α-helix	trans	-62.6	-25.3	-176	-164.9	38.5	0	0	0	112.3	I6 I10 R11 V12	I6-N8 PolarHBondContact O-N 3.4Å; N8-I10 VanDerWaalsContact C-N 3.26Å; N8-I10 PolarHBondContact O-N 3.35Å; N8-R11 PolarHBondContact O-N 2.88Å; N8-V12 WeakPolarHBondContact O-CG2 3.37Å; N8-V12 PolarHBondContact O-N 2.84Å
9	R	86.5	Confident	80.3	Confident	60 Å²	60	80.7 Å²	80.7	23%	0.226	38%	0.382	C	S	.	.	H	α-helix	trans	-56.5	-40.2	178.3	-68.8	179.8	-73.6	177.1	-7.4	112.2	D7 R11 V12 M13 V203	D7-R9 PolarHBondContact O-N 3.47Å; D7-R9 VanDerWaalsContact O-N 3.15Å; D7-R9 WeakPolarHBondContact OD1-CB 3.28Å; D7-R9 WeakPolarHBondContact OD1-CG 3.36Å; D7-R9 PolarHBondContact OD1-N 3.02Å; D7-R9 IonicContact OD1-NE 3.25Å; D7-R9 PolarHBondContact OD1-NE 3.01Å; D7-R9 IonicContact OD2-CZ 3.32Å; D7-R9 VanDerWaalsContact OD2-CZ 3.25Å; D7-R9 IonicContact OD2-NE 2.74Å; D7-R9 PolarHBondContact OD2-NE 3.29Å; D7-R9 IonicContact OD2-NH2 3.02Å; D7-R9 PolarHBondContact OD2-NH2 2.99Å; R9-R11 PolarHBondContact O-N 2.74Å; R9-V12 PolarHBondContact O-N 3.15Å; R9-M13 VanDerWaalsContact O-CB 3.27Å; R9-M13 WeakPolarHBondContact O-CB 3.41Å; R9-M13 PolarHBondContact O-N 2.68Å; R9-V203 HydrophobicContact CB-CG2 4.49Å
10	I	88.6	Confident	80.6	Confident	0 Å²	0	79 Å²	79	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-61.1	-48.1	179.9	-62.9	175.5	0	0	0	110.1	I6 D7 N8 M13 I14 F26 L40 I43 V197 L201 V203	I6-I10 HydrophobicContact CG2-CD1 4.06Å; D7-I10 PolarHBondContact O-N 3.2Å; N8-I10 VanDerWaalsContact C-N 3.26Å; N8-I10 PolarHBondContact O-N 3.35Å; I10-M13 PolarHBondContact O-N 3.01Å; I10-I14 HydrophobicContact CG2-CD1 4.22Å; I10-I14 WeakPolarHBondContact O-CG1 3.36Å; I10-I14 PolarHBondContact O-N 3.37Å; I10-F26 HydrophobicContact CB-CE1 4.42Å; I10-F26 HydrophobicContact CG1-CE1 4.3Å; I10-F26 HydrophobicContact CG2-CE1 3.87Å; I10-F26 HydrophobicContact CG2-CZ 3.9Å; I10-L40 HydrophobicContact CG2-CD2 3.7Å; I10-I43 HydrophobicContact CG2-CD1 4.43Å; I10-V197 HydrophobicContact CD1-CG1 4.08Å; I10-V197 HydrophobicContact CD1-CG2 4.26Å; I10-L201 HydrophobicContact CD1-CB 4.16Å; I10-L201 HydrophobicContact CD1-CD2 4.39Å; I10-L201 VanDerWaalsContact CD1-O 3.29Å; I10-L201 WeakPolarHBondContact CD1-O 3.32Å; I10-V203 HydrophobicContact CD1-CG2 4.14Å; I10-V203 HydrophobicContact CG1-CG2 3.82Å
11	R	89.1	Confident	80.9	Confident	139 Å²	139	76 Å²	76	53%	0.525	37%	0.365	S	S	.	.	H	α-helix	trans	-64.3	-50.3	179.8	-179.2	-178.4	170.7	-174.4	-5.1	111.7	N8 R9 M13 I14 E15 I43	N8-R11 PolarHBondContact O-N 2.88Å; R9-R11 PolarHBondContact O-N 2.74Å; R11-M13 PolarHBondContact O-N 3.17Å; R11-I14 PolarHBondContact O-N 3.39Å; R11-E15 HydrophobicContact CG-CG 4.46Å; R11-E15 IonicContact CZ-OE1 3.51Å; R11-E15 IonicContact NE-OE1 3.52Å; R11-E15 PolarHBondContact NE-OE1 3.33Å; R11-E15 IonicContact NH2-OE1 3.76Å; R11-E15 PolarHBondContact NH2-OE1 3.1Å; R11-E15 WeakPolarHBondContact O-CG 3.36Å; R11-E15 PolarHBondContact O-N 3.44Å; R11-I43 HydrophobicContact CG-CG2 4.42Å
12	V	89.3	Confident	83.1	Confident	11 Å²	11	66.1 Å²	66.1	7%	0.067	32%	0.316	C	S	.	.	H	α-helix	trans	-59.6	-37.9	-179.6	175.7	0	0	0	0	110.7	N8 R9 E15 N16 V213 P215	N8-V12 WeakPolarHBondContact O-CG2 3.37Å; N8-V12 PolarHBondContact O-N 2.84Å; R9-V12 PolarHBondContact O-N 3.15Å; V12-E15 PolarHBondContact O-N 3.18Å; V12-N16 VanDerWaalsContact O-CB 3.24Å; V12-N16 WeakPolarHBondContact O-CB 3.48Å; V12-N16 PolarHBondContact O-N 3.14Å; V12-N16 PolarHBondContact O-ND2 3.17Å; V12-V213 HydrophobicContact CB-CG1 4.46Å; V12-V213 HydrophobicContact CG1-CG1 3.88Å; V12-P215 HydrophobicContact CG1-CB 4.12Å
13	M	88.2	Confident	85.2	Confident	8 Å²	8	59.2 Å²	59.2	4%	0.039	27%	0.274	C	S	.	.	H	α-helix	trans	-63	-45.5	178.9	-156	66.5	178.5	0	0	113	R9 I10 R11 N16 G17 T24 K192 R193 L195 V213	R9-M13 VanDerWaalsContact O-CB 3.27Å; R9-M13 WeakPolarHBondContact O-CB 3.41Å; R9-M13 PolarHBondContact O-N 2.68Å; I10-M13 PolarHBondContact O-N 3.01Å; R11-M13 PolarHBondContact O-N 3.17Å; M13-N16 PolarHBondContact O-N 3.5Å; M13-G17 PolarHBondContact O-N 3.46Å; M13-T24 HydrophobicContact CB-CG2 4.41Å; M13-T24 HydrophobicContact CG-CG2 3.63Å; M13-K192 WeakPolarHBondContact CE-O 3.17Å; M13-R193 HydrophobicContact CE-CB 3.96Å; M13-R193 HydrophobicContact CE-CG 3.74Å; M13-L195 HydrophobicContact CB-CD1 3.82Å; M13-L195 HydrophobicContact CG-CD1 3.85Å; M13-L195 HydrophobicContact CG-CG 4.45Å; M13-V213 HydrophobicContact SD-CB 4.47Å; M13-V213 HydrophobicContact SD-CG1 3.56Å; M13-V213 VanDerWaalsContact SD-CG1 3.56Å; M13-V213 HydrophobicContact SD-CG2 4.03Å
14	I	90.8	Very high	86.8	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-65.7	-47.6	178.5	-63.6	172.9	0	0	0	109.8	I10 R11 N16 G17 V18 F26 L40 I43 L44 L143	I10-I14 HydrophobicContact CG2-CD1 4.22Å; I10-I14 WeakPolarHBondContact O-CG1 3.36Å; I10-I14 PolarHBondContact O-N 3.37Å; R11-I14 PolarHBondContact O-N 3.39Å; I14-N16 VanDerWaalsContact C-N 3.32Å; I14-N16 PolarHBondContact O-N 3.15Å; I14-G17 PolarHBondContact O-N 3.39Å; I14-G17 VanDerWaalsContact O-N 3.11Å; I14-V18 WeakPolarHBondContact O-CG2 3.38Å; I14-V18 PolarHBondContact O-N 2.92Å; I14-F26 HydrophobicContact CD1-CE2 3.95Å; I14-F26 HydrophobicContact CD1-CZ 4.03Å; I14-F26 HydrophobicContact CG1-CE2 3.73Å; I14-F26 HydrophobicContact CG1-CZ 3.86Å; I14-L40 HydrophobicContact CD1-CD2 4.39Å; I14-I43 HydrophobicContact CB-CG2 4.31Å; I14-I43 HydrophobicContact CD1-CB 4.08Å; I14-I43 HydrophobicContact CD1-CG2 3.67Å; I14-I43 HydrophobicContact CG2-CG2 4.31Å; I14-L44 HydrophobicContact CG2-CB 4.24Å; I14-L44 HydrophobicContact CG2-CD1 3.92Å; I14-L143 HydrophobicContact CD1-CD1 4.21Å; I14-L143 HydrophobicContact CG1-CD2 4.01Å; I14-L143 HydrophobicContact CG2-CD2 4.48Å
15	E	89.8	Confident	87.9	Confident	41 Å²	41	43.7 Å²	43.7	19%	0.192	21%	0.206	C	C	.	.	H	α-helix	trans	-59.5	-42.4	177.4	-71.8	-179.6	-175.8	0	0	111.8	R11 V12 G17 V18 K19	R11-E15 HydrophobicContact CG-CG 4.46Å; R11-E15 IonicContact CZ-OE1 3.51Å; R11-E15 IonicContact NE-OE1 3.52Å; R11-E15 PolarHBondContact NE-OE1 3.33Å; R11-E15 IonicContact NH2-OE1 3.76Å; R11-E15 PolarHBondContact NH2-OE1 3.1Å; R11-E15 WeakPolarHBondContact O-CG 3.36Å; R11-E15 PolarHBondContact O-N 3.44Å; V12-E15 PolarHBondContact O-N 3.18Å; E15-G17 VanDerWaalsContact C-N 3.34Å; E15-G17 PolarHBondContact O-N 3.1Å; E15-V18 PolarHBondContact O-N 3.22Å; E15-K19 WeakPolarHBondContact O-CB 3.34Å; E15-K19 VanDerWaalsContact O-CG 3.28Å; E15-K19 WeakPolarHBondContact O-CG 3.43Å; E15-K19 PolarHBondContact O-N 3.47Å
16	N	88.8	Confident	88.6	Confident	7 Å²	7	34.1 Å²	34.1	4%	0.037	17%	0.165	C	C	.	.	H	α-helix	trans	-65.2	-35.6	175.5	-76.1	-11.2	0	0	0	112.6	V12 M13 I14 L20 R193 E214 V216	V12-N16 VanDerWaalsContact O-CB 3.24Å; V12-N16 WeakPolarHBondContact O-CB 3.48Å; V12-N16 PolarHBondContact O-N 3.14Å; V12-N16 PolarHBondContact O-ND2 3.17Å; M13-N16 PolarHBondContact O-N 3.5Å; I14-N16 VanDerWaalsContact C-N 3.32Å; I14-N16 PolarHBondContact O-N 3.15Å; N16-L20 WeakPolarHBondContact O-CB 3.24Å; N16-L20 PolarHBondContact O-N 3.48Å; N16-L20 VanDerWaalsContact O-N 3.14Å; N16-R193 PolarHBondContact O-NH2 2.75Å; N16-E214 PolarHBondContact ND2-O 3.48Å; N16-V216 HydrophobicContact CB-CG2 4.49Å; N16-V216 PolarHBondContact OD1-N 3.41Å
17	G	88.2	Confident	89	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.1	-48.4	173.7	0	0	0	0	0	111.8	M13 I14 E15 L20 G21 H22 R193	M13-G17 PolarHBondContact O-N 3.46Å; I14-G17 PolarHBondContact O-N 3.39Å; I14-G17 VanDerWaalsContact O-N 3.11Å; E15-G17 VanDerWaalsContact C-N 3.34Å; E15-G17 PolarHBondContact O-N 3.1Å; G17-L20 PolarHBondContact O-N 3.14Å; G17-G21 WeakPolarHBondContact O-CA 3.44Å; G17-G21 PolarHBondContact O-N 3.44Å; G17-H22 CarbonylContact C-O 3.59Å; G17-H22 WeakPolarHBondContact CA-O 3.4Å; G17-H22 PolarHBondContact O-N 2.95Å; G17-R193 VanDerWaalsContact CA-NH1 3.28Å
18	V	89	Confident	89.4	Confident	42 Å²	42	29 Å²	29	26%	0.255	14%	0.139	S	C	.	.	H	α-helix	trans	-64	-44.1	178.9	177	0	0	0	0	111.6	I14 E15 G21 L44 T48	I14-V18 WeakPolarHBondContact O-CG2 3.38Å; I14-V18 PolarHBondContact O-N 2.92Å; E15-V18 PolarHBondContact O-N 3.22Å; V18-G21 PolarHBondContact O-N 3.17Å; V18-L44 HydrophobicContact CG2-CD1 3.83Å; V18-T48 HydrophobicContact CG1-CG2 4.05Å; V18-T48 HydrophobicContact CG2-CG2 3.82Å
19	K	87.1	Confident	89.4	Confident	100 Å²	100	24.4 Å²	24.4	44%	0.435	11%	0.113	S	C	.	.	H	α-helix	trans	-64.3	-40.3	179.6	-74.9	172.8	-179.1	173.6	0	113.2	E15	E15-K19 WeakPolarHBondContact O-CB 3.34Å; E15-K19 VanDerWaalsContact O-CG 3.28Å; E15-K19 WeakPolarHBondContact O-CG 3.43Å; E15-K19 PolarHBondContact O-N 3.47Å
20	L	85.3	Confident	89.3	Confident	45 Å²	45	22 Å²	22	24%	0.236	11%	0.108	C	C	.	.	H	α-helix	trans	-87.5	-11.5	-179.2	-70.5	170.1	0	0	0	113.1	N16 G17 H22 V216 A221	N16-L20 WeakPolarHBondContact O-CB 3.24Å; N16-L20 PolarHBondContact O-N 3.48Å; N16-L20 VanDerWaalsContact O-N 3.14Å; G17-L20 PolarHBondContact O-N 3.14Å; L20-H22 VanDerWaalsContact C-N 3.25Å; L20-H22 HydrophobicContact CB-CB 4.49Å; L20-H22 PolarHBondContact O-CD2 2.61Å; L20-H22 PolarHBondContact O-N 3.41Å; L20-V216 HydrophobicContact CD1-CB 4.4Å; L20-V216 HydrophobicContact CD1-CG1 4.25Å; L20-V216 HydrophobicContact CD1-CG2 4.04Å; L20-V216 HydrophobicContact CD2-CG1 4.2Å; L20-V216 HydrophobicContact CG-CG1 4.38Å; L20-A221 HydrophobicContact CD2-CB 3.95Å
21	G	87.6	Confident	88.9	Confident	16 Å²	16	27.3 Å²	27.3	17%	0.165	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	25.3	-172.1	0	0	0	0	0	113.2	G17 V18 G140 Q445	G17-G21 WeakPolarHBondContact O-CA 3.44Å; G17-G21 PolarHBondContact O-N 3.44Å; V18-G21 PolarHBondContact O-N 3.17Å; G21-G140 WeakPolarHBondContact O-CA 3.08Å; G21-Q445 PolarHBondContact O-N 2.96Å
22	H	90.4	Very high	88.6	Confident	22 Å²	22	27.1 Å²	27.1	10%	0.102	14%	0.139	C	C	.	.			trans	-100	150.6	178.3	-68	-161.8	0	0	0	110.2	G17 L20 G141 E446 D449	G17-H22 CarbonylContact C-O 3.59Å; G17-H22 WeakPolarHBondContact CA-O 3.4Å; G17-H22 PolarHBondContact O-N 2.95Å; L20-H22 VanDerWaalsContact C-N 3.25Å; L20-H22 HydrophobicContact CB-CB 4.49Å; L20-H22 PolarHBondContact O-CD2 2.61Å; L20-H22 PolarHBondContact O-N 3.41Å; H22-G141 WeakPolarHBondContact O-CA 3.27Å; H22-G141 PolarHBondContact O-N 3.39Å; H22-E446 PolarHBondContact NE2-O 3.42Å; H22-D449 IonicContact ND1-OD2 3.18Å
23	R	93.8	Very high	88.3	Confident	1 Å²	1	26.8 Å²	26.8	0%	0.004	14%	0.138	C	C	.	.			trans	-76.4	155.6	175.9	-68.9	171.6	-68	-174.8	-7.6	110.5	V135 V138 E139 I144 R193 Y444 D448 I450 E451	R23-V135 PolarHBondContact NH1-O 2.99Å; R23-V138 WeakPolarHBondContact CD-O 3.32Å; R23-V138 HydrophobicContact CG-CB 4.46Å; R23-V138 HydrophobicContact CG-CG1 4.16Å; R23-E139 WeakPolarHBondContact CG-O 3.47Å; R23-I144 HydrophobicContact CB-CD1 4.41Å; R23-R193 WeakPolarHBondContact O-CD 3.31Å; R23-Y444 VanDerWaalsContact CZ-CE1 3.49Å; R23-D448 IonicContact CZ-OD2 3.62Å; R23-D448 PolarHBondContact N-OD1 2.72Å; R23-D448 IonicContact NE-OD2 3.48Å; R23-D448 PolarHBondContact NE-OD2 3.07Å; R23-D448 IonicContact NH2-OD2 3.85Å; R23-D448 PolarHBondContact NH2-OD2 3.49Å; R23-I450 HydrophobicContact CB-CB 4.32Å; R23-I450 HydrophobicContact CB-CD1 3.73Å; R23-I450 HydrophobicContact CB-CG1 4.37Å; R23-I450 WeakPolarHBondContact O-CD1 3.46Å; R23-E451 VanDerWaalsContact NH2-CB 3.29Å
24	T	93.1	Very high	88.1	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	137.8	175	-52.9	0	0	0	0	110.9	M13 F26 G142 L143 I144	M13-T24 HydrophobicContact CB-CG2 4.41Å; M13-T24 HydrophobicContact CG-CG2 3.63Å; T24-F26 HydrophobicContact CG2-CD2 4.34Å; T24-F26 HydrophobicContact CG2-CE2 3.73Å; T24-F26 HydrophobicContact CG2-CZ 4.21Å; T24-G142 PolarHBondContact N-O 3.11Å; T24-L143 HydrophobicContact CG2-CD2 4.44Å; T24-L143 WeakPolarHBondContact O-CA 3.49Å; T24-I144 PolarHBondContact O-N 3.45Å
25	M	93.1	Very high	87.8	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	134.6	-178.2	-176.4	175.5	-69.5	0	0	111.3	V135 I144 L146 L188 R193 C194 L195 I450 W453	M25-V135 HydrophobicContact CE-CG2 4.49Å; M25-I144 CarbonylContact C-O 3.59Å; M25-I144 WeakPolarHBondContact CA-O 3.47Å; M25-I144 HydrophobicContact CE-CB 4.49Å; M25-I144 HydrophobicContact CE-CD1 4.37Å; M25-I144 HydrophobicContact CE-CG2 4.05Å; M25-I144 HydrophobicContact CG-CB 4.47Å; M25-I144 HydrophobicContact CG-CG2 4.43Å; M25-L146 HydrophobicContact CG-CD1 4.39Å; M25-L146 HydrophobicContact SD-CD1 3.9Å; M25-L188 HydrophobicContact SD-CD2 3.59Å; M25-L188 VanDerWaalsContact SD-CD2 3.59Å; M25-R193 PolarHBondContact N-O 3.09Å; M25-C194 HydrophobicContact CB-CB 4.35Å; M25-C194 WeakPolarHBondContact O-CA 3.23Å; M25-L195 PolarHBondContact O-N 2.95Å; M25-I450 HydrophobicContact CB-CD1 3.82Å; M25-I450 HydrophobicContact CE-CG2 4.37Å; M25-W453 HydrophobicContact CE-CE3 4.27Å; M25-W453 HydrophobicContact CE-CH2 3.87Å; M25-W453 HydrophobicContact CE-CZ3 3.54Å; M25-W453 HydrophobicContact SD-CH2 4.32Å; M25-W453 HydrophobicContact SD-CZ3 4.44Å
26	F	92.3	Very high	87.8	Confident	1 Å²	1	30.5 Å²	30.5	0%	0.004	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	133.5	174	-74.6	-80.4	0	0	0	110.3	I10 I14 T24 L40 L143 I144 I145 L146 L195 V197	I10-F26 HydrophobicContact CB-CE1 4.42Å; I10-F26 HydrophobicContact CG1-CE1 4.3Å; I10-F26 HydrophobicContact CG2-CE1 3.87Å; I10-F26 HydrophobicContact CG2-CZ 3.9Å; I14-F26 HydrophobicContact CD1-CE2 3.95Å; I14-F26 HydrophobicContact CD1-CZ 4.03Å; I14-F26 HydrophobicContact CG1-CE2 3.73Å; I14-F26 HydrophobicContact CG1-CZ 3.86Å; T24-F26 HydrophobicContact CG2-CD2 4.34Å; T24-F26 HydrophobicContact CG2-CE2 3.73Å; T24-F26 HydrophobicContact CG2-CZ 4.21Å; F26-L40 HydrophobicContact CB-CD1 4.29Å; F26-L40 HydrophobicContact CG-CD1 4.26Å; F26-L143 HydrophobicContact CD2-CD2 4.28Å; F26-L143 HydrophobicContact CE2-CD2 3.96Å; F26-I144 PolarHBondContact N-O 3.49Å; F26-I145 HydrophobicContact CB-CG1 4.49Å; F26-I145 CarbonylContact O-C 3.54Å; F26-I145 WeakPolarHBondContact O-CA 3.2Å; F26-L146 PolarHBondContact O-N 3.39Å; F26-L195 WeakPolarHBondContact CA-O 3.5Å; F26-L195 HydrophobicContact CD1-CB 3.89Å; F26-L195 HydrophobicContact CE1-CB 3.81Å; F26-L195 HydrophobicContact CE1-CD1 3.75Å; F26-L195 HydrophobicContact CE1-CG 4.36Å; F26-L195 HydrophobicContact CZ-CD1 4.21Å; F26-V197 HydrophobicContact CD1-CG2 4Å; F26-V197 HydrophobicContact CE1-CG2 4.42Å
27	I	90.3	Very high	87.8	Confident	12 Å²	12	30.1 Å²	30.1	6%	0.062	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	113.6	171.1	-57.8	178.4	0	0	0	106.7	I29 L146 L148 L188 L195 V196 V197	I27-I29 HydrophobicContact CG2-CG1 4.32Å; I27-L146 WeakPolarHBondContact CA-O 3.34Å; I27-L146 HydrophobicContact CD1-CD1 4.38Å; I27-L146 HydrophobicContact CG1-CB 4.2Å; I27-L146 HydrophobicContact CG1-CD1 4Å; I27-L148 HydrophobicContact CG2-CD1 3.43Å; I27-L148 VanDerWaalsContact CG2-CD1 3.43Å; I27-L148 HydrophobicContact CG2-CG 4.14Å; I27-L188 HydrophobicContact CD1-CB 4.47Å; I27-L188 HydrophobicContact CD1-CD1 3.63Å; I27-L188 HydrophobicContact CD1-CD2 4.14Å; I27-L188 HydrophobicContact CD1-CG 4.29Å; I27-L195 PolarHBondContact N-O 2.84Å; I27-V196 HydrophobicContact CB-CG1 4.35Å; I27-V196 HydrophobicContact CB-CG2 4.23Å; I27-V196 HydrophobicContact CD1-CG2 4.22Å; I27-V196 HydrophobicContact CG2-CG1 4.37Å; I27-V196 WeakPolarHBondContact O-CA 3.22Å; I27-V197 PolarHBondContact O-N 2.95Å
28	V	89.4	Confident	87.8	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	118.5	-177.5	-169.3	0	0	0	0	108.9	A33 Q36 L40 I145 L146 L147 L148 V197	V28-A33 HydrophobicContact CB-CB 3.99Å; V28-A33 HydrophobicContact CG1-CB 3.53Å; V28-Q36 HydrophobicContact CG1-CB 4.31Å; V28-Q36 HydrophobicContact CG1-CG 4.3Å; V28-L40 HydrophobicContact CG2-CD1 4.32Å; V28-I145 HydrophobicContact CG2-CG2 4.04Å; V28-L146 PolarHBondContact N-O 2.96Å; V28-L147 HydrophobicContact CB-CD2 4.15Å; V28-L147 HydrophobicContact CG2-CD2 4.5Å; V28-L148 PolarHBondContact O-N 2.95Å; V28-V197 CarbonylContact C-O 3.58Å; V28-V197 WeakPolarHBondContact CA-O 3.43Å
29	I	86.9	Confident	87.9	Confident	6 Å²	6	30.6 Å²	30.6	3%	0.031	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	121.2	-176.7	-60.2	171.4	0	0	0	110.2	I27 L148 L151 L154 V196 V197 N198 D199 L204	I27-I29 HydrophobicContact CG2-CG1 4.32Å; I29-L148 HydrophobicContact CD1-CD1 4.33Å; I29-L148 HydrophobicContact CG1-CB 4.11Å; I29-L148 HydrophobicContact CG1-CD1 3.84Å; I29-L151 HydrophobicContact CG2-CB 4.34Å; I29-L151 HydrophobicContact CG2-CD1 4.17Å; I29-L154 HydrophobicContact CD1-CD2 3.49Å; I29-L154 VanDerWaalsContact CD1-CD2 3.49Å; I29-V196 HydrophobicContact CD1-CG1 3.52Å; I29-V196 HydrophobicContact CG1-CG1 4.27Å; I29-V197 PolarHBondContact N-O 3.4Å; I29-N198 CarbonylContact O-C 3.58Å; I29-N198 WeakPolarHBondContact O-CA 3.49Å; I29-D199 PolarHBondContact O-N 2.87Å; I29-L204 HydrophobicContact CD1-CD1 4.06Å
30	G	83.9	Confident	88	Confident	11 Å²	11	25.9 Å²	25.9	11%	0.113	13%	0.133	C	C	.	.	S	Bend	trans	140.1	-176.4	165.8	0	0	0	0	0	113.7	A33 L148 D199	G30-A33 WeakPolarHBondContact O-CB 3.33Å; G30-L148 PolarHBondContact N-O 3.46Å; G30-D199 WeakPolarHBondContact CA-OD1 3.21Å; G30-D199 VanDerWaalsContact CA-OD2 3.23Å; G30-D199 WeakPolarHBondContact CA-OD2 3.48Å; G30-D199 PolarHBondContact N-OD1 3.17Å
31	D	80.1	Confident	88.3	Confident	111 Å²	111	24.4 Å²	24.4	59%	0.594	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-28.4	-172.8	-68.7	-30.6	0	0	0	112.6	T150 D199	D31-T150 VanDerWaalsContact CG-CG2 3.41Å; D31-T150 VanDerWaalsContact OD1-CB 3.25Å; D31-T150 WeakPolarHBondContact OD1-CB 3.3Å; D31-T150 WeakPolarHBondContact OD1-CG2 3.3Å; D31-T150 PolarHBondContact OD1-OG1 3.38Å; D31-T150 WeakPolarHBondContact OD2-CG2 3.47Å; D31-D199 PolarHBondContact N-OD2 2.78Å
32	K	82.4	Confident	88.4	Confident	135 Å²	135	27.1 Å²	27.1	59%	0.587	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.5	17.1	178.4	-62.6	-173.9	-179.1	-179.7	0	113	R34 D35 D199	K32-R34 PolarHBondContact O-N 3.44Å; K32-R34 VanDerWaalsContact O-N 3.09Å; K32-D35 PolarHBondContact O-N 3.24Å; K32-D199 HydrophobicContact CB-CB 4.42Å; K32-D199 PolarHBondContact N-OD1 3.05Å; K32-D199 PolarHBondContact N-OD2 2.65Å
33	A	83.1	Confident	88.3	Confident	4 Å²	4	27.2 Å²	27.2	3%	0.033	14%	0.136	C	C	.	.	H	α-helix	trans	-55.2	-32	-179.4	0	0	0	0	0	113	V28 G30 D35 Q36 L147 D199	V28-A33 HydrophobicContact CB-CB 3.99Å; V28-A33 HydrophobicContact CG1-CB 3.53Å; G30-A33 WeakPolarHBondContact O-CB 3.33Å; A33-D35 PolarHBondContact O-N 2.61Å; A33-Q36 WeakPolarHBondContact O-CB 3.47Å; A33-Q36 PolarHBondContact O-N 2.95Å; A33-L147 HydrophobicContact CB-CD2 4.06Å; A33-D199 WeakPolarHBondContact CA-OD1 3.48Å; A33-D199 PolarHBondContact N-OD1 2.8Å
34	R	84.5	Confident	88.1	Confident	48 Å²	48	27.3 Å²	27.3	18%	0.181	14%	0.137	C	C	.	.	H	α-helix	trans	-61.8	-40.1	177.1	179.2	178.2	169.1	-175.9	-14.6	113.1	K32 Q36 V37 P38 W57 D63 F90	K32-R34 PolarHBondContact O-N 3.44Å; K32-R34 VanDerWaalsContact O-N 3.09Å; R34-Q36 PolarHBondContact O-N 3.3Å; R34-V37 WeakPolarHBondContact O-CB 3.42Å; R34-V37 PolarHBondContact O-N 2.77Å; R34-P38 WeakPolarHBondContact O-CD 3.48Å; R34-W57 HydrophobicContact CG-CH2 4.22Å; R34-W57 HydrophobicContact CG-CZ2 4.47Å; R34-D63 IonicContact CZ-OD1 3.64Å; R34-D63 IonicContact CZ-OD2 3Å; R34-D63 IonicContact NH1-OD1 2.83Å; R34-D63 PolarHBondContact NH1-OD1 3.47Å; R34-D63 IonicContact NH1-OD2 2.54Å; R34-D63 PolarHBondContact NH1-OD2 2.99Å; R34-F90 HydrophobicContact CG-CD2 3.81Å; R34-F90 HydrophobicContact CG-CE2 3.46Å; R34-F90 VanDerWaalsContact CG-CE2 3.46Å; R34-F90 HydrophobicContact CG-CZ 3.93Å; R34-F90 VanDerWaalsContact CZ-CE1 3.48Å; R34-F90 WeakPolarHBondContact O-CD2 3.29Å
35	D	85.4	Confident	87.9	Confident	50 Å²	50	29 Å²	29	27%	0.267	15%	0.147	S	C	.	.	H	α-helix	trans	-72.9	-14.5	-176.1	-56.2	-20.2	0	0	0	111.5	K32 A33 P38	K32-D35 PolarHBondContact O-N 3.24Å; A33-D35 PolarHBondContact O-N 2.61Å; D35-P38 WeakPolarHBondContact O-CD 3.37Å
36	Q	88	Confident	87.6	Confident	28 Å²	28	36.3 Å²	36.3	13%	0.131	18%	0.179	C	C	.	.	H	α-helix	trans	-82.4	-21.1	176	-51.3	-46.1	-45.4	0	0	113.2	V28 A33 R34 I39 L40 D199 L201	V28-Q36 HydrophobicContact CG1-CB 4.31Å; V28-Q36 HydrophobicContact CG1-CG 4.3Å; A33-Q36 WeakPolarHBondContact O-CB 3.47Å; A33-Q36 PolarHBondContact O-N 2.95Å; R34-Q36 PolarHBondContact O-N 3.3Å; Q36-I39 PolarHBondContact O-N 3.26Å; Q36-I39 VanDerWaalsContact O-N 3.14Å; Q36-L40 PolarHBondContact O-N 3.48Å; Q36-L40 VanDerWaalsContact O-N 3.14Å; Q36-D199 WeakPolarHBondContact CG-O 3.33Å; Q36-D199 PolarHBondContact NE2-O 2.84Å; Q36-L201 HydrophobicContact CB-CD2 4.03Å; Q36-L201 HydrophobicContact CB-CG 4.41Å; Q36-L201 HydrophobicContact CG-CD2 4.34Å; Q36-L201 HydrophobicContact CG-CG 4.36Å
37	V	89.7	Confident	87.3	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59.2	-46.6	179.3	178.4	0	0	0	0	112.4	R34 I39 L40 Y41 W57 F93 V119 I145 L147	R34-V37 WeakPolarHBondContact O-CB 3.42Å; R34-V37 PolarHBondContact O-N 2.77Å; V37-I39 VanDerWaalsContact C-N 3.26Å; V37-I39 PolarHBondContact O-N 2.93Å; V37-L40 PolarHBondContact O-N 3.15Å; V37-Y41 WeakPolarHBondContact O-CB 3.49Å; V37-Y41 PolarHBondContact O-N 3.34Å; V37-W57 HydrophobicContact CB-CH2 4.45Å; V37-W57 HydrophobicContact CB-CZ3 4.43Å; V37-W57 HydrophobicContact CG1-CH2 4.44Å; V37-W57 HydrophobicContact CG1-CZ3 3.96Å; V37-W57 HydrophobicContact CG2-CH2 4.19Å; V37-F93 HydrophobicContact CG1-CE1 4.48Å; V37-F93 HydrophobicContact CG1-CZ 4.39Å; V37-V119 HydrophobicContact CG1-CG2 3.89Å; V37-V119 HydrophobicContact CG2-CG1 4.44Å; V37-I145 HydrophobicContact CG1-CD1 4.04Å; V37-I145 HydrophobicContact CG2-CD1 4.48Å; V37-I145 HydrophobicContact CG2-CG2 4.28Å; V37-L147 HydrophobicContact CG2-CD2 4.01Å
38	P	89.3	Confident	86.8	Confident	8 Å²	8	38.6 Å²	38.6	5%	0.052	20%	0.195	C	C	.	.	H	α-helix	trans	-53.9	-38.9	172.8	-28.8	35.1	0	0	0	114.3	R34 D35 Y41 D42 L89 F90 F93	R34-P38 WeakPolarHBondContact O-CD 3.48Å; D35-P38 WeakPolarHBondContact O-CD 3.37Å; P38-Y41 PolarHBondContact O-N 3.37Å; P38-D42 WeakPolarHBondContact O-CB 3.47Å; P38-D42 PolarHBondContact O-N 2.89Å; P38-L89 HydrophobicContact CB-CB 4.46Å; P38-F90 HydrophobicContact CG-CB 4.32Å; P38-F90 HydrophobicContact CG-CD2 3.76Å; P38-F90 HydrophobicContact CG-CG 4.44Å; P38-F93 HydrophobicContact CB-CB 3.91Å; P38-F93 HydrophobicContact CB-CG 4.2Å; P38-F93 HydrophobicContact CG-CB 3.83Å; P38-F93 HydrophobicContact CG-CD1 4.18Å; P38-F93 HydrophobicContact CG-CG 4.02Å
39	I	89.6	Confident	85.7	Confident	44 Å²	44	46 Å²	46	23%	0.226	24%	0.24	C	C	.	.	H	α-helix	trans	-69.3	-46.6	-177.6	-64	163.9	0	0	0	110.2	I6 Q36 V37 Y41 D42 I43 L201	I6-I39 HydrophobicContact CD1-CG2 3.89Å; Q36-I39 PolarHBondContact O-N 3.26Å; Q36-I39 VanDerWaalsContact O-N 3.14Å; V37-I39 VanDerWaalsContact C-N 3.26Å; V37-I39 PolarHBondContact O-N 2.93Å; I39-Y41 VanDerWaalsContact C-N 3.29Å; I39-Y41 PolarHBondContact O-N 3.24Å; I39-D42 PolarHBondContact O-N 3.48Å; I39-I43 HydrophobicContact CG2-CD1 4.22Å; I39-I43 WeakPolarHBondContact O-CG1 3.39Å; I39-I43 PolarHBondContact O-N 2.65Å; I39-L201 HydrophobicContact CB-CD1 4.13Å; I39-L201 HydrophobicContact CD1-CD1 4.08Å; I39-L201 HydrophobicContact CG2-CD1 3.6Å
40	L	90.3	Very high	84.9	Confident	1 Å²	1	54 Å²	54	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-61.3	-39.7	175.4	-65.8	175.5	0	0	0	111.7	I10 I14 F26 V28 Q36 V37 I43 L44 L143 I145 L201	I10-L40 HydrophobicContact CG2-CD2 3.7Å; I14-L40 HydrophobicContact CD1-CD2 4.39Å; F26-L40 HydrophobicContact CB-CD1 4.29Å; F26-L40 HydrophobicContact CG-CD1 4.26Å; V28-L40 HydrophobicContact CG2-CD1 4.32Å; Q36-L40 PolarHBondContact O-N 3.48Å; Q36-L40 VanDerWaalsContact O-N 3.14Å; V37-L40 PolarHBondContact O-N 3.15Å; L40-I43 PolarHBondContact O-N 2.87Å; L40-L44 PolarHBondContact O-N 2.8Å; L40-L143 HydrophobicContact CB-CD1 4.38Å; L40-I145 HydrophobicContact CB-CD1 4.32Å; L40-I145 HydrophobicContact CD1-CD1 3.98Å; L40-I145 HydrophobicContact CD1-CG1 4.36Å; L40-L201 HydrophobicContact CD2-CD2 4.34Å
41	Y	90.8	Very high	84.4	Confident	13 Å²	13	57.9 Å²	57.9	5%	0.051	31%	0.305	C	S	.	.	H	α-helix	trans	-65.3	-39.6	176.5	-179.6	-87.6	0	0	0	112.8	V37 P38 I39 L44 T45 P53 V55 F93 T97 V117	V37-Y41 WeakPolarHBondContact O-CB 3.49Å; V37-Y41 PolarHBondContact O-N 3.34Å; P38-Y41 PolarHBondContact O-N 3.37Å; I39-Y41 VanDerWaalsContact C-N 3.29Å; I39-Y41 PolarHBondContact O-N 3.24Å; Y41-L44 PolarHBondContact O-N 3.4Å; Y41-T45 VanDerWaalsContact CE1-OG1 3.3Å; Y41-T45 WeakPolarHBondContact CE1-OG1 3.34Å; Y41-T45 WeakPolarHBondContact O-CB 3.49Å; Y41-T45 PolarHBondContact O-N 3.43Å; Y41-T45 PolarHBondContact O-OG1 3.4Å; Y41-P53 HydrophobicContact CE2-CG 3.73Å; Y41-P53 PolarHBondContact OH-O 2.88Å; Y41-V55 HydrophobicContact CD2-CG2 3.95Å; Y41-V55 HydrophobicContact CE2-CG2 3.61Å; Y41-F93 AromaticContact CD1-CD2 3.9Å; Y41-F93 HydrophobicContact CD1-CD2 3.9Å; Y41-F93 AromaticContact CD1-CE2 3.72Å; Y41-F93 HydrophobicContact CD1-CE2 3.72Å; Y41-F93 AromaticContact CD2-CE2 3.71Å; Y41-F93 HydrophobicContact CD2-CE2 3.71Å; Y41-F93 HydrophobicContact CD2-CZ 4.44Å; Y41-F93 HydrophobicContact CE1-CD2 4.42Å; Y41-F93 HydrophobicContact CE1-CE2 4.2Å; Y41-F93 HydrophobicContact CE2-CE2 4.16Å; Y41-F93 HydrophobicContact CG-CD2 4.07Å; Y41-F93 AromaticContact CG-CE2 3.47Å; Y41-F93 HydrophobicContact CG-CE2 3.47Å; Y41-F93 VanDerWaalsContact CG-CE2 3.47Å; Y41-F93 HydrophobicContact CG-CZ 4.48Å; Y41-T97 HydrophobicContact CD1-CG2 4.23Å; Y41-T97 HydrophobicContact CE1-CG2 3.46Å; Y41-T97 VanDerWaalsContact CE1-CG2 3.46Å; Y41-T97 HydrophobicContact CE2-CG2 4.31Å; Y41-V117 HydrophobicContact CD2-CG2 3.94Å; Y41-V117 HydrophobicContact CE2-CG2 4.35Å
42	D	89.1	Confident	84.3	Confident	73 Å²	73	60.2 Å²	60.2	39%	0.39	31%	0.306	S	S	.	.	H	α-helix	trans	-66.5	-40	176.4	-175.2	54.2	0	0	0	111.6	P38 I39 L44 T45 K46	P38-D42 WeakPolarHBondContact O-CB 3.47Å; P38-D42 PolarHBondContact O-N 2.89Å; I39-D42 PolarHBondContact O-N 3.48Å; D42-L44 VanDerWaalsContact C-N 3.34Å; D42-L44 PolarHBondContact O-N 2.76Å; D42-T45 PolarHBondContact O-N 3.23Å; D42-K46 WeakPolarHBondContact O-CB 3.03Å; D42-K46 WeakPolarHBondContact O-CG 3.39Å; D42-K46 PolarHBondContact O-N 3.4Å; D42-K46 IonicContact OD1-NZ 2.84Å; D42-K46 WeakPolarHBondContact OD2-CE 3.19Å; D42-K46 IonicContact OD2-NZ 3.01Å; D42-K46 PolarHBondContact OD2-NZ 2.75Å
43	I	89.1	Confident	84.5	Confident	24 Å²	24	54.3 Å²	54.3	12%	0.123	28%	0.281	C	S	.	.	H	α-helix	trans	-61.1	-43.7	173.8	-63.8	165.3	0	0	0	110.8	I10 R11 I14 I39 L40 K46 S47	I10-I43 HydrophobicContact CG2-CD1 4.43Å; R11-I43 HydrophobicContact CG-CG2 4.42Å; I14-I43 HydrophobicContact CB-CG2 4.31Å; I14-I43 HydrophobicContact CD1-CB 4.08Å; I14-I43 HydrophobicContact CD1-CG2 3.67Å; I14-I43 HydrophobicContact CG2-CG2 4.31Å; I39-I43 HydrophobicContact CG2-CD1 4.22Å; I39-I43 WeakPolarHBondContact O-CG1 3.39Å; I39-I43 PolarHBondContact O-N 2.65Å; L40-I43 PolarHBondContact O-N 2.87Å; I43-K46 PolarHBondContact O-N 2.67Å; I43-S47 WeakPolarHBondContact O-CB 3.45Å; I43-S47 PolarHBondContact O-N 3.36Å; I43-S47 VanDerWaalsContact O-N 3.15Å; I43-S47 PolarHBondContact O-OG 3.5Å
44	L	89.7	Confident	84.8	Confident	3 Å²	3	56.3 Å²	56.3	2%	0.016	29%	0.293	C	S	.	.	H	α-helix	trans	-60.4	-50.7	175.2	178.3	67.9	0	0	0	111.2	I14 V18 L40 Y41 D42 K46 S47 T48 P53 V117 G141 L143	I14-L44 HydrophobicContact CG2-CB 4.24Å; I14-L44 HydrophobicContact CG2-CD1 3.92Å; V18-L44 HydrophobicContact CG2-CD1 3.83Å; L40-L44 PolarHBondContact O-N 2.8Å; Y41-L44 PolarHBondContact O-N 3.4Å; D42-L44 VanDerWaalsContact C-N 3.34Å; D42-L44 PolarHBondContact O-N 2.76Å; L44-K46 VanDerWaalsContact C-N 3.25Å; L44-K46 PolarHBondContact O-N 3.06Å; L44-S47 CarbonylContact O-C 3.53Å; L44-S47 WeakPolarHBondContact O-CA 3.38Å; L44-S47 WeakPolarHBondContact O-CB 3.35Å; L44-S47 PolarHBondContact O-N 2.92Å; L44-T48 HydrophobicContact CD1-CG2 3.9Å; L44-T48 HydrophobicContact CG-CG2 4.21Å; L44-T48 WeakPolarHBondContact O-CG2 3.44Å; L44-T48 PolarHBondContact O-N 3.49Å; L44-T48 PolarHBondContact O-OG1 3.48Å; L44-P53 HydrophobicContact CD2-CB 4.44Å; L44-P53 HydrophobicContact CD2-CG 3.81Å; L44-P53 HydrophobicContact CG-CG 4.47Å; L44-V117 HydrophobicContact CD2-CG2 3.51Å; L44-G141 WeakPolarHBondContact CD1-O 3.27Å; L44-L143 HydrophobicContact CB-CD1 3.91Å; L44-L143 HydrophobicContact CB-CG 4.49Å; L44-L143 HydrophobicContact CD1-CG 4.28Å; L44-L143 HydrophobicContact CD2-CD1 4.12Å; L44-L143 HydrophobicContact CD2-CG 4.01Å; L44-L143 HydrophobicContact CG-CD1 4.42Å; L44-L143 HydrophobicContact CG-CG 4.49Å
45	T	88.4	Confident	85.2	Confident	35 Å²	35	54 Å²	54	22%	0.215	28%	0.284	C	S	.	.	H	α-helix	trans	-59.8	-37.6	-177.5	-56.1	0	0	0	0	111.7	Y41 D42 S47 T48 R52	Y41-T45 VanDerWaalsContact CE1-OG1 3.3Å; Y41-T45 WeakPolarHBondContact CE1-OG1 3.34Å; Y41-T45 WeakPolarHBondContact O-CB 3.49Å; Y41-T45 PolarHBondContact O-N 3.43Å; Y41-T45 PolarHBondContact O-OG1 3.4Å; D42-T45 PolarHBondContact O-N 3.23Å; T45-S47 VanDerWaalsContact C-N 3.31Å; T45-T48 VanDerWaalsContact O-O 3.14Å; T45-T48 PolarHBondContact O-OG1 3.28Å; T45-R52 HydrophobicContact CG2-CG 4.27Å
46	K	88	Confident	85.5	Confident	155 Å²	155	51.6 Å²	51.6	67%	0.674	27%	0.271	S	S	*	.	H	α-helix	trans	-68.6	-28.3	174.6	-74.9	169.4	176.2	165.6	0	113.5	D42 I43 L44	D42-K46 WeakPolarHBondContact O-CB 3.03Å; D42-K46 WeakPolarHBondContact O-CG 3.39Å; D42-K46 PolarHBondContact O-N 3.4Å; D42-K46 IonicContact OD1-NZ 2.84Å; D42-K46 WeakPolarHBondContact OD2-CE 3.19Å; D42-K46 IonicContact OD2-NZ 3.01Å; D42-K46 PolarHBondContact OD2-NZ 2.75Å; I43-K46 PolarHBondContact O-N 2.67Å; L44-K46 VanDerWaalsContact C-N 3.25Å; L44-K46 PolarHBondContact O-N 3.06Å
47	S	84.4	Confident	85.7	Confident	30 Å²	30	50.3 Å²	50.3	21%	0.21	27%	0.265	C	S	.	.	H	α-helix	trans	-86	-25.1	-179.3	-53.8	0	0	0	0	112.4	I43 L44 T45	I43-S47 WeakPolarHBondContact O-CB 3.45Å; I43-S47 PolarHBondContact O-N 3.36Å; I43-S47 VanDerWaalsContact O-N 3.15Å; I43-S47 PolarHBondContact O-OG 3.5Å; L44-S47 CarbonylContact O-C 3.53Å; L44-S47 WeakPolarHBondContact O-CA 3.38Å; L44-S47 WeakPolarHBondContact O-CB 3.35Å; L44-S47 PolarHBondContact O-N 2.92Å; T45-S47 VanDerWaalsContact C-N 3.31Å
48	T	80.7	Confident	85.7	Confident	32 Å²	32	50.3 Å²	50.3	20%	0.196	27%	0.265	C	S	.	.			trans	-92.9	131.8	-179.4	56.5	0	0	0	0	112.1	V18 L44 T45 K50	V18-T48 HydrophobicContact CG1-CG2 4.05Å; V18-T48 HydrophobicContact CG2-CG2 3.82Å; L44-T48 HydrophobicContact CD1-CG2 3.9Å; L44-T48 HydrophobicContact CG-CG2 4.21Å; L44-T48 WeakPolarHBondContact O-CG2 3.44Å; L44-T48 PolarHBondContact O-N 3.49Å; L44-T48 PolarHBondContact O-OG1 3.48Å; T45-T48 VanDerWaalsContact O-O 3.14Å; T45-T48 PolarHBondContact O-OG1 3.28Å; T48-K50 VanDerWaalsContact C-N 3.3Å
49	V	65.5	Low	85.7	Confident	155 Å²	155	50.3 Å²	50.3	94%	0.939	26%	0.264	S	S	*	.			trans	-83.9	-6.8	174.6	-173.5	0	0	0	0	112.3
50	K	71.1	Confident	85.4	Confident	175 Å²	175	52.1 Å²	52.1	76%	0.761	27%	0.271	S	S	*	.	S	Bend	trans	-84.8	174.5	-176.4	-70.8	-177.3	-179.4	173.5	0	112.8	T48	T48-K50 VanDerWaalsContact C-N 3.3Å
51	A	72.3	Confident	84.9	Confident	92 Å²	92	57.7 Å²	57.7	76%	0.76	30%	0.3	S	S	*	.	S	Bend	trans	-52.1	151	169	0	0	0	0	0	111.7
52	R	79.9	Confident	83.9	Confident	160 Å²	160	60.6 Å²	60.6	60%	0.604	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-53.8	127.7	-178.6	-77.1	-173.6	175.6	-175.6	-0.5	111.1	T45 A96	T45-R52 HydrophobicContact CG2-CG 4.27Å; R52-A96 PolarHBondContact NH1-O 2.89Å
53	P	84.7	Confident	82.8	Confident	10 Å²	10	58.9 Å²	58.9	7%	0.065	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-67.3	141.8	-175.9	21.3	-27.4	0	0	0	112	Y41 L44	Y41-P53 HydrophobicContact CE2-CG 3.73Å; Y41-P53 PolarHBondContact OH-O 2.88Å; L44-P53 HydrophobicContact CD2-CB 4.44Å; L44-P53 HydrophobicContact CD2-CG 3.81Å; L44-P53 HydrophobicContact CG-CG 4.47Å
54	T	90.7	Very high	81.2	Confident	46 Å²	46	65.8 Å²	65.8	28%	0.282	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-76.8	147.8	173.8	58.1	0	0	0	0	110.7	G116 V117	T54-G116 PolarHBondContact O-N 3.15Å; T54-V117 PolarHBondContact O-N 3.4Å
55	V	91.6	Very high	79.6	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	124.9	-175.9	-176.4	0	0	0	0	110.1	Y41 F93 T98 I99 H100 V117 V119	Y41-V55 HydrophobicContact CD2-CG2 3.95Å; Y41-V55 HydrophobicContact CE2-CG2 3.61Å; V55-F93 HydrophobicContact CG1-CZ 4.3Å; V55-F93 HydrophobicContact CG2-CE2 4.25Å; V55-F93 HydrophobicContact CG2-CZ 3.94Å; V55-T98 PolarHBondContact N-O 3.2Å; V55-T98 VanDerWaalsContact N-O 3.15Å; V55-I99 HydrophobicContact CB-CG1 4.22Å; V55-I99 WeakPolarHBondContact O-CA 3.34Å; V55-H100 PolarHBondContact O-N 3.06Å; V55-V117 CarbonylContact C-O 3.54Å; V55-V117 WeakPolarHBondContact CA-O 3.39Å; V55-V117 HydrophobicContact CG1-CB 4.45Å; V55-V117 HydrophobicContact CG1-CG1 4.46Å; V55-V117 HydrophobicContact CG2-CB 4.27Å; V55-V119 HydrophobicContact CG1-CG2 4.29Å
56	L	92.2	Very high	78.2	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	122.5	166.9	175.8	66.9	0	0	0	108.8	R102 V110 Y115 V117 C118 V119	L56-R102 HydrophobicContact CD1-CG 4.22Å; L56-V110 HydrophobicContact CD1-CG1 4.01Å; L56-V110 HydrophobicContact CD1-CG2 4.06Å; L56-V110 HydrophobicContact CD2-CG1 3.6Å; L56-V110 HydrophobicContact CG-CG1 4.46Å; L56-Y115 HydrophobicContact CB-CD1 3.78Å; L56-Y115 HydrophobicContact CB-CD2 4Å; L56-Y115 HydrophobicContact CB-CE1 4.12Å; L56-Y115 HydrophobicContact CB-CE2 4.37Å; L56-Y115 HydrophobicContact CB-CG 3.71Å; L56-Y115 HydrophobicContact CD1-CE1 4.5Å; L56-Y115 HydrophobicContact CD1-CE2 4.31Å; L56-Y115 HydrophobicContact CD2-CD2 4.15Å; L56-Y115 HydrophobicContact CD2-CE2 4.34Å; L56-V117 PolarHBondContact N-O 2.9Å; L56-C118 CarbonylContact O-C 3.56Å; L56-C118 WeakPolarHBondContact O-CA 3.26Å; L56-V119 PolarHBondContact O-N 3.12Å
57	W	91.8	Very high	76.7	Confident	1 Å²	1	59.8 Å²	59.8	0%	0.004	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	115.4	175.9	-161.7	-58.7	0	0	0	110	R34 V37 Y59 I66 F90 F93 I99 H100 G101 R102 V119 L147	R34-W57 HydrophobicContact CG-CH2 4.22Å; R34-W57 HydrophobicContact CG-CZ2 4.47Å; V37-W57 HydrophobicContact CB-CH2 4.45Å; V37-W57 HydrophobicContact CB-CZ3 4.43Å; V37-W57 HydrophobicContact CG1-CH2 4.44Å; V37-W57 HydrophobicContact CG1-CZ3 3.96Å; V37-W57 HydrophobicContact CG2-CH2 4.19Å; W57-Y59 AromaticContact CD1-CD1 3.76Å; W57-I66 HydrophobicContact CD2-CD1 3.65Å; W57-I66 HydrophobicContact CE3-CD1 4.44Å; W57-I66 HydrophobicContact CG-CD1 3.85Å; W57-I66 HydrophobicContact CZ2-CD1 3.79Å; W57-F90 AromaticContact CH2-CE2 3.56Å; W57-F90 HydrophobicContact CH2-CE2 3.56Å; W57-F90 AromaticContact CH2-CZ 3.52Å; W57-F90 HydrophobicContact CH2-CZ 3.52Å; W57-F90 HydrophobicContact CZ2-CZ 4.27Å; W57-F90 AromaticContact CZ3-CE2 3.83Å; W57-F90 HydrophobicContact CZ3-CE2 3.83Å; W57-F90 AromaticContact CZ3-CZ 3.71Å; W57-F90 HydrophobicContact CZ3-CZ 3.71Å; W57-F93 HydrophobicContact CZ3-CE1 4.28Å; W57-I99 HydrophobicContact CB-CG2 3.88Å; W57-H100 PolarHBondContact N-O 2.91Å; W57-G101 CarbonylContact O-C 3.47Å; W57-G101 WeakPolarHBondContact O-CA 3.07Å; W57-R102 PolarHBondContact O-N 3.27Å; W57-V119 HydrophobicContact CD2-CB 3.9Å; W57-V119 HydrophobicContact CD2-CG1 3.94Å; W57-V119 HydrophobicContact CD2-CG2 4.4Å; W57-V119 HydrophobicContact CE3-CB 3.88Å; W57-V119 HydrophobicContact CE3-CG1 4.03Å; W57-V119 HydrophobicContact CE3-CG2 3.85Å; W57-V119 HydrophobicContact CG-CB 4.3Å; W57-V119 HydrophobicContact CH2-CG1 3.87Å; W57-V119 HydrophobicContact CZ2-CG1 3.8Å; W57-V119 HydrophobicContact CZ3-CB 4.23Å; W57-V119 HydrophobicContact CZ3-CG1 4Å; W57-V119 HydrophobicContact CZ3-CG2 3.99Å; W57-L147 HydrophobicContact CZ2-CD1 4.11Å
58	C	90.2	Very high	75.2	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	132.9	-179.3	-62	0	0	0	0	111.5	R102 Y104 V119 L120 Q121	C58-R102 WeakPolarHBondContact CA-O 3.49Å; C58-Y104 HydrophobicContact CB-CD1 3.71Å; C58-Y104 HydrophobicContact CB-CE1 3.39Å; C58-V119 PolarHBondContact N-O 3.15Å; C58-L120 HydrophobicContact CB-CD2 3.97Å; C58-Q121 WeakPolarHBondContact O-CB 3.09Å; C58-Q121 PolarHBondContact O-N 3.26Å; C58-Q121 VanDerWaalsContact O-N 3.14Å
59	Y	88.8	Confident	73.6	Confident	8 Å²	8	68.8 Å²	68.8	3%	0.031	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	155.9	-177.2	51.3	-107	0	0	0	111.7	W57 K62 I66 R102 Y103 Y104	W57-Y59 AromaticContact CD1-CD1 3.76Å; Y59-K62 HydrophobicContact CD2-CB 4.08Å; Y59-K62 HydrophobicContact CD2-CG 4.5Å; Y59-K62 HydrophobicContact CE1-CG 4.4Å; Y59-K62 HydrophobicContact CE2-CB 3.57Å; Y59-K62 HydrophobicContact CE2-CD 4.41Å; Y59-K62 HydrophobicContact CE2-CG 3.73Å; Y59-I66 HydrophobicContact CE1-CG2 4.22Å; Y59-R102 PolarHBondContact N-O 3.41Å; Y59-Y103 AromaticContact CD2-CD1 3.83Å; Y59-Y103 HydrophobicContact CD2-CD1 3.83Å; Y59-Y103 AromaticContact CD2-CE1 3.95Å; Y59-Y103 HydrophobicContact CD2-CE1 3.95Å; Y59-Y103 AromaticContact CE2-CD1 3.57Å; Y59-Y103 HydrophobicContact CE2-CD1 3.57Å; Y59-Y103 HydrophobicContact CE2-CD2 4.4Å; Y59-Y103 AromaticContact CE2-CE1 3.46Å; Y59-Y103 HydrophobicContact CE2-CE1 3.46Å; Y59-Y103 VanDerWaalsContact CE2-CE1 3.46Å; Y59-Y103 HydrophobicContact CE2-CE2 4.31Å; Y59-Y103 HydrophobicContact CE2-CG 4.06Å; Y59-Y103 AromaticContact CE2-CZ 3.85Å; Y59-Y103 WeakPolarHBondContact O-CA 3.3Å; Y59-Y104 VanDerWaalsContact C-CD2 3.47Å; Y59-Y104 PolarHBondContact O-N 3.14Å; Y59-Y104 VanDerWaalsContact O-N 3.1Å
60	K	83.9	Confident	72.9	Confident	82 Å²	82	62.1 Å²	62.1	36%	0.357	32%	0.317	S	S	.	.	S	Bend	trans	-82.6	-59.6	168.4	-179.8	-176.9	176.5	-180	0	110.1	Y103 Y104 D122 A125 D163	K60-Y103 WeakPolarHBondContact O-CD1 3.3Å; K60-Y104 HydrophobicContact CB-CD2 3.85Å; K60-Y104 HydrophobicContact CB-CE2 4.12Å; K60-D122 WeakPolarHBondContact CB-OD2 3.44Å; K60-D122 PolarHBondContact N-OD2 2.96Å; K60-A125 HydrophobicContact CB-CB 4.37Å; K60-A125 HydrophobicContact CD-CB 4.28Å; K60-D163 WeakPolarHBondContact CD-OD2 3.4Å; K60-D163 VanDerWaalsContact CE-OD2 3.22Å; K60-D163 WeakPolarHBondContact CE-OD2 3.07Å; K60-D163 IonicContact NZ-OD1 3.9Å; K60-D163 PolarHBondContact NZ-OD1 2.95Å; K60-D163 IonicContact NZ-OD2 3.6Å; K60-D163 PolarHBondContact NZ-OD2 2.98Å
61	N	79.6	Confident	72.1	Confident	117 Å²	117	62 Å²	62	63%	0.626	32%	0.316	S	S	*	.	S	Bend	trans	-100.3	128.6	175.2	-68.2	-18.4	0	0	0	108	D63	N61-D63 PolarHBondContact O-N 3.23Å; N61-D63 VanDerWaalsContact O-N 3.08Å
62	K	70.4	Confident	71.3	Confident	74 Å²	74	64.1 Å²	64.1	32%	0.322	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-64.7	116.5	179.1	-169.9	174.6	-168.6	-169.3	0	108.7	Y59 Y103	Y59-K62 HydrophobicContact CD2-CB 4.08Å; Y59-K62 HydrophobicContact CD2-CG 4.5Å; Y59-K62 HydrophobicContact CE1-CG 4.4Å; Y59-K62 HydrophobicContact CE2-CB 3.57Å; Y59-K62 HydrophobicContact CE2-CD 4.41Å; Y59-K62 HydrophobicContact CE2-CG 3.73Å; K62-Y103 HydrophobicContact CB-CE1 4.15Å
63	D	65.6	Low	70	Confident	37 Å²	37	63 Å²	63	20%	0.198	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-57.5	144.2	171.6	-160.5	-48.1	0	0	0	109.4	R34 N61 A65 I66 S67 Q121	R34-D63 IonicContact CZ-OD1 3.64Å; R34-D63 IonicContact CZ-OD2 3Å; R34-D63 IonicContact NH1-OD1 2.83Å; R34-D63 PolarHBondContact NH1-OD1 3.47Å; R34-D63 IonicContact NH1-OD2 2.54Å; R34-D63 PolarHBondContact NH1-OD2 2.99Å; N61-D63 PolarHBondContact O-N 3.23Å; N61-D63 VanDerWaalsContact O-N 3.08Å; D63-A65 CarbonylContact C-O 3.48Å; D63-A65 WeakPolarHBondContact CB-O 3.49Å; D63-A65 PolarHBondContact OD1-N 3.43Å; D63-I66 HydrophobicContact CB-CD1 4Å; D63-I66 HydrophobicContact CB-CG1 4.33Å; D63-S67 PolarHBondContact O-N 2.97Å; D63-Q121 PolarHBondContact OD2-NE2 3.04Å
64	E	56	Low	68.6	Low	169 Å²	169	64.3 Å²	64.3	79%	0.79	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-37.4	-177.5	-69.4	-167.7	156.3	0	0	111.9	S67	E64-S67 VanDerWaalsContact O-CB 3.24Å; E64-S67 WeakPolarHBondContact O-CB 3.36Å; E64-S67 PolarHBondContact O-N 3.47Å
65	A	55	Low	67.1	Low	19 Å²	19	69.7 Å²	69.7	16%	0.157	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	163.3	156.2	0	0	0	0	0	106.8	D63 S67	D63-A65 CarbonylContact C-O 3.48Å; D63-A65 WeakPolarHBondContact CB-O 3.49Å; D63-A65 PolarHBondContact OD1-N 3.43Å; A65-S67 PolarHBondContact O-N 3.43Å
66	I	59.8	Low	65.4	Low	22 Å²	22	76.1 Å²	76.1	11%	0.113	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.8	-38.7	-151.8	-42.9	174.3	0	0	0	114.3	W57 Y59 D63 F90 R94	W57-I66 HydrophobicContact CD2-CD1 3.65Å; W57-I66 HydrophobicContact CE3-CD1 4.44Å; W57-I66 HydrophobicContact CG-CD1 3.85Å; W57-I66 HydrophobicContact CZ2-CD1 3.79Å; Y59-I66 HydrophobicContact CE1-CG2 4.22Å; D63-I66 HydrophobicContact CB-CD1 4Å; D63-I66 HydrophobicContact CB-CG1 4.33Å; I66-F90 HydrophobicContact CG1-CE1 4.44Å; I66-R94 VanDerWaalsContact C-NH2 3.27Å; I66-R94 VanDerWaalsContact N-NH1 3.17Å; I66-R94 PolarHBondContact O-NH2 3.37Å
67	S	57.2	Low	63.8	Low	26 Å²	26	79 Å²	79	18%	0.182	38%	0.379	C	S	.	.	S	Bend	trans	-62.1	156.1	173.6	-165.5	0	0	0	0	114.1	D63 E64 A65 H69 G70 R94	D63-S67 PolarHBondContact O-N 2.97Å; E64-S67 VanDerWaalsContact O-CB 3.24Å; E64-S67 WeakPolarHBondContact O-CB 3.36Å; E64-S67 PolarHBondContact O-N 3.47Å; A65-S67 PolarHBondContact O-N 3.43Å; S67-H69 PolarHBondContact O-N 2.9Å; S67-G70 PolarHBondContact O-N 2.79Å; S67-R94 PolarHBondContact O-NH2 3.47Å
68	N	51.6	Low	62.2	Low	128 Å²	128	83.2 Å²	83.2	68%	0.684	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-13.5	-178	-79.8	-13.1	0	0	0	113.4	G70 K71	N68-G70 PolarHBondContact O-N 3.47Å; N68-K71 PolarHBondContact O-N 3.2Å
69	H	47.9	Very low	60.9	Low	124 Å²	124	88.3 Å²	88.3	57%	0.574	44%	0.444	S	S	*	.	H	α-helix	trans	-59.9	-19.2	168.6	-89.4	-95.2	0	0	0	113.4	S67 K71 K72 R73	S67-H69 PolarHBondContact O-N 2.9Å; H69-K71 VanDerWaalsContact C-N 3.31Å; H69-K71 PolarHBondContact O-N 3.16Å; H69-K72 WeakPolarHBondContact O-CB 3.2Å; H69-K72 PolarHBondContact O-N 2.81Å; H69-K72 VanDerWaalsContact O-N 3.09Å; H69-R73 PolarHBondContact O-N 3.13Å
70	G	50	Low	59.2	Low	15 Å²	15	90.7 Å²	90.7	16%	0.155	47%	0.471	C	S	.	.	H	α-helix	trans	-58.5	-35.2	171.1	0	0	0	0	0	113.8	S67 N68 R73 A74	S67-G70 PolarHBondContact O-N 2.79Å; N68-G70 PolarHBondContact O-N 3.47Å; G70-R73 PolarHBondContact O-N 3.4Å; G70-A74 VanDerWaalsContact O-CB 3.25Å; G70-A74 WeakPolarHBondContact O-CB 3.34Å; G70-A74 PolarHBondContact O-N 3.34Å
71	K	54.4	Low	58	Low	171 Å²	171	95.2 Å²	95.2	74%	0.743	49%	0.491	S	S	*	.	H	α-helix	trans	-68.1	-34.4	173.8	-77.8	-175.7	176.8	-179.4	0	112.3	N68 H69 K75	N68-K71 PolarHBondContact O-N 3.2Å; H69-K71 VanDerWaalsContact C-N 3.31Å; H69-K71 PolarHBondContact O-N 3.16Å; K71-K75 WeakPolarHBondContact O-CB 3.19Å; K71-K75 PolarHBondContact O-N 3.19Å
72	K	56.1	Low	56.8	Low	137 Å²	137	93.1 Å²	93.1	60%	0.596	48%	0.482	S	S	*	.	H	α-helix	trans	-70.5	-37.4	172.8	-74.9	-177.7	176.9	177.6	0	111.4	H69 K76	H69-K72 WeakPolarHBondContact O-CB 3.2Å; H69-K72 PolarHBondContact O-N 2.81Å; H69-K72 VanDerWaalsContact O-N 3.09Å; K72-K76 WeakPolarHBondContact O-CG 3.43Å; K72-K76 PolarHBondContact O-N 3.36Å; K72-K76 VanDerWaalsContact O-N 3.08Å
73	R	53.4	Low	55.8	Low	136 Å²	136	97 Å²	97	51%	0.513	51%	0.506	S	S	.	.	H	α-helix	trans	-71.1	-42.3	176.1	-166.3	174.1	176	175.5	-5.6	112	H69 G70 K75 K76 I77	H69-R73 PolarHBondContact O-N 3.13Å; G70-R73 PolarHBondContact O-N 3.4Å; R73-K75 VanDerWaalsContact C-N 3.34Å; R73-K75 PolarHBondContact O-N 3.38Å; R73-K76 CarbonylContact O-C 3.57Å; R73-K76 WeakPolarHBondContact O-CA 3.44Å; R73-K76 WeakPolarHBondContact O-CB 3.05Å; R73-K76 PolarHBondContact O-N 2.92Å; R73-I77 HydrophobicContact CG-CD1 4.41Å; R73-I77 WeakPolarHBondContact O-CG1 3.47Å; R73-I77 PolarHBondContact O-N 3.44Å
74	A	55.2	Low	54.9	Low	38 Å²	38	100.1 Å²	100.1	31%	0.314	53%	0.527	S	S	.	.	H	α-helix	trans	-60.7	-40.1	172	0	0	0	0	0	112.3	G70 K76 I77 A78	G70-A74 VanDerWaalsContact O-CB 3.25Å; G70-A74 WeakPolarHBondContact O-CB 3.34Å; G70-A74 PolarHBondContact O-N 3.34Å; A74-K76 VanDerWaalsContact C-N 3.34Å; A74-K76 PolarHBondContact O-N 3.26Å; A74-I77 PolarHBondContact O-N 3.14Å; A74-A78 WeakPolarHBondContact O-CB 3.35Å; A74-A78 PolarHBondContact O-N 3.45Å
75	K	59.1	Low	54.7	Low	160 Å²	160	99.9 Å²	99.9	70%	0.696	53%	0.531	S	S	*	.	H	α-helix	trans	-61.7	-37.2	169.1	-87.2	-173.8	173.8	-173.7	0	112.8	K71 R73 V79	K71-K75 WeakPolarHBondContact O-CB 3.19Å; K71-K75 PolarHBondContact O-N 3.19Å; R73-K75 VanDerWaalsContact C-N 3.34Å; R73-K75 PolarHBondContact O-N 3.38Å; K75-V79 WeakPolarHBondContact O-CB 3.47Å; K75-V79 WeakPolarHBondContact O-CG2 3.38Å; K75-V79 PolarHBondContact O-N 3.09Å; K75-V79 VanDerWaalsContact O-N 3.12Å
76	K	55.8	Low	54.4	Low	134 Å²	134	107.8 Å²	107.8	58%	0.583	56%	0.564	S	S	*	*	H	α-helix	trans	-70.1	-34	175.7	-74.3	178.7	177.4	-172.3	0	112.9	K72 R73 A74 V79 G80 K81	K72-K76 WeakPolarHBondContact O-CG 3.43Å; K72-K76 PolarHBondContact O-N 3.36Å; K72-K76 VanDerWaalsContact O-N 3.08Å; R73-K76 CarbonylContact O-C 3.57Å; R73-K76 WeakPolarHBondContact O-CA 3.44Å; R73-K76 WeakPolarHBondContact O-CB 3.05Å; R73-K76 PolarHBondContact O-N 2.92Å; A74-K76 VanDerWaalsContact C-N 3.34Å; A74-K76 PolarHBondContact O-N 3.26Å; K76-V79 PolarHBondContact O-N 3.28Å; K76-G80 PolarHBondContact O-N 3.21Å; K76-K81 PolarHBondContact O-N 3Å
77	I	57	Low	54	Low	62 Å²	62	109.7 Å²	109.7	32%	0.318	58%	0.583	S	S	.	*	H	α-helix	trans	-67.9	-45	173.2	-65.3	163.8	0	0	0	110	R73 A74 V79 G80 V82	R73-I77 HydrophobicContact CG-CD1 4.41Å; R73-I77 WeakPolarHBondContact O-CG1 3.47Å; R73-I77 PolarHBondContact O-N 3.44Å; A74-I77 PolarHBondContact O-N 3.14Å; I77-V79 PolarHBondContact O-N 2.9Å; I77-G80 PolarHBondContact O-N 3.05Å; I77-V82 HydrophobicContact CG1-CB 4.25Å; I77-V82 HydrophobicContact CG1-CG2 4.5Å
78	A	58.4	Low	54.5	Low	89 Å²	89	111.9 Å²	111.9	74%	0.736	59%	0.593	S	S	*	*	H	α-helix	trans	-64.1	-24	175.8	0	0	0	0	0	113.8	A74 G80	A74-A78 WeakPolarHBondContact O-CB 3.35Å; A74-A78 PolarHBondContact O-N 3.45Å; A78-G80 VanDerWaalsContact C-N 3.31Å
79	V	62.6	Low	55.6	Low	106 Å²	106	110.5 Å²	110.5	64%	0.642	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	0.8	175.7	172.3	0	0	0	0	112	K75 K76 I77 K81	K75-V79 WeakPolarHBondContact O-CB 3.47Å; K75-V79 WeakPolarHBondContact O-CG2 3.38Å; K75-V79 PolarHBondContact O-N 3.09Å; K75-V79 VanDerWaalsContact O-N 3.12Å; K76-V79 PolarHBondContact O-N 3.28Å; I77-V79 PolarHBondContact O-N 2.9Å; V79-K81 VanDerWaalsContact C-N 3.33Å; V79-K81 HydrophobicContact CG1-CG 4.49Å; V79-K81 PolarHBondContact O-N 2.96Å
80	G	54.3	Low	57.1	Low	58 Å²	58	104.6 Å²	104.6	60%	0.598	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	73.1	16.9	173.5	0	0	0	0	0	115.3	K76 I77 A78 V82	K76-G80 PolarHBondContact O-N 3.21Å; I77-G80 PolarHBondContact O-N 3.05Å; A78-G80 VanDerWaalsContact C-N 3.31Å; G80-V82 VanDerWaalsContact C-N 3.28Å
81	K	57.7	Low	58.3	Low	178 Å²	178	105.2 Å²	105.2	77%	0.774	56%	0.558	S	S	*	*	S	Bend	trans	-83.7	-0.1	176.4	-77.8	-172.6	175.1	-174.3	0	113.9	K76 V79	K76-K81 PolarHBondContact O-N 3Å; V79-K81 VanDerWaalsContact C-N 3.33Å; V79-K81 HydrophobicContact CG1-CG 4.49Å; V79-K81 PolarHBondContact O-N 2.96Å
82	V	55.1	Low	59.4	Low	72 Å²	72	100.3 Å²	100.3	44%	0.436	55%	0.545	S	S	.	.	S	Bend	trans	-136	129.4	178.6	-178.1	0	0	0	0	106.7	I77 G80 V84	I77-V82 HydrophobicContact CG1-CB 4.25Å; I77-V82 HydrophobicContact CG1-CG2 4.5Å; G80-V82 VanDerWaalsContact C-N 3.28Å; V82-V84 PolarHBondContact O-N 2.94Å
83	D	49.4	Very low	60.7	Low	155 Å²	155	94.3 Å²	94.3	83%	0.829	52%	0.519	S	S	*	.			trans	-58.7	132.9	-180	-93.4	-36.6	0	0	0	111.8	N85	D83-N85 VanDerWaalsContact C-N 3.3Å; D83-N85 PolarHBondContact O-N 3.18Å
84	V	47.9	Very low	61.8	Low	104 Å²	104	89.9 Å²	89.9	63%	0.63	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-77.3	-13.4	-171.4	179.1	0	0	0	0	112.7	V82 E86	V82-V84 PolarHBondContact O-N 2.94Å; V84-E86 PolarHBondContact O-N 3.23Å
85	N	49.9	Very low	62.8	Low	164 Å²	164	93.6 Å²	93.6	88%	0.877	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-84	-4	-172.2	-86.4	-13	0	0	0	115.8	D83	D83-N85 VanDerWaalsContact C-N 3.3Å; D83-N85 PolarHBondContact O-N 3.18Å
86	E	48.6	Very low	63.7	Low	184 Å²	184	88.7 Å²	88.7	86%	0.86	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-129.3	55.1	167.6	-71.6	-172.6	161.4	0	0	109.9	V84 D88	V84-E86 PolarHBondContact O-N 3.23Å; E86-D88 VanDerWaalsContact C-N 3.28Å; E86-D88 PolarHBondContact O-N 3.25Å
87	A	52.9	Low	64.9	Low	62 Å²	62	83 Å²	83	51%	0.512	49%	0.487	S	S	.	.			trans	-62.3	100.5	159.5	0	0	0	0	0	107.4	L89	A87-L89 PolarHBondContact O-N 3.19Å
88	D	67.3	Low	66.3	Low	72 Å²	72	84 Å²	84	39%	0.385	50%	0.496	S	S	.	.			trans	-45.4	123.7	170.5	-172.4	0.1	0	0	0	108.3	E86 F90 D91 S92	E86-D88 VanDerWaalsContact C-N 3.28Å; E86-D88 PolarHBondContact O-N 3.25Å; D88-F90 PolarHBondContact O-N 3.49Å; D88-D91 PolarHBondContact O-N 3.37Å; D88-S92 PolarHBondContact O-N 3.29Å
89	L	74.6	Confident	67.6	Low	99 Å²	99	81.9 Å²	81.9	52%	0.518	47%	0.471	S	S	.	.	H	α-helix	trans	-49.3	-30.6	-176.9	-96.4	118.3	0	0	0	111.3	P38 A87 F93	P38-L89 HydrophobicContact CB-CB 4.46Å; A87-L89 PolarHBondContact O-N 3.19Å; L89-F93 WeakPolarHBondContact O-CB 3.34Å; L89-F93 PolarHBondContact O-N 2.97Å
90	F	78.8	Confident	68.7	Low	0 Å²	0	80 Å²	80	0%	0	46%	0.455	C	S	.	.	H	α-helix	trans	-63.2	-40.8	175.4	-160	-90.2	0	0	0	113.9	R34 P38 W57 I66 D88 F93 R94	R34-F90 HydrophobicContact CG-CD2 3.81Å; R34-F90 HydrophobicContact CG-CE2 3.46Å; R34-F90 VanDerWaalsContact CG-CE2 3.46Å; R34-F90 HydrophobicContact CG-CZ 3.93Å; R34-F90 VanDerWaalsContact CZ-CE1 3.48Å; R34-F90 WeakPolarHBondContact O-CD2 3.29Å; P38-F90 HydrophobicContact CG-CB 4.32Å; P38-F90 HydrophobicContact CG-CD2 3.76Å; P38-F90 HydrophobicContact CG-CG 4.44Å; W57-F90 AromaticContact CH2-CE2 3.56Å; W57-F90 HydrophobicContact CH2-CE2 3.56Å; W57-F90 AromaticContact CH2-CZ 3.52Å; W57-F90 HydrophobicContact CH2-CZ 3.52Å; W57-F90 HydrophobicContact CZ2-CZ 4.27Å; W57-F90 AromaticContact CZ3-CE2 3.83Å; W57-F90 HydrophobicContact CZ3-CE2 3.83Å; W57-F90 AromaticContact CZ3-CZ 3.71Å; W57-F90 HydrophobicContact CZ3-CZ 3.71Å; I66-F90 HydrophobicContact CG1-CE1 4.44Å; D88-F90 PolarHBondContact O-N 3.49Å; F90-F93 HydrophobicContact CE2-CD1 4.35Å; F90-F93 WeakPolarHBondContact O-CB 3.46Å; F90-F93 PolarHBondContact O-N 3.31Å; F90-R94 HydrophobicContact CD1-CG 3.92Å; F90-R94 HydrophobicContact CE1-CG 3.68Å; F90-R94 VanDerWaalsContact O-CG 3.31Å; F90-R94 WeakPolarHBondContact O-CG 2.9Å; F90-R94 PolarHBondContact O-N 3.05Å
91	D	75.4	Confident	70.3	Confident	28 Å²	28	78.3 Å²	78.3	15%	0.15	44%	0.439	C	S	.	.	H	α-helix	trans	-70.3	-37.9	179.9	-85.1	-20.3	0	0	0	111.5	D88 R94 V95	D88-D91 PolarHBondContact O-N 3.37Å; D91-R94 PolarHBondContact O-N 3.31Å; D91-R94 IonicContact OD1-NH1 2.71Å; D91-V95 WeakPolarHBondContact O-CG2 3.4Å; D91-V95 PolarHBondContact O-N 3.04Å
92	S	77.6	Confident	71.7	Confident	68 Å²	68	73.4 Å²	73.4	48%	0.476	42%	0.415	S	S	.	.	H	α-helix	trans	-61.3	-44.2	170.3	-62.4	0	0	0	0	111.8	D88 R94 V95 A96	D88-S92 PolarHBondContact O-N 3.29Å; S92-R94 PolarHBondContact O-N 3.28Å; S92-V95 PolarHBondContact O-N 3.19Å; S92-A96 VanDerWaalsContact O-CB 3.23Å; S92-A96 WeakPolarHBondContact O-CB 3.45Å; S92-A96 PolarHBondContact O-N 3.47Å
93	F	82.8	Confident	73.3	Confident	12 Å²	12	73.8 Å²	73.8	5%	0.053	41%	0.409	C	S	.	.	H	α-helix	trans	-57.9	-45.8	175.9	166.3	-106.6	0	0	0	112	V37 P38 Y41 V55 W57 L89 F90 V95 A96 T97 I99	V37-F93 HydrophobicContact CG1-CE1 4.48Å; V37-F93 HydrophobicContact CG1-CZ 4.39Å; P38-F93 HydrophobicContact CB-CB 3.91Å; P38-F93 HydrophobicContact CB-CG 4.2Å; P38-F93 HydrophobicContact CG-CB 3.83Å; P38-F93 HydrophobicContact CG-CD1 4.18Å; P38-F93 HydrophobicContact CG-CG 4.02Å; Y41-F93 AromaticContact CD1-CD2 3.9Å; Y41-F93 HydrophobicContact CD1-CD2 3.9Å; Y41-F93 AromaticContact CD1-CE2 3.72Å; Y41-F93 HydrophobicContact CD1-CE2 3.72Å; Y41-F93 AromaticContact CD2-CE2 3.71Å; Y41-F93 HydrophobicContact CD2-CE2 3.71Å; Y41-F93 HydrophobicContact CD2-CZ 4.44Å; Y41-F93 HydrophobicContact CE1-CD2 4.42Å; Y41-F93 HydrophobicContact CE1-CE2 4.2Å; Y41-F93 HydrophobicContact CE2-CE2 4.16Å; Y41-F93 HydrophobicContact CG-CD2 4.07Å; Y41-F93 AromaticContact CG-CE2 3.47Å; Y41-F93 HydrophobicContact CG-CE2 3.47Å; Y41-F93 VanDerWaalsContact CG-CE2 3.47Å; Y41-F93 HydrophobicContact CG-CZ 4.48Å; V55-F93 HydrophobicContact CG1-CZ 4.3Å; V55-F93 HydrophobicContact CG2-CE2 4.25Å; V55-F93 HydrophobicContact CG2-CZ 3.94Å; W57-F93 HydrophobicContact CZ3-CE1 4.28Å; L89-F93 WeakPolarHBondContact O-CB 3.34Å; L89-F93 PolarHBondContact O-N 2.97Å; F90-F93 HydrophobicContact CE2-CD1 4.35Å; F90-F93 WeakPolarHBondContact O-CB 3.46Å; F90-F93 PolarHBondContact O-N 3.31Å; F93-V95 PolarHBondContact O-N 2.97Å; F93-A96 PolarHBondContact O-N 2.9Å; F93-T97 HydrophobicContact CD2-CG2 3.7Å; F93-T97 HydrophobicContact CE2-CG2 3.77Å; F93-T97 WeakPolarHBondContact O-CB 3.42Å; F93-T97 WeakPolarHBondContact O-CG2 3.47Å; F93-T97 PolarHBondContact O-N 2.97Å; F93-T97 PolarHBondContact O-OG1 2.91Å; F93-I99 HydrophobicContact CD1-CD1 4.04Å; F93-I99 HydrophobicContact CE1-CD1 3.59Å; F93-I99 HydrophobicContact CE1-CG1 4.39Å; F93-I99 HydrophobicContact CZ-CD1 4.2Å
94	R	77	Confident	75.2	Confident	42 Å²	42	67.3 Å²	67.3	16%	0.158	37%	0.373	C	S	.	.	H	α-helix	trans	-63.5	-36.6	179.9	-72.1	175.1	71	-174.1	0.5	114.5	I66 S67 F90 D91 S92 I99	I66-R94 VanDerWaalsContact C-NH2 3.27Å; I66-R94 VanDerWaalsContact N-NH1 3.17Å; I66-R94 PolarHBondContact O-NH2 3.37Å; S67-R94 PolarHBondContact O-NH2 3.47Å; F90-R94 HydrophobicContact CD1-CG 3.92Å; F90-R94 HydrophobicContact CE1-CG 3.68Å; F90-R94 VanDerWaalsContact O-CG 3.31Å; F90-R94 WeakPolarHBondContact O-CG 2.9Å; F90-R94 PolarHBondContact O-N 3.05Å; D91-R94 PolarHBondContact O-N 3.31Å; D91-R94 IonicContact OD1-NH1 2.71Å; S92-R94 PolarHBondContact O-N 3.28Å; R94-I99 HydrophobicContact CB-CD1 4.32Å; R94-I99 HydrophobicContact CG-CD1 3.95Å
95	V	76.3	Confident	76.9	Confident	117 Å²	117	67 Å²	67	71%	0.709	38%	0.376	S	S	*	.	H	α-helix	trans	-76.8	-38.2	-179.9	174.9	0	0	0	0	110.4	D91 S92 F93	D91-V95 WeakPolarHBondContact O-CG2 3.4Å; D91-V95 PolarHBondContact O-N 3.04Å; S92-V95 PolarHBondContact O-N 3.19Å; F93-V95 PolarHBondContact O-N 2.97Å
96	A	78.7	Confident	78.5	Confident	56 Å²	56	62.7 Å²	62.7	46%	0.463	35%	0.35	S	S	.	.	H	α-helix	trans	-81.6	-15.6	-174.7	0	0	0	0	0	114.4	R52 S92 F93	R52-A96 PolarHBondContact NH1-O 2.89Å; S92-A96 VanDerWaalsContact O-CB 3.23Å; S92-A96 WeakPolarHBondContact O-CB 3.45Å; S92-A96 PolarHBondContact O-N 3.47Å; F93-A96 PolarHBondContact O-N 2.9Å
97	T	81.4	Confident	80.1	Confident	16 Å²	16	54.1 Å²	54.1	10%	0.098	31%	0.311	C	S	.	.	S	Bend	trans	-122.4	151.3	-173.1	66.4	0	0	0	0	112.9	Y41 F93 I99	Y41-T97 HydrophobicContact CD1-CG2 4.23Å; Y41-T97 HydrophobicContact CE1-CG2 3.46Å; Y41-T97 VanDerWaalsContact CE1-CG2 3.46Å; Y41-T97 HydrophobicContact CE2-CG2 4.31Å; F93-T97 HydrophobicContact CD2-CG2 3.7Å; F93-T97 HydrophobicContact CE2-CG2 3.77Å; F93-T97 WeakPolarHBondContact O-CB 3.42Å; F93-T97 WeakPolarHBondContact O-CG2 3.47Å; F93-T97 PolarHBondContact O-N 2.97Å; F93-T97 PolarHBondContact O-OG1 2.91Å; T97-I99 PolarHBondContact O-N 3.42Å; T97-I99 WeakPolarHBondContact OG1-CG1 3.36Å
98	T	84.9	Confident	81.3	Confident	83 Å²	83	55.3 Å²	55.3	51%	0.509	31%	0.306	S	S	.	.			trans	-86.9	93.7	175.9	43.8	0	0	0	0	110.1	V55	V55-T98 PolarHBondContact N-O 3.2Å; V55-T98 VanDerWaalsContact N-O 3.15Å
99	I	86.3	Confident	81.7	Confident	43 Å²	43	53.8 Å²	53.8	22%	0.221	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	122.1	179.1	-54	175.4	0	0	0	110.5	V55 W57 F93 R94 T97	V55-I99 HydrophobicContact CB-CG1 4.22Å; V55-I99 WeakPolarHBondContact O-CA 3.34Å; W57-I99 HydrophobicContact CB-CG2 3.88Å; F93-I99 HydrophobicContact CD1-CD1 4.04Å; F93-I99 HydrophobicContact CE1-CD1 3.59Å; F93-I99 HydrophobicContact CE1-CG1 4.39Å; F93-I99 HydrophobicContact CZ-CD1 4.2Å; R94-I99 HydrophobicContact CB-CD1 4.32Å; R94-I99 HydrophobicContact CG-CD1 3.95Å; T97-I99 PolarHBondContact O-N 3.42Å; T97-I99 WeakPolarHBondContact OG1-CG1 3.36Å
100	H	86.4	Confident	82	Confident	66 Å²	66	49.2 Å²	49.2	31%	0.306	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	97.2	171.9	-66.3	-78.7	0	0	0	110	V55 W57 Y115	V55-H100 PolarHBondContact O-N 3.06Å; W57-H100 PolarHBondContact N-O 2.91Å; H100-Y115 HydrophobicContact CB-CE1 3.93Å; H100-Y115 AromaticContact CD2-CE1 3.57Å; H100-Y115 AromaticContact CG-CE1 3.89Å
101	G	86.7	Confident	81.8	Confident	24 Å²	24	51 Å²	51	25%	0.247	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	127.6	174.4	0	0	0	0	0	112.2	W57	W57-G101 CarbonylContact O-C 3.47Å; W57-G101 WeakPolarHBondContact O-CA 3.07Å
102	R	87.9	Confident	81.7	Confident	74 Å²	74	51.8 Å²	51.8	28%	0.279	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	141.9	177.7	-69.2	-65	-177.4	-147.5	0.8	111.9	L56 W57 C58 Y59 V110	L56-R102 HydrophobicContact CD1-CG 4.22Å; W57-R102 PolarHBondContact O-N 3.27Å; C58-R102 WeakPolarHBondContact CA-O 3.49Å; Y59-R102 PolarHBondContact N-O 3.41Å; R102-V110 HydrophobicContact CB-CG2 4.43Å; R102-V110 HydrophobicContact CG-CG2 4.01Å
103	Y	89	Confident	82	Confident	81 Å²	81	54.4 Å²	54.4	32%	0.318	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	149	169.4	-67.7	-79.4	0	0	0	110.6	Y59 K60 K62 S105 E106 T107	Y59-Y103 AromaticContact CD2-CD1 3.83Å; Y59-Y103 HydrophobicContact CD2-CD1 3.83Å; Y59-Y103 AromaticContact CD2-CE1 3.95Å; Y59-Y103 HydrophobicContact CD2-CE1 3.95Å; Y59-Y103 AromaticContact CE2-CD1 3.57Å; Y59-Y103 HydrophobicContact CE2-CD1 3.57Å; Y59-Y103 HydrophobicContact CE2-CD2 4.4Å; Y59-Y103 AromaticContact CE2-CE1 3.46Å; Y59-Y103 HydrophobicContact CE2-CE1 3.46Å; Y59-Y103 VanDerWaalsContact CE2-CE1 3.46Å; Y59-Y103 HydrophobicContact CE2-CE2 4.31Å; Y59-Y103 HydrophobicContact CE2-CG 4.06Å; Y59-Y103 AromaticContact CE2-CZ 3.85Å; Y59-Y103 WeakPolarHBondContact O-CA 3.3Å; K60-Y103 WeakPolarHBondContact O-CD1 3.3Å; K62-Y103 HydrophobicContact CB-CE1 4.15Å; Y103-S105 PolarHBondContact O-N 3.38Å; Y103-E106 WeakPolarHBondContact O-CA 3.01Å; Y103-E106 PolarHBondContact O-N 2.61Å; Y103-T107 PolarHBondContact O-N 2.81Å
104	Y	87.8	Confident	82.2	Confident	19 Å²	19	56.6 Å²	56.6	8%	0.075	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-57.5	-32.9	174.3	-72.1	-40.7	0	0	0	113.7	C58 Y59 K60 E106 T107 L120 Q121 D122 A125 L126 L130	C58-Y104 HydrophobicContact CB-CD1 3.71Å; C58-Y104 HydrophobicContact CB-CE1 3.39Å; Y59-Y104 VanDerWaalsContact C-CD2 3.47Å; Y59-Y104 PolarHBondContact O-N 3.14Å; Y59-Y104 VanDerWaalsContact O-N 3.1Å; K60-Y104 HydrophobicContact CB-CD2 3.85Å; K60-Y104 HydrophobicContact CB-CE2 4.12Å; Y104-E106 VanDerWaalsContact C-N 3.27Å; Y104-E106 PolarHBondContact O-N 3.09Å; Y104-T107 VanDerWaalsContact O-CG2 3.23Å; Y104-T107 WeakPolarHBondContact O-CG2 3.15Å; Y104-T107 PolarHBondContact O-N 2.83Å; Y104-T107 PolarHBondContact O-OG1 3.29Å; Y104-L120 HydrophobicContact CE1-CD2 4.17Å; Y104-Q121 PolarHBondContact OH-N 2.82Å; Y104-D122 HydrophobicContact CE2-CB 3.99Å; Y104-D122 PolarHBondContact OH-N 2.93Å; Y104-D122 PolarHBondContact OH-O 3.28Å; Y104-A125 HydrophobicContact CD2-CB 3.65Å; Y104-A125 HydrophobicContact CE2-CB 3.68Å; Y104-L126 HydrophobicContact CE1-CD2 4.19Å; Y104-L130 VanDerWaalsContact CB-CD1 3.45Å; Y104-L130 HydrophobicContact CD1-CD1 3.4Å; Y104-L130 VanDerWaalsContact CD1-CD1 3.4Å; Y104-L130 HydrophobicContact CD1-CD2 3.77Å; Y104-L130 HydrophobicContact CD1-CG 4.16Å; Y104-L130 HydrophobicContact CE1-CD1 4.26Å; Y104-L130 HydrophobicContact CE1-CD2 3.85Å; Y104-L130 HydrophobicContact CG-CD1 3.62Å
105	S	84.2	Confident	82.9	Confident	97 Å²	97	54.9 Å²	54.9	68%	0.678	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-64.8	-28	172.6	50.1	0	0	0	0	113.5	Y103 H108	Y103-S105 PolarHBondContact O-N 3.38Å; S105-H108 PolarHBondContact O-ND1 2.66Å
106	E	84.4	Confident	83.6	Confident	73 Å²	73	49.3 Å²	49.3	34%	0.341	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-98.1	10.7	-175.6	-65.3	178.7	-178.1	0	0	113.3	Y103 Y104 H108 A109	Y103-E106 WeakPolarHBondContact O-CA 3.01Å; Y103-E106 PolarHBondContact O-N 2.61Å; Y104-E106 VanDerWaalsContact C-N 3.27Å; Y104-E106 PolarHBondContact O-N 3.09Å; E106-H108 PolarHBondContact O-N 2.96Å; E106-A109 WeakPolarHBondContact O-CB 2.89Å; E106-A109 PolarHBondContact O-N 2.69Å
107	T	81.8	Confident	84.3	Confident	5 Å²	5	46.6 Å²	46.6	3%	0.031	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-59.5	-19.3	-178.4	48.1	0	0	0	0	114.1	Y103 Y104 A109 V110 L130 T134	Y103-T107 PolarHBondContact O-N 2.81Å; Y104-T107 VanDerWaalsContact O-CG2 3.23Å; Y104-T107 WeakPolarHBondContact O-CG2 3.15Å; Y104-T107 PolarHBondContact O-N 2.83Å; Y104-T107 PolarHBondContact O-OG1 3.29Å; T107-A109 PolarHBondContact O-N 3.45Å; T107-V110 WeakPolarHBondContact O-CB 3.14Å; T107-V110 PolarHBondContact O-N 3.31Å; T107-L130 HydrophobicContact CG2-CD1 3.95Å; T107-L130 HydrophobicContact CG2-CG 4Å; T107-T134 HydrophobicContact CG2-CG2 4.43Å
108	H	77.8	Confident	84.9	Confident	87 Å²	87	45.9 Å²	45.9	40%	0.403	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-63.2	-27.9	172.2	65.3	-86.3	0	0	0	112.9	S105 E106 V110 L111	S105-H108 PolarHBondContact O-ND1 2.66Å; E106-H108 PolarHBondContact O-N 2.96Å; H108-V110 PolarHBondContact O-N 3.01Å; H108-L111 HydrophobicContact CB-CD1 4.34Å; H108-L111 WeakPolarHBondContact O-CB 3.39Å; H108-L111 VanDerWaalsContact O-CD1 3.27Å; H108-L111 WeakPolarHBondContact O-CD1 3.43Å; H108-L111 WeakPolarHBondContact O-CG 3.44Å; H108-L111 PolarHBondContact O-N 3.38Å
109	A	76.4	Confident	85.3	Confident	40 Å²	40	41.9 Å²	41.9	33%	0.331	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-77.2	-8.9	179.2	0	0	0	0	0	113.6	E106 T107 L111	E106-A109 WeakPolarHBondContact O-CB 2.89Å; E106-A109 PolarHBondContact O-N 2.69Å; T107-A109 PolarHBondContact O-N 3.45Å; A109-L111 VanDerWaalsContact C-N 3.32Å
110	V	79.9	Confident	85.6	Confident	3 Å²	3	40 Å²	40	2%	0.018	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-83.5	-17.5	177.8	-171.6	0	0	0	0	110.8	L56 R102 T107 H108 R113 Y115 T137	L56-V110 HydrophobicContact CD1-CG1 4.01Å; L56-V110 HydrophobicContact CD1-CG2 4.06Å; L56-V110 HydrophobicContact CD2-CG1 3.6Å; L56-V110 HydrophobicContact CG-CG1 4.46Å; R102-V110 HydrophobicContact CB-CG2 4.43Å; R102-V110 HydrophobicContact CG-CG2 4.01Å; T107-V110 WeakPolarHBondContact O-CB 3.14Å; T107-V110 PolarHBondContact O-N 3.31Å; H108-V110 PolarHBondContact O-N 3.01Å; V110-R113 WeakPolarHBondContact O-CB 3.18Å; V110-R113 PolarHBondContact O-N 3.26Å; V110-Y115 HydrophobicContact CG1-CD2 4.14Å; V110-Y115 HydrophobicContact CG1-CE2 3.44Å; V110-Y115 VanDerWaalsContact CG1-CE2 3.44Å; V110-T137 HydrophobicContact CG1-CG2 3.83Å
111	L	76	Confident	85.7	Confident	38 Å²	38	37.5 Å²	37.5	20%	0.199	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	140.6	-178.9	-59.6	172.5	0	0	0	111	H108 A109 R113 R133 R281 Y411 E412	H108-L111 HydrophobicContact CB-CD1 4.34Å; H108-L111 WeakPolarHBondContact O-CB 3.39Å; H108-L111 VanDerWaalsContact O-CD1 3.27Å; H108-L111 WeakPolarHBondContact O-CD1 3.43Å; H108-L111 WeakPolarHBondContact O-CG 3.44Å; H108-L111 PolarHBondContact O-N 3.38Å; A109-L111 VanDerWaalsContact C-N 3.32Å; L111-R113 PolarHBondContact O-N 3.1Å; L111-R133 HydrophobicContact CD2-CG 4.35Å; L111-R281 VanDerWaalsContact CD1-NH2 3.29Å; L111-R281 VanDerWaalsContact CD2-NH1 3.34Å; L111-Y411 HydrophobicContact CD2-CE2 4.43Å; L111-Y411 WeakPolarHBondContact CD2-OH 2.81Å; L111-E412 WeakPolarHBondContact CD1-OE1 3.21Å
112	G	72.7	Confident	85.7	Confident	43 Å²	43	38 Å²	38	44%	0.443	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.6	-13.5	-175.5	0	0	0	0	0	114.6
113	R	82.9	Confident	85.4	Confident	123 Å²	123	35.5 Å²	35.5	46%	0.464	19%	0.192	S	C	.	.			trans	-96.7	160.5	173.6	-60.4	-177	179.4	-161.9	-3.2	111.4	V110 L111 Y115	V110-R113 WeakPolarHBondContact O-CB 3.18Å; V110-R113 PolarHBondContact O-N 3.26Å; L111-R113 PolarHBondContact O-N 3.1Å; R113-Y115 HydrophobicContact CB-CE2 3.75Å
114	T	87.6	Confident	85	Confident	59 Å²	59	36.3 Å²	36.3	36%	0.362	20%	0.199	S	C	.	.			trans	-128.5	138.3	177.1	-51.8	0	0	0	0	109	T137 E139 R443	T114-T137 CarbonylContact C-O 3.5Å; T114-T137 VanDerWaalsContact CA-O 3.3Å; T114-T137 WeakPolarHBondContact CA-O 3.02Å; T114-E139 HydrophobicContact CG2-CB 3.71Å; T114-R443 HydrophobicContact CG2-CG 4.24Å; T114-R443 PolarHBondContact OG1-NE 2.84Å
115	Y	91.1	Very high	84.6	Confident	5 Å²	5	36 Å²	36	2%	0.02	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	150.6	-176.8	-64.1	-87.2	0	0	0	110.7	L56 H100 V110 R113 T137 V138 E139	L56-Y115 HydrophobicContact CB-CD1 3.78Å; L56-Y115 HydrophobicContact CB-CD2 4Å; L56-Y115 HydrophobicContact CB-CE1 4.12Å; L56-Y115 HydrophobicContact CB-CE2 4.37Å; L56-Y115 HydrophobicContact CB-CG 3.71Å; L56-Y115 HydrophobicContact CD1-CE1 4.5Å; L56-Y115 HydrophobicContact CD1-CE2 4.31Å; L56-Y115 HydrophobicContact CD2-CD2 4.15Å; L56-Y115 HydrophobicContact CD2-CE2 4.34Å; H100-Y115 HydrophobicContact CB-CE1 3.93Å; H100-Y115 AromaticContact CD2-CE1 3.57Å; H100-Y115 AromaticContact CG-CE1 3.89Å; V110-Y115 HydrophobicContact CG1-CD2 4.14Å; V110-Y115 HydrophobicContact CG1-CE2 3.44Å; V110-Y115 VanDerWaalsContact CG1-CE2 3.44Å; R113-Y115 HydrophobicContact CB-CE2 3.75Å; Y115-T137 PolarHBondContact N-O 3.28Å; Y115-V138 VanDerWaalsContact O-CA 3.31Å; Y115-V138 WeakPolarHBondContact O-CA 3.38Å; Y115-E139 PolarHBondContact O-N 3.2Å
116	G	91.4	Very high	84.5	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-31.6	175	0	0	0	0	0	113	T54 G142 L143	T54-G116 PolarHBondContact O-N 3.15Å; G116-G142 CarbonylContact O-C 3.56Å; G116-G142 WeakPolarHBondContact O-CA 3.48Å; G116-L143 PolarHBondContact O-N 2.95Å
117	V	93.7	Very high	84.7	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	135.3	177	-179.2	0	0	0	0	110.5	Y41 L44 T54 V55 L56 V119 L143 I145	Y41-V117 HydrophobicContact CD2-CG2 3.94Å; Y41-V117 HydrophobicContact CE2-CG2 4.35Å; L44-V117 HydrophobicContact CD2-CG2 3.51Å; T54-V117 PolarHBondContact O-N 3.4Å; V55-V117 CarbonylContact C-O 3.54Å; V55-V117 WeakPolarHBondContact CA-O 3.39Å; V55-V117 HydrophobicContact CG1-CB 4.45Å; V55-V117 HydrophobicContact CG1-CG1 4.46Å; V55-V117 HydrophobicContact CG2-CB 4.27Å; L56-V117 PolarHBondContact N-O 2.9Å; V117-V119 HydrophobicContact CG1-CG2 4.2Å; V117-L143 CarbonylContact C-O 3.48Å; V117-L143 VanDerWaalsContact CA-O 3.32Å; V117-L143 WeakPolarHBondContact CA-O 3.48Å; V117-L143 HydrophobicContact CG1-CB 4.32Å; V117-L143 HydrophobicContact CG2-CB 4.24Å; V117-I145 HydrophobicContact CG1-CD1 4.11Å
118	C	94.9	Very high	85	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	125.6	171.9	-180	0	0	0	0	110.4	L56 V138 L143 I144 I145	L56-C118 CarbonylContact O-C 3.56Å; L56-C118 WeakPolarHBondContact O-CA 3.26Å; C118-V138 HydrophobicContact CB-CG2 3.49Å; C118-V138 VanDerWaalsContact CB-CG2 3.49Å; C118-L143 PolarHBondContact N-O 2.78Å; C118-I144 CarbonylContact O-C 3.6Å; C118-I144 WeakPolarHBondContact O-CA 3.43Å; C118-I145 PolarHBondContact O-N 3.33Å
119	V	93.3	Very high	85.5	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	125	176.7	-173.5	0	0	0	0	109.3	V37 V55 L56 W57 C58 V117 I145 L147	V37-V119 HydrophobicContact CG1-CG2 3.89Å; V37-V119 HydrophobicContact CG2-CG1 4.44Å; V55-V119 HydrophobicContact CG1-CG2 4.29Å; L56-V119 PolarHBondContact O-N 3.12Å; W57-V119 HydrophobicContact CD2-CB 3.9Å; W57-V119 HydrophobicContact CD2-CG1 3.94Å; W57-V119 HydrophobicContact CD2-CG2 4.4Å; W57-V119 HydrophobicContact CE3-CB 3.88Å; W57-V119 HydrophobicContact CE3-CG1 4.03Å; W57-V119 HydrophobicContact CE3-CG2 3.85Å; W57-V119 HydrophobicContact CG-CB 4.3Å; W57-V119 HydrophobicContact CH2-CG1 3.87Å; W57-V119 HydrophobicContact CZ2-CG1 3.8Å; W57-V119 HydrophobicContact CZ3-CB 4.23Å; W57-V119 HydrophobicContact CZ3-CG1 4Å; W57-V119 HydrophobicContact CZ3-CG2 3.99Å; C58-V119 PolarHBondContact N-O 3.15Å; V117-V119 HydrophobicContact CG1-CG2 4.2Å; V119-I145 WeakPolarHBondContact CA-O 3.32Å; V119-I145 HydrophobicContact CG2-CB 4.48Å; V119-I145 HydrophobicContact CG2-CD1 4.48Å; V119-L147 HydrophobicContact CG1-CD1 3.85Å; V119-L147 HydrophobicContact CG1-CG 4.14Å
120	L	92.2	Very high	86.1	Confident	2 Å²	2	24.5 Å²	24.5	1%	0.01	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	108.2	178.5	-63.8	175.3	0	0	0	108.3	C58 Y104 L126 L130 T134 I145 L146 L147	C58-L120 HydrophobicContact CB-CD2 3.97Å; Y104-L120 HydrophobicContact CE1-CD2 4.17Å; L120-L126 HydrophobicContact CB-CD2 4.24Å; L120-L126 HydrophobicContact CD1-CD2 4.07Å; L120-L126 HydrophobicContact CD2-CD2 4.13Å; L120-L126 HydrophobicContact CG-CD2 4.37Å; L120-L130 HydrophobicContact CD2-CD2 4.26Å; L120-T134 HydrophobicContact CD2-CG2 3.9Å; L120-I145 PolarHBondContact N-O 3.3Å; L120-L146 HydrophobicContact CB-CD2 3.79Å; L120-L146 HydrophobicContact CD1-CD2 3.52Å; L120-L146 HydrophobicContact CD1-CG 4.26Å; L120-L146 HydrophobicContact CG-CD2 4.26Å; L120-L147 PolarHBondContact O-N 3.13Å
121	Q	88.6	Confident	86.6	Confident	15 Å²	15	24.7 Å²	24.7	7%	0.07	13%	0.133	C	C	.	.			trans	-81.4	-45.5	-167.8	179	168.1	-14.4	0	0	114.2	C58 D63 Y104	C58-Q121 WeakPolarHBondContact O-CB 3.09Å; C58-Q121 PolarHBondContact O-N 3.26Å; C58-Q121 VanDerWaalsContact O-N 3.14Å; D63-Q121 PolarHBondContact OD2-NE2 3.04Å; Y104-Q121 PolarHBondContact OH-N 2.82Å
122	D	85.5	Confident	87.2	Confident	35 Å²	35	23 Å²	23	19%	0.187	12%	0.124	C	C	.	.			trans	-113.1	112	-175	-38.5	-78.2	0	0	0	110.3	K60 Y104 A125	K60-D122 WeakPolarHBondContact CB-OD2 3.44Å; K60-D122 PolarHBondContact N-OD2 2.96Å; Y104-D122 HydrophobicContact CE2-CB 3.99Å; Y104-D122 PolarHBondContact OH-N 2.93Å; Y104-D122 PolarHBondContact OH-O 3.28Å; D122-A125 HydrophobicContact CB-CB 4.43Å
123	F	83.1	Confident	88	Confident	21 Å²	21	23.2 Å²	23.2	9%	0.092	11%	0.111	C	C	.	.	G	3₁₀ helix	trans	-69.9	-34.3	178.6	-178.2	-105.3	0	0	0	112.9	A125 L126 L148 L157 M160 L184	F123-A125 PolarHBondContact O-N 3.05Å; F123-A125 VanDerWaalsContact O-N 3.1Å; F123-L126 HydrophobicContact CB-CD1 4.4Å; F123-L126 HydrophobicContact CD2-CD1 3.67Å; F123-L126 HydrophobicContact CE2-CD1 4.42Å; F123-L126 HydrophobicContact CG-CD1 4.39Å; F123-L126 WeakPolarHBondContact O-CB 3.32Å; F123-L126 PolarHBondContact O-N 3.42Å; F123-L148 HydrophobicContact CB-CD2 3.32Å; F123-L148 HydrophobicContact CD1-CD2 3.75Å; F123-L148 HydrophobicContact CD2-CD2 3.92Å; F123-L148 HydrophobicContact CG-CD2 3.41Å; F123-L148 VanDerWaalsContact CG-CD2 3.41Å; F123-L157 HydrophobicContact CD1-CD2 4.23Å; F123-L157 HydrophobicContact CE1-CD2 4.12Å; F123-M160 HydrophobicContact CD1-CE 3.28Å; F123-M160 HydrophobicContact CD1-SD 4.07Å; F123-M160 HydrophobicContact CE1-CE 3.76Å; F123-M160 HydrophobicContact CG-CE 4.34Å; F123-L184 HydrophobicContact CE2-CD2 3.72Å; F123-L184 HydrophobicContact CZ-CD2 3.77Å
124	E	80.1	Confident	88.3	Confident	98 Å²	98	17.4 Å²	17.4	46%	0.458	9%	0.09	S	C	.	.	G	3₁₀ helix	trans	-58.2	-25.8	177.8	-65.8	173.4	-174.5	0	0	114.1	M160 M162 D163	E124-M160 HydrophobicContact CB-CE 4.05Å; E124-M160 HydrophobicContact CG-CE 3.42Å; E124-M160 VanDerWaalsContact CG-CE 3.42Å; E124-M160 HydrophobicContact CG-CG 4.3Å; E124-M160 HydrophobicContact CG-SD 3.57Å; E124-M160 VanDerWaalsContact CG-SD 3.57Å; E124-M162 WeakPolarHBondContact O-CA 3.33Å; E124-M162 WeakPolarHBondContact O-CB 3.46Å; E124-D163 PolarHBondContact O-N 3.3Å
125	A	79.3	Confident	88.5	Confident	13 Å²	13	14.6 Å²	14.6	11%	0.107	7%	0.073	C	C	.	.	G	3₁₀ helix	trans	-97.5	-3	-178.5	0	0	0	0	0	113.2	K60 Y104 D122 F123 T127	K60-A125 HydrophobicContact CB-CB 4.37Å; K60-A125 HydrophobicContact CD-CB 4.28Å; Y104-A125 HydrophobicContact CD2-CB 3.65Å; Y104-A125 HydrophobicContact CE2-CB 3.68Å; D122-A125 HydrophobicContact CB-CB 4.43Å; F123-A125 PolarHBondContact O-N 3.05Å; F123-A125 VanDerWaalsContact O-N 3.1Å; A125-T127 PolarHBondContact O-N 3.47Å; A125-T127 VanDerWaalsContact O-N 3.08Å
126	L	82.8	Confident	88.3	Confident	7 Å²	7	15.1 Å²	15.1	4%	0.037	8%	0.075	C	C	.	.			trans	-75.9	97.8	-175.4	-71.2	179.1	0	0	0	112.1	Y104 L120 F123 L130 L146 M162	Y104-L126 HydrophobicContact CE1-CD2 4.19Å; L120-L126 HydrophobicContact CB-CD2 4.24Å; L120-L126 HydrophobicContact CD1-CD2 4.07Å; L120-L126 HydrophobicContact CD2-CD2 4.13Å; L120-L126 HydrophobicContact CG-CD2 4.37Å; F123-L126 HydrophobicContact CB-CD1 4.4Å; F123-L126 HydrophobicContact CD2-CD1 3.67Å; F123-L126 HydrophobicContact CE2-CD1 4.42Å; F123-L126 HydrophobicContact CG-CD1 4.39Å; F123-L126 WeakPolarHBondContact O-CB 3.32Å; F123-L126 PolarHBondContact O-N 3.42Å; L126-L130 HydrophobicContact CD2-CD2 3.56Å; L126-L146 HydrophobicContact CD1-CD2 3.34Å; L126-M162 WeakPolarHBondContact O-CE 3.47Å
127	T	87.4	Confident	88.2	Confident	26 Å²	26	15.1 Å²	15.1	16%	0.16	8%	0.075	C	C	.	.			trans	-79.7	152.8	169.4	66.8	0	0	0	0	111.8	A125 N129 L130 L131 V164	A125-T127 PolarHBondContact O-N 3.47Å; A125-T127 VanDerWaalsContact O-N 3.08Å; T127-N129 VanDerWaalsContact C-N 3.27Å; T127-N129 PolarHBondContact O-N 3.23Å; T127-L130 WeakPolarHBondContact O-CA 3.35Å; T127-L130 WeakPolarHBondContact O-CB 3.38Å; T127-L130 PolarHBondContact O-N 3.35Å; T127-L130 WeakPolarHBondContact OG1-CB 3.29Å; T127-L130 PolarHBondContact OG1-N 3.03Å; T127-L131 PolarHBondContact O-N 3.41Å; T127-V164 HydrophobicContact CG2-CG2 3.46Å; T127-V164 VanDerWaalsContact CG2-CG2 3.46Å
128	P	89.4	Confident	88.2	Confident	1 Å²	1	15.1 Å²	15.1	1%	0.006	8%	0.075	C	C	.	.	H	α-helix	trans	-51.6	-42.4	176.7	-26.7	30.5	0	0	0	113.8	L130 L131 A132 F180 L458 P515 N516 Q519	P128-L130 VanDerWaalsContact C-N 3.34Å; P128-L130 PolarHBondContact O-N 2.79Å; P128-L131 PolarHBondContact O-N 3.24Å; P128-A132 WeakPolarHBondContact O-CB 3.47Å; P128-A132 PolarHBondContact O-N 3.07Å; P128-F180 HydrophobicContact CB-CZ 4.17Å; P128-F180 HydrophobicContact CG-CE1 3.96Å; P128-F180 HydrophobicContact CG-CE2 4.01Å; P128-F180 HydrophobicContact CG-CZ 3.64Å; P128-L458 HydrophobicContact CB-CD2 3.66Å; P128-P515 HydrophobicContact CB-CB 3.91Å; P128-N516 WeakPolarHBondContact CD-OD1 3.3Å; P128-Q519 HydrophobicContact CG-CB 3.83Å
129	N	88	Confident	88	Confident	17 Å²	17	18.6 Å²	18.6	9%	0.091	9%	0.091	C	C	.	.	H	α-helix	trans	-65.8	-37.2	177.1	-177.9	20.1	0	0	0	112.1	T127 A132 R133 Y411 N516	T127-N129 VanDerWaalsContact C-N 3.27Å; T127-N129 PolarHBondContact O-N 3.23Å; N129-A132 PolarHBondContact O-N 2.85Å; N129-R133 PolarHBondContact ND2-NH2 2.66Å; N129-R133 VanDerWaalsContact O-CG 3.26Å; N129-R133 WeakPolarHBondContact O-CG 3.32Å; N129-R133 PolarHBondContact O-N 3.02Å; N129-R133 PolarHBondContact OD1-NE 2.84Å; N129-Y411 VanDerWaalsContact OD1-CD2 3.27Å; N129-Y411 WeakPolarHBondContact OD1-CD2 3.46Å; N129-Y411 PolarHBondContact OD1-O 3Å; N129-N516 WeakPolarHBondContact CB-OD1 3.25Å; N129-N516 PolarHBondContact N-OD1 3.04Å
130	L	89.4	Confident	87.9	Confident	8 Å²	8	19.7 Å²	19.7	4%	0.042	10%	0.103	C	C	.	.	H	α-helix	trans	-67	-45.3	176.6	-169.9	148	0	0	0	111.3	Y104 T107 L120 L126 T127 P128 A132 R133 T134	Y104-L130 VanDerWaalsContact CB-CD1 3.45Å; Y104-L130 HydrophobicContact CD1-CD1 3.4Å; Y104-L130 VanDerWaalsContact CD1-CD1 3.4Å; Y104-L130 HydrophobicContact CD1-CD2 3.77Å; Y104-L130 HydrophobicContact CD1-CG 4.16Å; Y104-L130 HydrophobicContact CE1-CD1 4.26Å; Y104-L130 HydrophobicContact CE1-CD2 3.85Å; Y104-L130 HydrophobicContact CG-CD1 3.62Å; T107-L130 HydrophobicContact CG2-CD1 3.95Å; T107-L130 HydrophobicContact CG2-CG 4Å; L120-L130 HydrophobicContact CD2-CD2 4.26Å; L126-L130 HydrophobicContact CD2-CD2 3.56Å; T127-L130 WeakPolarHBondContact O-CA 3.35Å; T127-L130 WeakPolarHBondContact O-CB 3.38Å; T127-L130 PolarHBondContact O-N 3.35Å; T127-L130 WeakPolarHBondContact OG1-CB 3.29Å; T127-L130 PolarHBondContact OG1-N 3.03Å; P128-L130 VanDerWaalsContact C-N 3.34Å; P128-L130 PolarHBondContact O-N 2.79Å; L130-A132 VanDerWaalsContact C-N 3.28Å; L130-A132 PolarHBondContact O-N 3.38Å; L130-R133 WeakPolarHBondContact O-CB 3.43Å; L130-R133 PolarHBondContact O-N 3.34Å; L130-R133 VanDerWaalsContact O-N 3.16Å; L130-T134 HydrophobicContact CD2-CG2 3.98Å; L130-T134 WeakPolarHBondContact O-CG2 3.38Å; L130-T134 PolarHBondContact O-N 3.44Å; L130-T134 PolarHBondContact O-OG1 3.43Å; L130-T134 VanDerWaalsContact O-OG1 3.07Å
131	L	89.4	Confident	87.7	Confident	8 Å²	8	19.9 Å²	19.9	4%	0.042	11%	0.106	C	C	.	.	H	α-helix	trans	-57.7	-44.3	175.8	-170.1	153.3	0	0	0	110.4	T127 P128 R133 T134 V135 L184 W453 L454	T127-L131 PolarHBondContact O-N 3.41Å; P128-L131 PolarHBondContact O-N 3.24Å; L131-R133 PolarHBondContact O-N 2.72Å; L131-T134 PolarHBondContact O-N 2.83Å; L131-T134 PolarHBondContact O-OG1 3.07Å; L131-V135 HydrophobicContact CD2-CG2 4Å; L131-V135 HydrophobicContact CG-CG2 4.28Å; L131-V135 VanDerWaalsContact O-CB 3.23Å; L131-V135 WeakPolarHBondContact O-CB 3.29Å; L131-V135 WeakPolarHBondContact O-CG2 3.39Å; L131-V135 PolarHBondContact O-N 3.48Å; L131-L184 HydrophobicContact CD1-CD1 4.48Å; L131-W453 HydrophobicContact CD1-CH2 4.4Å; L131-W453 HydrophobicContact CD2-CH2 4.05Å; L131-W453 HydrophobicContact CD2-CZ3 4.16Å; L131-L454 HydrophobicContact CD2-CD1 3.18Å
132	A	89.3	Confident	87.9	Confident	1 Å²	1	19.3 Å²	19.3	1%	0.008	10%	0.103	C	C	.	.	H	α-helix	trans	-62	-42.8	176.1	0	0	0	0	0	112.8	P128 N129 L130 E136 Y411 L458	P128-A132 WeakPolarHBondContact O-CB 3.47Å; P128-A132 PolarHBondContact O-N 3.07Å; N129-A132 PolarHBondContact O-N 2.85Å; L130-A132 VanDerWaalsContact C-N 3.28Å; L130-A132 PolarHBondContact O-N 3.38Å; A132-E136 VanDerWaalsContact O-CB 3.31Å; A132-E136 WeakPolarHBondContact O-CB 3.47Å; A132-E136 PolarHBondContact O-N 3.19Å; A132-Y411 HydrophobicContact CB-CD1 3.31Å; A132-Y411 HydrophobicContact CB-CE1 3.92Å; A132-Y411 HydrophobicContact CB-CG 3.63Å; A132-Y411 WeakPolarHBondContact O-CE1 3.38Å; A132-L458 HydrophobicContact CB-CD1 3.71Å
133	R	87.8	Confident	88.3	Confident	48 Å²	48	17.6 Å²	17.6	18%	0.181	9%	0.094	C	C	.	.	H	α-helix	trans	-60.9	-48.4	177.5	-75.2	166.9	-172.2	-158.6	-7.8	112.9	L111 N129 L130 L131 T137 Y411	L111-R133 HydrophobicContact CD2-CG 4.35Å; N129-R133 PolarHBondContact ND2-NH2 2.66Å; N129-R133 VanDerWaalsContact O-CG 3.26Å; N129-R133 WeakPolarHBondContact O-CG 3.32Å; N129-R133 PolarHBondContact O-N 3.02Å; N129-R133 PolarHBondContact OD1-NE 2.84Å; L130-R133 WeakPolarHBondContact O-CB 3.43Å; L130-R133 PolarHBondContact O-N 3.34Å; L130-R133 VanDerWaalsContact O-N 3.16Å; L131-R133 PolarHBondContact O-N 2.72Å; R133-T137 WeakPolarHBondContact O-CG2 3.35Å; R133-Y411 HydrophobicContact CB-CE2 4.19Å; R133-Y411 HydrophobicContact CG-CD2 3.75Å; R133-Y411 HydrophobicContact CG-CE2 3.12Å
134	T	90.2	Very high	88.9	Confident	1 Å²	1	16.6 Å²	16.6	1%	0.006	9%	0.09	C	C	.	.	H	α-helix	trans	-76.1	-45.1	-172.9	54.5	0	0	0	0	111.1	T107 L120 L130 L131 E136 T137	T107-T134 HydrophobicContact CG2-CG2 4.43Å; L120-T134 HydrophobicContact CD2-CG2 3.9Å; L130-T134 HydrophobicContact CD2-CG2 3.98Å; L130-T134 WeakPolarHBondContact O-CG2 3.38Å; L130-T134 PolarHBondContact O-N 3.44Å; L130-T134 PolarHBondContact O-OG1 3.43Å; L130-T134 VanDerWaalsContact O-OG1 3.07Å; L131-T134 PolarHBondContact O-N 2.83Å; L131-T134 PolarHBondContact O-OG1 3.07Å; T134-E136 VanDerWaalsContact C-N 3.33Å; T134-E136 PolarHBondContact O-N 3Å; T134-T137 PolarHBondContact O-N 3.13Å; T134-T137 PolarHBondContact O-OG1 3Å
135	V	90.7	Very high	89.5	Confident	1 Å²	1	12 Å²	12	1%	0.006	7%	0.068	C	C	.	.	H	α-helix	trans	-61.7	-38.5	179.7	171	0	0	0	0	112	R23 M25 L131 T137 V138 I144 I450 L454	R23-V135 PolarHBondContact NH1-O 2.99Å; M25-V135 HydrophobicContact CE-CG2 4.49Å; L131-V135 HydrophobicContact CD2-CG2 4Å; L131-V135 HydrophobicContact CG-CG2 4.28Å; L131-V135 VanDerWaalsContact O-CB 3.23Å; L131-V135 WeakPolarHBondContact O-CB 3.29Å; L131-V135 WeakPolarHBondContact O-CG2 3.39Å; L131-V135 PolarHBondContact O-N 3.48Å; V135-T137 VanDerWaalsContact C-N 3.29Å; V135-T137 PolarHBondContact O-N 3.34Å; V135-V138 PolarHBondContact O-N 3.45Å; V135-I144 HydrophobicContact CB-CD1 4.29Å; V135-I144 HydrophobicContact CG1-CD1 3.76Å; V135-I144 HydrophobicContact CG2-CD1 4.18Å; V135-I144 HydrophobicContact CG2-CG2 4.33Å; V135-I450 HydrophobicContact CG1-CG2 3.85Å; V135-L454 HydrophobicContact CB-CD2 4.16Å; V135-L454 HydrophobicContact CG1-CD2 3.85Å
136	E	88.3	Confident	90.1	Very high	15 Å²	15	11.8 Å²	11.8	7%	0.07	7%	0.065	C	C	.	.	H	α-helix	trans	-71.1	-23	-179.7	-157.1	-156.4	119.3	0	0	113.4	A132 T134 V138 R281 G282 Y411 R443	A132-E136 VanDerWaalsContact O-CB 3.31Å; A132-E136 WeakPolarHBondContact O-CB 3.47Å; A132-E136 PolarHBondContact O-N 3.19Å; T134-E136 VanDerWaalsContact C-N 3.33Å; T134-E136 PolarHBondContact O-N 3Å; E136-V138 PolarHBondContact O-N 2.54Å; E136-R281 VanDerWaalsContact OE1-C 3.27Å; E136-R281 WeakPolarHBondContact OE1-CB 3.35Å; E136-R281 WeakPolarHBondContact OE1-CD 3.45Å; E136-R281 WeakPolarHBondContact OE1-CG 3.47Å; E136-R281 WeakPolarHBondContact OE2-CB 3.3Å; E136-R281 VanDerWaalsContact OE2-CD 3.23Å; E136-R281 WeakPolarHBondContact OE2-CD 3.39Å; E136-G282 WeakPolarHBondContact OE1-CA 3.33Å; E136-G282 PolarHBondContact OE1-N 2.73Å; E136-Y411 HydrophobicContact CB-CE1 4.45Å; E136-Y411 WeakPolarHBondContact OE2-CE1 3.07Å; E136-Y411 PolarHBondContact OE2-OH 2.96Å; E136-R443 WeakPolarHBondContact O-CD 3.43Å; E136-R443 PolarHBondContact O-NH1 3Å; E136-R443 IonicContact OE1-CZ 3.9Å; E136-R443 IonicContact OE1-NH1 2.68Å; E136-R443 PolarHBondContact OE1-NH1 3.39Å
137	T	89.7	Confident	90.4	Very high	1 Å²	1	12 Å²	12	1%	0.006	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-8.2	179.9	63.3	0	0	0	0	113.5	V110 T114 Y115 R133 T134 V135	V110-T137 HydrophobicContact CG1-CG2 3.83Å; T114-T137 CarbonylContact C-O 3.5Å; T114-T137 VanDerWaalsContact CA-O 3.3Å; T114-T137 WeakPolarHBondContact CA-O 3.02Å; Y115-T137 PolarHBondContact N-O 3.28Å; R133-T137 WeakPolarHBondContact O-CG2 3.35Å; T134-T137 PolarHBondContact O-N 3.13Å; T134-T137 PolarHBondContact O-OG1 3Å; V135-T137 VanDerWaalsContact C-N 3.29Å; V135-T137 PolarHBondContact O-N 3.34Å
138	V	92.3	Very high	90.2	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	134.7	179.8	-175.1	0	0	0	0	110.5	R23 Y115 C118 V135 E136 I144	R23-V138 WeakPolarHBondContact CD-O 3.32Å; R23-V138 HydrophobicContact CG-CB 4.46Å; R23-V138 HydrophobicContact CG-CG1 4.16Å; Y115-V138 VanDerWaalsContact O-CA 3.31Å; Y115-V138 WeakPolarHBondContact O-CA 3.38Å; C118-V138 HydrophobicContact CB-CG2 3.49Å; C118-V138 VanDerWaalsContact CB-CG2 3.49Å; V135-V138 PolarHBondContact O-N 3.45Å; E136-V138 PolarHBondContact O-N 2.54Å; V138-I144 HydrophobicContact CB-CG1 4.27Å; V138-I144 HydrophobicContact CG1-CG1 4.34Å; V138-I144 HydrophobicContact CG2-CG1 3.81Å
139	E	91.6	Very high	89.7	Confident	72 Å²	72	18 Å²	18	34%	0.336	9%	0.091	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	163	174.6	64.6	-175.6	173.6	0	0	113.4	R23 T114 Y115 G142 R443	R23-E139 WeakPolarHBondContact CG-O 3.47Å; T114-E139 HydrophobicContact CG2-CB 3.71Å; Y115-E139 PolarHBondContact O-N 3.2Å; E139-G142 WeakPolarHBondContact O-CA 3.33Å; E139-G142 PolarHBondContact O-N 3.18Å; E139-R443 CarbonylContact C-O 3.5Å; E139-R443 WeakPolarHBondContact CA-O 3.35Å
140	G	90.1	Very high	88.5	Confident	23 Å²	23	21.6 Å²	21.6	24%	0.237	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	134.2	173.7	0	0	0	0	0	111.8	G21 G142 R443	G21-G140 WeakPolarHBondContact O-CA 3.08Å; G140-G142 PolarHBondContact O-N 2.81Å; G140-R443 PolarHBondContact N-O 2.65Å
141	G	88.9	Confident	87.3	Confident	7 Å²	7	22.4 Å²	22.4	7%	0.072	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	81.1	-4.9	-170	0	0	0	0	0	114.3	H22 L44	H22-G141 WeakPolarHBondContact O-CA 3.27Å; H22-G141 PolarHBondContact O-N 3.39Å; L44-G141 WeakPolarHBondContact CD1-O 3.27Å
142	G	92.4	Very high	85.6	Confident	2 Å²	2	29.9 Å²	29.9	2%	0.021	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	171.2	176.8	0	0	0	0	0	114.5	T24 G116 E139 G140	T24-G142 PolarHBondContact N-O 3.11Å; G116-G142 CarbonylContact O-C 3.56Å; G116-G142 WeakPolarHBondContact O-CA 3.48Å; E139-G142 WeakPolarHBondContact O-CA 3.33Å; E139-G142 PolarHBondContact O-N 3.18Å; G140-G142 PolarHBondContact O-N 2.81Å
143	L	94.3	Very high	84.2	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	137.6	-177.7	-59.7	-177.5	0	0	0	112.7	I14 T24 F26 L40 L44 G116 V117 C118	I14-L143 HydrophobicContact CD1-CD1 4.21Å; I14-L143 HydrophobicContact CG1-CD2 4.01Å; I14-L143 HydrophobicContact CG2-CD2 4.48Å; T24-L143 HydrophobicContact CG2-CD2 4.44Å; T24-L143 WeakPolarHBondContact O-CA 3.49Å; F26-L143 HydrophobicContact CD2-CD2 4.28Å; F26-L143 HydrophobicContact CE2-CD2 3.96Å; L40-L143 HydrophobicContact CB-CD1 4.38Å; L44-L143 HydrophobicContact CB-CD1 3.91Å; L44-L143 HydrophobicContact CB-CG 4.49Å; L44-L143 HydrophobicContact CD1-CG 4.28Å; L44-L143 HydrophobicContact CD2-CD1 4.12Å; L44-L143 HydrophobicContact CD2-CG 4.01Å; L44-L143 HydrophobicContact CG-CD1 4.42Å; L44-L143 HydrophobicContact CG-CG 4.49Å; G116-L143 PolarHBondContact O-N 2.95Å; V117-L143 CarbonylContact C-O 3.48Å; V117-L143 VanDerWaalsContact CA-O 3.32Å; V117-L143 WeakPolarHBondContact CA-O 3.48Å; V117-L143 HydrophobicContact CG1-CB 4.32Å; V117-L143 HydrophobicContact CG2-CB 4.24Å; C118-L143 PolarHBondContact N-O 2.78Å
144	I	95.4	Very high	83.1	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	120.4	169.8	-61.2	152.8	0	0	0	107.6	R23 T24 M25 F26 C118 V135 V138 I450	R23-I144 HydrophobicContact CB-CD1 4.41Å; T24-I144 PolarHBondContact O-N 3.45Å; M25-I144 CarbonylContact C-O 3.59Å; M25-I144 WeakPolarHBondContact CA-O 3.47Å; M25-I144 HydrophobicContact CE-CB 4.49Å; M25-I144 HydrophobicContact CE-CD1 4.37Å; M25-I144 HydrophobicContact CE-CG2 4.05Å; M25-I144 HydrophobicContact CG-CB 4.47Å; M25-I144 HydrophobicContact CG-CG2 4.43Å; F26-I144 PolarHBondContact N-O 3.49Å; C118-I144 CarbonylContact O-C 3.6Å; C118-I144 WeakPolarHBondContact O-CA 3.43Å; V135-I144 HydrophobicContact CB-CD1 4.29Å; V135-I144 HydrophobicContact CG1-CD1 3.76Å; V135-I144 HydrophobicContact CG2-CD1 4.18Å; V135-I144 HydrophobicContact CG2-CG2 4.33Å; V138-I144 HydrophobicContact CB-CG1 4.27Å; V138-I144 HydrophobicContact CG1-CG1 4.34Å; V138-I144 HydrophobicContact CG2-CG1 3.81Å; I144-I450 HydrophobicContact CD1-CD1 4.22Å; I144-I450 HydrophobicContact CD1-CG2 4.02Å
145	I	93.8	Very high	81.8	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	118.2	-175.7	-55.4	171	0	0	0	109.1	F26 V28 V37 L40 V117 C118 V119 L120 L147	F26-I145 HydrophobicContact CB-CG1 4.49Å; F26-I145 CarbonylContact O-C 3.54Å; F26-I145 WeakPolarHBondContact O-CA 3.2Å; V28-I145 HydrophobicContact CG2-CG2 4.04Å; V37-I145 HydrophobicContact CG1-CD1 4.04Å; V37-I145 HydrophobicContact CG2-CD1 4.48Å; V37-I145 HydrophobicContact CG2-CG2 4.28Å; L40-I145 HydrophobicContact CB-CD1 4.32Å; L40-I145 HydrophobicContact CD1-CD1 3.98Å; L40-I145 HydrophobicContact CD1-CG1 4.36Å; V117-I145 HydrophobicContact CG1-CD1 4.11Å; C118-I145 PolarHBondContact O-N 3.33Å; V119-I145 WeakPolarHBondContact CA-O 3.32Å; V119-I145 HydrophobicContact CG2-CB 4.48Å; V119-I145 HydrophobicContact CG2-CD1 4.48Å; L120-I145 PolarHBondContact N-O 3.3Å; I145-L147 HydrophobicContact CG2-CD2 3.8Å
146	L	91.3	Very high	80.7	Confident	10 Å²	10	38.2 Å²	38.2	5%	0.052	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	121.8	173.1	-73.7	157.2	0	0	0	108.6	M25 F26 I27 V28 L120 L126	M25-L146 HydrophobicContact CG-CD1 4.39Å; M25-L146 HydrophobicContact SD-CD1 3.9Å; F26-L146 PolarHBondContact O-N 3.39Å; I27-L146 WeakPolarHBondContact CA-O 3.34Å; I27-L146 HydrophobicContact CD1-CD1 4.38Å; I27-L146 HydrophobicContact CG1-CB 4.2Å; I27-L146 HydrophobicContact CG1-CD1 4Å; V28-L146 PolarHBondContact N-O 2.96Å; L120-L146 HydrophobicContact CB-CD2 3.79Å; L120-L146 HydrophobicContact CD1-CD2 3.52Å; L120-L146 HydrophobicContact CD1-CG 4.26Å; L120-L146 HydrophobicContact CG-CD2 4.26Å; L126-L146 HydrophobicContact CD1-CD2 3.34Å
147	L	88.9	Confident	79.8	Confident	11 Å²	11	37.9 Å²	37.9	6%	0.058	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	129.5	177	-55.1	-179.5	0	0	0	109.8	V28 A33 V37 W57 V119 L120 I145	V28-L147 HydrophobicContact CB-CD2 4.15Å; V28-L147 HydrophobicContact CG2-CD2 4.5Å; A33-L147 HydrophobicContact CB-CD2 4.06Å; V37-L147 HydrophobicContact CG2-CD2 4.01Å; W57-L147 HydrophobicContact CZ2-CD1 4.11Å; V119-L147 HydrophobicContact CG1-CD1 3.85Å; V119-L147 HydrophobicContact CG1-CG 4.14Å; L120-L147 PolarHBondContact O-N 3.13Å; I145-L147 HydrophobicContact CG2-CD2 3.8Å
148	L	83.9	Confident	78.7	Confident	12 Å²	12	39.8 Å²	39.8	6%	0.063	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	115.1	175.1	-68.6	174.7	0	0	0	108.6	I27 V28 I29 G30 F123 L151 L157	I27-L148 HydrophobicContact CG2-CD1 3.43Å; I27-L148 VanDerWaalsContact CG2-CD1 3.43Å; I27-L148 HydrophobicContact CG2-CG 4.14Å; V28-L148 PolarHBondContact O-N 2.95Å; I29-L148 HydrophobicContact CD1-CD1 4.33Å; I29-L148 HydrophobicContact CG1-CB 4.11Å; I29-L148 HydrophobicContact CG1-CD1 3.84Å; G30-L148 PolarHBondContact N-O 3.46Å; F123-L148 HydrophobicContact CB-CD2 3.32Å; F123-L148 HydrophobicContact CD1-CD2 3.75Å; F123-L148 HydrophobicContact CD2-CD2 3.92Å; F123-L148 HydrophobicContact CG-CD2 3.41Å; F123-L148 VanDerWaalsContact CG-CD2 3.41Å; L148-L151 HydrophobicContact CB-CD1 4.28Å; L148-L151 HydrophobicContact CD1-CD1 4.27Å; L148-L157 HydrophobicContact CD1-CD1 4.03Å; L148-L157 HydrophobicContact CD1-CD2 4.11Å; L148-L157 HydrophobicContact CD2-CD2 3.97Å
149	K	77.8	Confident	77.4	Confident	141 Å²	141	44.6 Å²	44.6	61%	0.613	23%	0.229	S	C	*	.			trans	-76	141.4	174	-70.1	-174	175.1	-176.8	0	110
150	T	63.7	Low	76.2	Confident	92 Å²	92	42.9 Å²	42.9	56%	0.564	22%	0.222	S	C	*	.			trans	20.8	100.9	170.3	4.8	0	0	0	0	117	D31	D31-T150 VanDerWaalsContact CG-CG2 3.41Å; D31-T150 VanDerWaalsContact OD1-CB 3.25Å; D31-T150 WeakPolarHBondContact OD1-CB 3.3Å; D31-T150 WeakPolarHBondContact OD1-CG2 3.3Å; D31-T150 PolarHBondContact OD1-OG1 3.38Å; D31-T150 WeakPolarHBondContact OD2-CG2 3.47Å
151	L	64.1	Low	74.8	Confident	25 Å²	25	44.8 Å²	44.8	13%	0.131	23%	0.231	C	C	.	.			trans	-123.8	132.2	168.2	-65.6	161	0	0	0	108.6	I29 L148 Q156 L157	I29-L151 HydrophobicContact CG2-CB 4.34Å; I29-L151 HydrophobicContact CG2-CD1 4.17Å; L148-L151 HydrophobicContact CB-CD1 4.28Å; L148-L151 HydrophobicContact CD1-CD1 4.27Å; L151-Q156 HydrophobicContact CD2-CB 4.01Å; L151-L157 HydrophobicContact CD1-CD1 3.72Å; L151-L157 HydrophobicContact CD1-CD2 3.55Å; L151-L157 HydrophobicContact CD1-CG 3.51Å; L151-L157 HydrophobicContact CD2-CD2 4.07Å; L151-L157 HydrophobicContact CD2-CG 4.1Å; L151-L157 HydrophobicContact CG-CD2 4.44Å; L151-L157 HydrophobicContact CG-CG 4.46Å
152	Q	53.5	Low	73.7	Confident	165 Å²	165	44.8 Å²	44.8	77%	0.771	23%	0.229	S	C	*	.	S	Bend	trans	-82.4	-30.2	172.1	-67.5	174.3	-22.9	0	0	110.9
153	S	59.2	Low	72.3	Confident	22 Å²	22	46.8 Å²	46.8	15%	0.154	24%	0.24	C	C	.	.			trans	-140.9	146.3	174.7	170.8	0	0	0	0	110.9	K155 Q156 E658	S153-K155 PolarHBondContact O-N 2.83Å; S153-K155 PolarHBondContact OG-N 2.7Å; S153-K155 VanDerWaalsContact OG-N 3.08Å; S153-Q156 WeakPolarHBondContact O-CB 3.37Å; S153-Q156 PolarHBondContact O-N 3.38Å; S153-Q156 VanDerWaalsContact O-N 3.15Å; S153-E658 WeakPolarHBondContact CB-OE1 3.36Å; S153-E658 PolarHBondContact OG-OE1 2.76Å; S153-E658 PolarHBondContact OG-OE2 3.11Å
154	L	64.4	Low	70.6	Confident	5 Å²	5	48 Å²	48	3%	0.026	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-22.6	172.1	-71.8	166.8	0	0	0	112.2	I29 Q156 L157 L206 L655 E658 I660	I29-L154 HydrophobicContact CD1-CD2 3.49Å; I29-L154 VanDerWaalsContact CD1-CD2 3.49Å; L154-Q156 VanDerWaalsContact C-N 3.27Å; L154-Q156 PolarHBondContact O-N 3.46Å; L154-L157 HydrophobicContact CD2-CD1 4.03Å; L154-L157 WeakPolarHBondContact O-CB 3.43Å; L154-L157 PolarHBondContact O-N 2.86Å; L154-L206 HydrophobicContact CD1-CD1 3.85Å; L154-L655 HydrophobicContact CG-CD2 4.14Å; L154-E658 WeakPolarHBondContact CB-OE2 3.39Å; L154-E658 PolarHBondContact N-OE2 2.78Å; L154-I660 HydrophobicContact CB-CD1 4.3Å; L154-I660 HydrophobicContact CD1-CD1 4.49Å
155	K	64.4	Low	69.6	Low	125 Å²	125	48 Å²	48	54%	0.543	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-24.5	175.7	-67.3	-177.7	-179.5	175.7	0	113	S153 L157 Y158	S153-K155 PolarHBondContact O-N 2.83Å; S153-K155 PolarHBondContact OG-N 2.7Å; S153-K155 VanDerWaalsContact OG-N 3.08Å; K155-L157 PolarHBondContact O-N 2.79Å; K155-Y158 HydrophobicContact CB-CD2 4.14Å; K155-Y158 HydrophobicContact CG-CD2 4.35Å; K155-Y158 HydrophobicContact CG-CE2 4.28Å; K155-Y158 VanDerWaalsContact O-CB 3.3Å; K155-Y158 WeakPolarHBondContact O-CB 3.33Å; K155-Y158 WeakPolarHBondContact O-CD2 3.45Å; K155-Y158 PolarHBondContact O-N 3.48Å
156	Q	66.4	Low	68.3	Low	74 Å²	74	55 Å²	55	35%	0.346	28%	0.277	S	S	.	.	H	α-helix	trans	-63.3	-24.7	175	-68.1	175.3	-20.7	0	0	112.1	L151 S153 L154 Y158 T159 M160	L151-Q156 HydrophobicContact CD2-CB 4.01Å; S153-Q156 WeakPolarHBondContact O-CB 3.37Å; S153-Q156 PolarHBondContact O-N 3.38Å; S153-Q156 VanDerWaalsContact O-N 3.15Å; L154-Q156 VanDerWaalsContact C-N 3.27Å; L154-Q156 PolarHBondContact O-N 3.46Å; Q156-Y158 PolarHBondContact O-N 3.3Å; Q156-T159 PolarHBondContact O-N 2.73Å; Q156-T159 PolarHBondContact O-OG1 2.82Å; Q156-M160 PolarHBondContact O-N 2.95Å
157	L	68.8	Low	67	Low	8 Å²	8	63 Å²	63	4%	0.042	31%	0.307	C	S	.	.	H	α-helix	trans	-65.3	-24.8	173.5	-70.3	167.8	0	0	0	113	F123 L148 L151 L154 K155 I185	F123-L157 HydrophobicContact CD1-CD2 4.23Å; F123-L157 HydrophobicContact CE1-CD2 4.12Å; L148-L157 HydrophobicContact CD1-CD1 4.03Å; L148-L157 HydrophobicContact CD1-CD2 4.11Å; L148-L157 HydrophobicContact CD2-CD2 3.97Å; L151-L157 HydrophobicContact CD1-CD1 3.72Å; L151-L157 HydrophobicContact CD1-CD2 3.55Å; L151-L157 HydrophobicContact CD1-CG 3.51Å; L151-L157 HydrophobicContact CD2-CD2 4.07Å; L151-L157 HydrophobicContact CD2-CG 4.1Å; L151-L157 HydrophobicContact CG-CD2 4.44Å; L151-L157 HydrophobicContact CG-CG 4.46Å; L154-L157 HydrophobicContact CD2-CD1 4.03Å; L154-L157 WeakPolarHBondContact O-CB 3.43Å; L154-L157 PolarHBondContact O-N 2.86Å; K155-L157 PolarHBondContact O-N 2.79Å; L157-I185 HydrophobicContact CB-CD1 3.43Å; L157-I185 VanDerWaalsContact CB-CD1 3.43Å; L157-I185 HydrophobicContact CD1-CD1 4.39Å
158	Y	67.3	Low	66.3	Low	41 Å²	41	63.9 Å²	63.9	16%	0.161	31%	0.31	C	S	.	.	H	α-helix	trans	-71.8	-31.7	176.6	-63.8	-49.2	0	0	0	113.2	K155 Q156 C178 E182 I185 I660	K155-Y158 HydrophobicContact CB-CD2 4.14Å; K155-Y158 HydrophobicContact CG-CD2 4.35Å; K155-Y158 HydrophobicContact CG-CE2 4.28Å; K155-Y158 VanDerWaalsContact O-CB 3.3Å; K155-Y158 WeakPolarHBondContact O-CB 3.33Å; K155-Y158 WeakPolarHBondContact O-CD2 3.45Å; K155-Y158 PolarHBondContact O-N 3.48Å; Q156-Y158 PolarHBondContact O-N 3.3Å; Y158-C178 WeakPolarHBondContact O-CB 3.26Å; Y158-E182 VanDerWaalsContact CD1-CA 3.45Å; Y158-E182 HydrophobicContact CD1-CB 3.71Å; Y158-E182 HydrophobicContact CD1-CG 3.85Å; Y158-E182 HydrophobicContact CE1-CB 4.05Å; Y158-E182 HydrophobicContact CE1-CG 3.84Å; Y158-I185 HydrophobicContact CD1-CD1 3.67Å; Y158-I185 HydrophobicContact CE1-CB 3.98Å; Y158-I185 HydrophobicContact CE1-CD1 3.63Å; Y158-I185 HydrophobicContact CE1-CG1 4.43Å; Y158-I185 HydrophobicContact CE1-CG2 4.17Å; Y158-I660 WeakPolarHBondContact OH-CG2 3.36Å
159	T	65.2	Low	65.8	Low	102 Å²	102	68.2 Å²	68.2	63%	0.626	33%	0.326	S	S	*	.	H	α-helix	trans	-100.2	-5.3	-175.3	55.4	0	0	0	0	112.6	Q156 S161	Q156-T159 PolarHBondContact O-N 2.73Å; Q156-T159 PolarHBondContact O-OG1 2.82Å; T159-S161 PolarHBondContact O-N 3.44Å
160	M	66	Low	65.3	Low	36 Å²	36	62.1 Å²	62.1	18%	0.177	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-63.2	118.3	-177.6	-162.1	-165.5	73.3	0	0	111.9	F123 E124 Q156 C178 N181	F123-M160 HydrophobicContact CD1-CE 3.28Å; F123-M160 HydrophobicContact CD1-SD 4.07Å; F123-M160 HydrophobicContact CE1-CE 3.76Å; F123-M160 HydrophobicContact CG-CE 4.34Å; E124-M160 HydrophobicContact CB-CE 4.05Å; E124-M160 HydrophobicContact CG-CE 3.42Å; E124-M160 VanDerWaalsContact CG-CE 3.42Å; E124-M160 HydrophobicContact CG-CG 4.3Å; E124-M160 HydrophobicContact CG-SD 3.57Å; E124-M160 VanDerWaalsContact CG-SD 3.57Å; Q156-M160 PolarHBondContact O-N 2.95Å; M160-C178 PolarHBondContact O-SG 2.98Å; M160-N181 PolarHBondContact O-ND2 3.22Å; M160-N181 VanDerWaalsContact O-ND2 3.15Å
161	S	60.5	Low	65.5	Low	62 Å²	62	61.1 Å²	61.1	43%	0.434	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-74.8	130.4	177.3	66.8	0	0	0	0	111.4	T159 H165	T159-S161 PolarHBondContact O-N 3.44Å; S161-H165 WeakPolarHBondContact CA-ND1 3.47Å
162	M	66.2	Low	65.8	Low	7 Å²	7	61.9 Å²	61.9	3%	0.034	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-90.5	159.4	177.1	-62.3	177.1	74.3	0	0	111.8	E124 L126 V164 H165 N181 Q519	E124-M162 WeakPolarHBondContact O-CA 3.33Å; E124-M162 WeakPolarHBondContact O-CB 3.46Å; L126-M162 WeakPolarHBondContact O-CE 3.47Å; M162-V164 PolarHBondContact O-N 2.75Å; M162-H165 PolarHBondContact N-CE1 2.66Å; M162-H165 VanDerWaalsContact N-CE1 3.3Å; M162-H165 PolarHBondContact N-ND1 3.17Å; M162-H165 VanDerWaalsContact O-CB 3.26Å; M162-H165 WeakPolarHBondContact O-CB 3.38Å; M162-H165 PolarHBondContact O-N 2.94Å; M162-N181 PolarHBondContact SD-OD1 3.14Å; M162-Q519 PolarHBondContact SD-NE2 3.4Å
163	D	64.1	Low	66.8	Low	44 Å²	44	56.8 Å²	56.8	24%	0.235	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-33.9	178.1	-80.6	-40.8	0	0	0	113.3	K60 E124 H165 K166	K60-D163 WeakPolarHBondContact CD-OD2 3.4Å; K60-D163 VanDerWaalsContact CE-OD2 3.22Å; K60-D163 WeakPolarHBondContact CE-OD2 3.07Å; K60-D163 IonicContact NZ-OD1 3.9Å; K60-D163 PolarHBondContact NZ-OD1 2.95Å; K60-D163 IonicContact NZ-OD2 3.6Å; K60-D163 PolarHBondContact NZ-OD2 2.98Å; E124-D163 PolarHBondContact O-N 3.3Å; D163-H165 PolarHBondContact O-N 2.67Å; D163-K166 PolarHBondContact O-N 3.25Å
164	V	58.4	Low	67.5	Low	25 Å²	25	62 Å²	62	15%	0.152	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-29	179.3	-173.6	0	0	0	0	111.3	T127 M162 K166 R167 F168	T127-V164 HydrophobicContact CG2-CG2 3.46Å; T127-V164 VanDerWaalsContact CG2-CG2 3.46Å; M162-V164 PolarHBondContact O-N 2.75Å; V164-K166 PolarHBondContact O-N 2.89Å; V164-K166 VanDerWaalsContact O-N 3.15Å; V164-R167 WeakPolarHBondContact O-CA 3.41Å; V164-R167 WeakPolarHBondContact O-CB 3.44Å; V164-R167 PolarHBondContact O-N 3.18Å; V164-F168 HydrophobicContact CB-CE2 4.45Å; V164-F168 HydrophobicContact CG1-CD2 4.33Å; V164-F168 HydrophobicContact CG1-CE1 3.85Å; V164-F168 HydrophobicContact CG1-CE2 3.62Å; V164-F168 HydrophobicContact CG1-CZ 3.34Å
165	H	74.3	Confident	68	Low	0 Å²	0	67.4 Å²	67.4	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-62	-26.6	-178.5	-59.4	163.1	0	0	0	112.3	S161 M162 D163 R167 F168 R169 V176 C178 D523	S161-H165 WeakPolarHBondContact CA-ND1 3.47Å; M162-H165 PolarHBondContact N-CE1 2.66Å; M162-H165 VanDerWaalsContact N-CE1 3.3Å; M162-H165 PolarHBondContact N-ND1 3.17Å; M162-H165 VanDerWaalsContact O-CB 3.26Å; M162-H165 WeakPolarHBondContact O-CB 3.38Å; M162-H165 PolarHBondContact O-N 2.94Å; D163-H165 PolarHBondContact O-N 2.67Å; H165-R167 PolarHBondContact O-N 2.94Å; H165-F168 AromaticContact CD2-CD2 3.97Å; H165-F168 PolarHBondContact O-N 3.4Å; H165-R169 WeakPolarHBondContact O-CG 3.45Å; H165-R169 PolarHBondContact O-N 2.8Å; H165-V176 HydrophobicContact CB-CB 4.4Å; H165-V176 HydrophobicContact CB-CG1 4.01Å; H165-V176 HydrophobicContact CB-CG2 4.29Å; H165-C178 PolarHBondContact CE1-SG 3.49Å; H165-D523 IonicContact CD2-OD2 2.71Å; H165-D523 IonicContact CE1-OD2 3.07Å; H165-D523 IonicContact NE2-OD2 2.73Å; H165-D523 PolarHBondContact NE2-OD2 2.87Å
166	K	66	Low	68.8	Low	147 Å²	147	62.8 Å²	62.8	64%	0.639	31%	0.313	S	S	*	.	H	α-helix	trans	-59.1	-28.7	171.3	-67.2	179.8	179.8	171.9	0	113	D163 V164	D163-K166 PolarHBondContact O-N 3.25Å; V164-K166 PolarHBondContact O-N 2.89Å; V164-K166 VanDerWaalsContact O-N 3.15Å
167	R	62.8	Low	69.4	Low	180 Å²	180	62.4 Å²	62.4	68%	0.679	32%	0.316	S	S	*	.	H	α-helix	trans	-84.1	-20.3	177.2	-59.7	-178.5	179.2	-177.4	-0.7	113.3	V164 H165 A573	V164-R167 WeakPolarHBondContact O-CA 3.41Å; V164-R167 WeakPolarHBondContact O-CB 3.44Å; V164-R167 PolarHBondContact O-N 3.18Å; H165-R167 PolarHBondContact O-N 2.94Å; R167-A573 HydrophobicContact CB-CB 4.24Å
168	F	74.7	Confident	70.1	Confident	29 Å²	29	62.7 Å²	62.7	13%	0.127	32%	0.318	C	S	.	.	H	α-helix	trans	-91	-15.7	-179.1	-62.3	-24.2	0	0	0	113.1	V164 H165 T170 Q519 M520 D523 A524	V164-F168 HydrophobicContact CB-CE2 4.45Å; V164-F168 HydrophobicContact CG1-CD2 4.33Å; V164-F168 HydrophobicContact CG1-CE1 3.85Å; V164-F168 HydrophobicContact CG1-CE2 3.62Å; V164-F168 HydrophobicContact CG1-CZ 3.34Å; H165-F168 AromaticContact CD2-CD2 3.97Å; H165-F168 PolarHBondContact O-N 3.4Å; F168-T170 PolarHBondContact O-N 3.48Å; F168-Q519 HydrophobicContact CE2-CG 4.34Å; F168-M520 HydrophobicContact CD1-CG 4.38Å; F168-M520 HydrophobicContact CE1-CB 3.87Å; F168-M520 HydrophobicContact CE1-CG 3.75Å; F168-M520 HydrophobicContact CZ-CB 3.73Å; F168-M520 HydrophobicContact CZ-CG 4.11Å; F168-D523 HydrophobicContact CD2-CB 4.27Å; F168-D523 HydrophobicContact CE2-CB 4.31Å; F168-A524 HydrophobicContact CB-CB 3.77Å; F168-A524 HydrophobicContact CD1-CB 4.05Å; F168-A524 HydrophobicContact CD2-CB 4Å; F168-A524 HydrophobicContact CG-CB 3.7Å
169	R	74.8	Confident	71	Confident	103 Å²	103	61.5 Å²	61.5	39%	0.389	31%	0.313	S	S	.	.			trans	-75.2	119.6	175.3	-70	174.9	-170.7	179.1	2.1	109.6	H165 H173 Q174 V176	H165-R169 WeakPolarHBondContact O-CG 3.45Å; H165-R169 PolarHBondContact O-N 2.8Å; R169-H173 WeakPolarHBondContact CA-O 3.25Å; R169-Q174 WeakPolarHBondContact CG-O 3.29Å; R169-Q174 PolarHBondContact NE-O 2.86Å; R169-V176 HydrophobicContact CG-CG2 3.65Å
170	T	66.2	Low	72.1	Confident	13 Å²	13	56.8 Å²	56.8	8%	0.08	28%	0.284	C	S	.	.			trans	-95.2	169.4	164.2	61.5	0	0	0	0	109.2	F168 A172 H173	F168-T170 PolarHBondContact O-N 3.48Å; T170-A172 VanDerWaalsContact C-N 3.26Å; T170-A172 PolarHBondContact O-N 2.9Å; T170-H173 PolarHBondContact N-O 3Å; T170-H173 CarbonylContact O-C 3.53Å; T170-H173 PolarHBondContact O-N 3.11Å; T170-H173 WeakPolarHBondContact OG1-CB 3.49Å; T170-H173 PolarHBondContact OG1-N 3.4Å; T170-H173 VanDerWaalsContact OG1-N 3.1Å
171	E	68.9	Low	73	Confident	70 Å²	70	55 Å²	55	33%	0.327	28%	0.276	S	S	.	.	S	Bend	trans	-60.5	-39.7	176.2	-169.1	169.3	-167.9	0	0	111.4	I557 S558 S561	E171-I557 WeakPolarHBondContact OE2-CA 3.15Å; E171-I557 WeakPolarHBondContact OE2-CG2 3.39Å; E171-S558 WeakPolarHBondContact OE1-CB 3.28Å; E171-S558 PolarHBondContact OE1-OG 2.88Å; E171-S558 PolarHBondContact OE2-N 2.83Å; E171-S561 PolarHBondContact OE1-OG 2.87Å; E171-S561 PolarHBondContact OE2-OG 3.04Å
172	A	68.6	Low	74	Confident	42 Å²	42	53 Å²	53	35%	0.347	26%	0.26	S	S	.	.	S	Bend	trans	-73.3	-29.8	176.5	0	0	0	0	0	113.9	T170 Q556	T170-A172 VanDerWaalsContact C-N 3.26Å; T170-A172 PolarHBondContact O-N 2.9Å; A172-Q556 HydrophobicContact CB-CB 4.43Å
173	H	74.6	Confident	75.1	Confident	57 Å²	57	52.7 Å²	52.7	26%	0.264	26%	0.258	S	S	.	.			trans	-128.3	89.1	-175.2	-59.5	-66.3	0	0	0	112.2	R169 T170 P525	R169-H173 WeakPolarHBondContact CA-O 3.25Å; T170-H173 PolarHBondContact N-O 3Å; T170-H173 CarbonylContact O-C 3.53Å; T170-H173 PolarHBondContact O-N 3.11Å; T170-H173 WeakPolarHBondContact OG1-CB 3.49Å; T170-H173 PolarHBondContact OG1-N 3.4Å; T170-H173 VanDerWaalsContact OG1-N 3.1Å; H173-P525 HydrophobicContact CB-CB 4.07Å; H173-P525 HydrophobicContact CB-CG 3.72Å
174	Q	74.1	Confident	76.3	Confident	131 Å²	131	50.9 Å²	50.9	61%	0.612	25%	0.248	S	C	*	.			trans	-92.5	-25.6	-178.1	-59.3	-173.3	8	0	0	113.9	R169 V176	R169-Q174 WeakPolarHBondContact CG-O 3.29Å; R169-Q174 PolarHBondContact NE-O 2.86Å; Q174-V176 PolarHBondContact O-N 3.35Å
175	T	76.6	Confident	77.5	Confident	119 Å²	119	50.1 Å²	50.1	73%	0.73	24%	0.243	S	C	*	.			trans	-80.7	114.8	-177.7	49.4	0	0	0	0	110.6	P525	T175-P525 WeakPolarHBondContact O-CB 3.47Å; T175-P525 WeakPolarHBondContact O-CG 3.45Å
176	V	79.4	Confident	78	Confident	28 Å²	28	50.8 Å²	50.8	17%	0.17	25%	0.246	C	C	.	.			trans	-106.6	134.7	179.8	179.5	0	0	0	0	109.1	H165 R169 Q174 D523 P525	H165-V176 HydrophobicContact CB-CB 4.4Å; H165-V176 HydrophobicContact CB-CG1 4.01Å; H165-V176 HydrophobicContact CB-CG2 4.29Å; R169-V176 HydrophobicContact CG-CG2 3.65Å; Q174-V176 PolarHBondContact O-N 3.35Å; V176-D523 HydrophobicContact CG1-CB 4.23Å; V176-P525 HydrophobicContact CG2-CG 4.43Å
177	T	80.1	Confident	79.1	Confident	66 Å²	66	43.8 Å²	43.8	41%	0.405	22%	0.216	S	C	.	.			trans	-108.8	122.4	177.1	34.2	0	0	0	0	108.7	R179 D523	T177-R179 VanDerWaalsContact C-N 3.33Å; T177-R179 PolarHBondContact O-N 3.3Å; T177-R179 VanDerWaalsContact OG1-CZ 3.26Å; T177-R179 PolarHBondContact OG1-NH1 3.26Å; T177-R179 PolarHBondContact OG1-NH2 3.42Å; T177-D523 WeakPolarHBondContact O-CA 3.36Å
178	C	82.7	Confident	80.2	Confident	14 Å²	14	35.7 Å²	35.7	10%	0.095	19%	0.187	C	C	.	.			trans	-88.6	64.9	-168.5	-49.2	0	0	0	0	112.2	Y158 M160 H165 F180 N181 E182	Y158-C178 WeakPolarHBondContact O-CB 3.26Å; M160-C178 PolarHBondContact O-SG 2.98Å; H165-C178 PolarHBondContact CE1-SG 3.49Å; C178-F180 VanDerWaalsContact C-N 3.33Å; C178-F180 PolarHBondContact O-N 2.85Å; C178-N181 HydrophobicContact CB-CB 4.32Å; C178-N181 PolarHBondContact O-N 3.14Å; C178-E182 PolarHBondContact O-N 2.77Å
179	R	86.2	Confident	80.6	Confident	16 Å²	16	35.1 Å²	35.1	6%	0.06	19%	0.187	C	C	.	.	H	α-helix	trans	-65.5	-34.3	-177.6	-63.7	-176.7	-174.8	72	15.8	112.9	T177 N181 E182 R183 D486 F489 S522 D523	T177-R179 VanDerWaalsContact C-N 3.33Å; T177-R179 PolarHBondContact O-N 3.3Å; T177-R179 VanDerWaalsContact OG1-CZ 3.26Å; T177-R179 PolarHBondContact OG1-NH1 3.26Å; T177-R179 PolarHBondContact OG1-NH2 3.42Å; R179-N181 VanDerWaalsContact C-N 3.32Å; R179-N181 PolarHBondContact O-N 2.92Å; R179-E182 PolarHBondContact O-N 3.42Å; R179-R183 PolarHBondContact O-N 2.89Å; R179-R183 VanDerWaalsContact O-N 3.09Å; R179-D486 IonicContact CZ-OD1 3.05Å; R179-D486 VanDerWaalsContact CZ-OD1 3.23Å; R179-D486 IonicContact CZ-OD2 2.79Å; R179-D486 VanDerWaalsContact NE-CG 3.29Å; R179-D486 IonicContact NE-OD1 3.93Å; R179-D486 PolarHBondContact NE-OD1 3.34Å; R179-D486 IonicContact NE-OD2 3.98Å; R179-D486 VanDerWaalsContact NH2-CG 3.3Å; R179-D486 IonicContact NH2-OD1 3.71Å; R179-D486 PolarHBondContact NH2-OD1 3.18Å; R179-D486 IonicContact NH2-OD2 2.78Å; R179-D486 PolarHBondContact NH2-OD2 2.79Å; R179-F489 HydrophobicContact CB-CB 3.99Å; R179-F489 HydrophobicContact CB-CD2 4.47Å; R179-F489 HydrophobicContact CB-CG 4.41Å; R179-S522 WeakPolarHBondContact CD-O 3.49Å; R179-S522 PolarHBondContact NH1-O 3.36Å; R179-D523 PolarHBondContact N-OD1 3.41Å; R179-D523 VanDerWaalsContact N-OD1 3.11Å
180	F	88.9	Confident	81	Confident	3 Å²	3	33.8 Å²	33.8	1%	0.013	19%	0.187	C	C	.	.	H	α-helix	trans	-63.3	-39.9	178.5	-176.4	-100.3	0	0	0	112.1	P128 C178 E182 R183 L184 L518 Q519 S522 D523	P128-F180 HydrophobicContact CB-CZ 4.17Å; P128-F180 HydrophobicContact CG-CE1 3.96Å; P128-F180 HydrophobicContact CG-CE2 4.01Å; P128-F180 HydrophobicContact CG-CZ 3.64Å; C178-F180 VanDerWaalsContact C-N 3.33Å; C178-F180 PolarHBondContact O-N 2.85Å; F180-E182 VanDerWaalsContact C-N 3.34Å; F180-R183 PolarHBondContact O-N 3.42Å; F180-L184 HydrophobicContact CE1-CB 4.46Å; F180-L184 HydrophobicContact CE1-CD2 4.32Å; F180-L184 VanDerWaalsContact O-CB 3.31Å; F180-L184 WeakPolarHBondContact O-CB 3.34Å; F180-L184 PolarHBondContact O-N 3.02Å; F180-L518 HydrophobicContact CE2-CD2 4.19Å; F180-Q519 HydrophobicContact CB-CG 4.24Å; F180-Q519 HydrophobicContact CG-CB 4.44Å; F180-Q519 HydrophobicContact CG-CG 4.3Å; F180-S522 WeakPolarHBondContact CB-OG 3.22Å; F180-D523 PolarHBondContact N-OD1 2.93Å
181	N	84.8	Confident	82	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.9	-40.6	179.5	-69.3	-9.8	0	0	0	111.1	M160 M162 C178 R179 L184 I185	M160-N181 PolarHBondContact O-ND2 3.22Å; M160-N181 VanDerWaalsContact O-ND2 3.15Å; M162-N181 PolarHBondContact SD-OD1 3.14Å; C178-N181 HydrophobicContact CB-CB 4.32Å; C178-N181 PolarHBondContact O-N 3.14Å; R179-N181 VanDerWaalsContact C-N 3.32Å; R179-N181 PolarHBondContact O-N 2.92Å; N181-L184 PolarHBondContact O-N 3.39Å; N181-I185 VanDerWaalsContact O-CD1 3.31Å; N181-I185 WeakPolarHBondContact O-CD1 3.07Å; N181-I185 VanDerWaalsContact O-CG1 3.27Å; N181-I185 WeakPolarHBondContact O-CG1 3.37Å; N181-I185 PolarHBondContact O-N 2.96Å
182	E	82.9	Confident	82.7	Confident	20 Å²	20	36.1 Å²	36.1	9%	0.093	20%	0.196	C	C	.	.	H	α-helix	trans	-57.6	-51.5	173.4	-173.6	173.8	-175.9	0	0	112	Y158 C178 R179 F180 L184 I185 L186 R663	Y158-E182 VanDerWaalsContact CD1-CA 3.45Å; Y158-E182 HydrophobicContact CD1-CB 3.71Å; Y158-E182 HydrophobicContact CD1-CG 3.85Å; Y158-E182 HydrophobicContact CE1-CB 4.05Å; Y158-E182 HydrophobicContact CE1-CG 3.84Å; C178-E182 PolarHBondContact O-N 2.77Å; R179-E182 PolarHBondContact O-N 3.42Å; F180-E182 VanDerWaalsContact C-N 3.34Å; E182-L184 VanDerWaalsContact C-N 3.34Å; E182-L184 PolarHBondContact O-N 3.45Å; E182-I185 PolarHBondContact O-N 3.08Å; E182-L186 HydrophobicContact CG-CD1 4.14Å; E182-L186 VanDerWaalsContact O-CG 3.3Å; E182-L186 WeakPolarHBondContact O-CG 3.17Å; E182-L186 PolarHBondContact O-N 3.25Å; E182-L186 VanDerWaalsContact O-N 3.11Å; E182-R663 IonicContact OE1-CZ 3.25Å; E182-R663 IonicContact OE1-NE 3.52Å; E182-R663 PolarHBondContact OE1-NE 3.15Å; E182-R663 IonicContact OE1-NH2 3.59Å; E182-R663 IonicContact OE2-CZ 2.61Å; E182-R663 IonicContact OE2-NE 2.76Å; E182-R663 PolarHBondContact OE2-NE 3.5Å; E182-R663 IonicContact OE2-NH2 2.65Å; E182-R663 PolarHBondContact OE2-NH2 2.9Å
183	R	88.6	Confident	83.6	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-59.6	-42.4	175.1	-175	171.2	177.1	-117.6	-4	112.8	R179 F180 L186 S187 N456 L457 C459 Y491 E496 L518	R179-R183 PolarHBondContact O-N 2.89Å; R179-R183 VanDerWaalsContact O-N 3.09Å; F180-R183 PolarHBondContact O-N 3.42Å; R183-L186 PolarHBondContact O-N 3.02Å; R183-S187 WeakPolarHBondContact O-CB 3.44Å; R183-S187 PolarHBondContact O-N 2.81Å; R183-S187 PolarHBondContact O-OG 3.37Å; R183-N456 PolarHBondContact NH2-O 3.23Å; R183-L457 HydrophobicContact CG-CD1 4.42Å; R183-L457 VanDerWaalsContact CZ-O 3.29Å; R183-L457 PolarHBondContact NH1-O 2.92Å; R183-L457 PolarHBondContact NH2-O 3.39Å; R183-C459 PolarHBondContact NH2-SG 3.35Å; R183-C459 VanDerWaalsContact NH2-SG 3.41Å; R183-Y491 HydrophobicContact CG-CD2 3.96Å; R183-E496 IonicContact CZ-OE1 2.81Å; R183-E496 IonicContact CZ-OE2 2.69Å; R183-E496 IonicContact NE-OE1 3.72Å; R183-E496 PolarHBondContact NE-OE1 3.33Å; R183-E496 IonicContact NE-OE2 3.73Å; R183-E496 PolarHBondContact NE-OE2 3.48Å; R183-E496 IonicContact NH2-OE1 3.78Å; R183-E496 IonicContact NH2-OE2 3.06Å; R183-E496 PolarHBondContact NH2-OE2 2.91Å; R183-L518 VanDerWaalsContact NH1-CD2 3.34Å
184	L	88.4	Confident	84.4	Confident	6 Å²	6	32.4 Å²	32.4	3%	0.031	17%	0.172	C	C	.	.	H	α-helix	trans	-60	-48.6	-179.7	174.4	62.1	0	0	0	111.1	F123 L131 F180 N181 E182 S187 L188 W453 L457	F123-L184 HydrophobicContact CE2-CD2 3.72Å; F123-L184 HydrophobicContact CZ-CD2 3.77Å; L131-L184 HydrophobicContact CD1-CD1 4.48Å; F180-L184 HydrophobicContact CE1-CB 4.46Å; F180-L184 HydrophobicContact CE1-CD2 4.32Å; F180-L184 VanDerWaalsContact O-CB 3.31Å; F180-L184 WeakPolarHBondContact O-CB 3.34Å; F180-L184 PolarHBondContact O-N 3.02Å; N181-L184 PolarHBondContact O-N 3.39Å; E182-L184 VanDerWaalsContact C-N 3.34Å; E182-L184 PolarHBondContact O-N 3.45Å; L184-S187 PolarHBondContact O-N 3.46Å; L184-S187 PolarHBondContact O-OG 3.26Å; L184-L188 HydrophobicContact CD1-CD1 4.11Å; L184-L188 HydrophobicContact CD1-CG 4.34Å; L184-L188 HydrophobicContact CG-CD1 4.01Å; L184-L188 VanDerWaalsContact O-CG 3.27Å; L184-L188 WeakPolarHBondContact O-CG 3.36Å; L184-L188 PolarHBondContact O-N 3.31Å; L184-W453 HydrophobicContact CD1-CH2 4.38Å; L184-W453 HydrophobicContact CD1-CZ2 3.84Å; L184-L457 HydrophobicContact CD1-CD1 4.42Å; L184-L457 HydrophobicContact CD1-CD2 3.47Å; L184-L457 VanDerWaalsContact CD1-CD2 3.47Å
185	I	84.1	Confident	85.1	Confident	9 Å²	9	26.1 Å²	26.1	5%	0.046	14%	0.143	C	C	.	.	H	α-helix	trans	-66.4	-43.2	-178.4	-63.9	156.8	0	0	0	111.1	L157 Y158 N181 E182 S187 L188 A189 I660	L157-I185 HydrophobicContact CB-CD1 3.43Å; L157-I185 VanDerWaalsContact CB-CD1 3.43Å; L157-I185 HydrophobicContact CD1-CD1 4.39Å; Y158-I185 HydrophobicContact CD1-CD1 3.67Å; Y158-I185 HydrophobicContact CE1-CB 3.98Å; Y158-I185 HydrophobicContact CE1-CD1 3.63Å; Y158-I185 HydrophobicContact CE1-CG1 4.43Å; Y158-I185 HydrophobicContact CE1-CG2 4.17Å; N181-I185 VanDerWaalsContact O-CD1 3.31Å; N181-I185 WeakPolarHBondContact O-CD1 3.07Å; N181-I185 VanDerWaalsContact O-CG1 3.27Å; N181-I185 WeakPolarHBondContact O-CG1 3.37Å; N181-I185 PolarHBondContact O-N 2.96Å; E182-I185 PolarHBondContact O-N 3.08Å; I185-S187 VanDerWaalsContact C-N 3.28Å; I185-S187 PolarHBondContact O-N 3.01Å; I185-L188 WeakPolarHBondContact O-CB 3.42Å; I185-L188 PolarHBondContact O-N 2.96Å; I185-L188 VanDerWaalsContact O-N 3.17Å; I185-A189 PolarHBondContact O-N 2.97Å; I185-I660 HydrophobicContact CG2-CD1 3.51Å
186	L	84.4	Confident	85.5	Confident	13 Å²	13	20.9 Å²	20.9	7%	0.068	11%	0.11	C	C	.	.	H	α-helix	trans	-61.6	-38.7	175.1	-67	172.1	0	0	0	111.5	E182 R183 A189 D190 Y491 I660	E182-L186 HydrophobicContact CG-CD1 4.14Å; E182-L186 VanDerWaalsContact O-CG 3.3Å; E182-L186 WeakPolarHBondContact O-CG 3.17Å; E182-L186 PolarHBondContact O-N 3.25Å; E182-L186 VanDerWaalsContact O-N 3.11Å; R183-L186 PolarHBondContact O-N 3.02Å; L186-A189 WeakPolarHBondContact O-CB 3.41Å; L186-A189 PolarHBondContact O-N 3.33Å; L186-D190 PolarHBondContact O-N 3.48Å; L186-Y491 HydrophobicContact CB-CD1 3.61Å; L186-Y491 HydrophobicContact CB-CE1 4.36Å; L186-Y491 HydrophobicContact CB-CG 3.84Å; L186-I660 HydrophobicContact CD2-CG2 3.48Å; L186-I660 VanDerWaalsContact CD2-CG2 3.48Å
187	S	88.8	Confident	85.9	Confident	1 Å²	1	19.6 Å²	19.6	1%	0.007	10%	0.102	C	C	.	.	H	α-helix	trans	-67.7	-34.1	175.3	81.2	0	0	0	0	113.4	R183 L184 I185 A189 D190 C191 W453	R183-S187 WeakPolarHBondContact O-CB 3.44Å; R183-S187 PolarHBondContact O-N 2.81Å; R183-S187 PolarHBondContact O-OG 3.37Å; L184-S187 PolarHBondContact O-N 3.46Å; L184-S187 PolarHBondContact O-OG 3.26Å; I185-S187 VanDerWaalsContact C-N 3.28Å; I185-S187 PolarHBondContact O-N 3.01Å; S187-A189 VanDerWaalsContact C-N 3.3Å; S187-D190 PolarHBondContact O-N 3.43Å; S187-C191 PolarHBondContact O-N 2.77Å; S187-W453 VanDerWaalsContact O-CD1 3.3Å; S187-W453 PolarHBondContact O-NE1 3.29Å; S187-W453 PolarHBondContact OG-NE1 2.99Å
188	L	86	Confident	86.2	Confident	10 Å²	10	17.9 Å²	17.9	5%	0.052	9%	0.091	C	C	.	.	H	α-helix	trans	-68.7	-33.7	176.2	-73	163.2	0	0	0	111	M25 I27 L184 I185 D190 C191 W453	M25-L188 HydrophobicContact SD-CD2 3.59Å; M25-L188 VanDerWaalsContact SD-CD2 3.59Å; I27-L188 HydrophobicContact CD1-CB 4.47Å; I27-L188 HydrophobicContact CD1-CD1 3.63Å; I27-L188 HydrophobicContact CD1-CD2 4.14Å; I27-L188 HydrophobicContact CD1-CG 4.29Å; L184-L188 HydrophobicContact CD1-CD1 4.11Å; L184-L188 HydrophobicContact CD1-CG 4.34Å; L184-L188 HydrophobicContact CG-CD1 4.01Å; L184-L188 VanDerWaalsContact O-CG 3.27Å; L184-L188 WeakPolarHBondContact O-CG 3.36Å; L184-L188 PolarHBondContact O-N 3.31Å; I185-L188 WeakPolarHBondContact O-CB 3.42Å; I185-L188 PolarHBondContact O-N 2.96Å; I185-L188 VanDerWaalsContact O-N 3.17Å; L188-D190 VanDerWaalsContact C-N 3.3Å; L188-D190 PolarHBondContact O-N 3.43Å; L188-C191 WeakPolarHBondContact O-CB 3.03Å; L188-C191 PolarHBondContact O-N 3.28Å; L188-W453 HydrophobicContact CD2-CH2 3.96Å; L188-W453 HydrophobicContact CD2-CZ2 3.37Å; L188-W453 HydrophobicContact CG-CZ2 3.9Å
189	A	83.1	Confident	86.2	Confident	17 Å²	17	18.9 Å²	18.9	14%	0.14	10%	0.095	C	C	.	.	H	α-helix	trans	-65.9	-30.6	171	0	0	0	0	0	112.8	I185 L186 S187 C191 L206 S207	I185-A189 PolarHBondContact O-N 2.97Å; L186-A189 WeakPolarHBondContact O-CB 3.41Å; L186-A189 PolarHBondContact O-N 3.33Å; S187-A189 VanDerWaalsContact C-N 3.3Å; A189-C191 VanDerWaalsContact C-N 3.34Å; A189-L206 HydrophobicContact CB-CD2 3.73Å; A189-L206 HydrophobicContact CB-CG 4.35Å; A189-S207 WeakPolarHBondContact O-CB 3.19Å; A189-S207 PolarHBondContact O-OG 3.25Å
190	D	84.4	Confident	86	Confident	74 Å²	74	22.9 Å²	22.9	40%	0.396	12%	0.118	S	C	.	.	H	α-helix	trans	-78.2	-20.5	175.5	-162.7	41.3	0	0	0	113.3	L186 S187 L188 K192 K209 Y491	L186-D190 PolarHBondContact O-N 3.48Å; S187-D190 PolarHBondContact O-N 3.43Å; L188-D190 VanDerWaalsContact C-N 3.3Å; L188-D190 PolarHBondContact O-N 3.43Å; D190-K192 PolarHBondContact O-N 3Å; D190-K209 IonicContact OD1-NZ 2.68Å; D190-K209 PolarHBondContact OD1-NZ 3.25Å; D190-Y491 HydrophobicContact CB-CE1 4.15Å; D190-Y491 WeakPolarHBondContact CB-OH 3.14Å
191	C	86.4	Confident	85.8	Confident	7 Å²	7	23 Å²	23	5%	0.047	12%	0.119	C	C	.	.			trans	-71.9	114.4	-177.4	-173	0	0	0	0	112.2	S187 L188 A189 R193 C194 W453	S187-C191 PolarHBondContact O-N 2.77Å; L188-C191 WeakPolarHBondContact O-CB 3.03Å; L188-C191 PolarHBondContact O-N 3.28Å; A189-C191 VanDerWaalsContact C-N 3.34Å; C191-R193 PolarHBondContact O-N 3.4Å; C191-C194 HydrophobicContact CB-CB 3.88Å; C191-C194 PolarHBondContact O-N 2.82Å; C191-W453 HydrophobicContact CB-CB 4.43Å; C191-W453 HydrophobicContact CB-CG 4.1Å
192	K	84.6	Confident	85.8	Confident	126 Å²	126	24.7 Å²	24.7	55%	0.548	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-29.1	177.9	-62.8	-179.7	-177.4	177.5	0	113.2	M13 D190	M13-K192 WeakPolarHBondContact CE-O 3.17Å; D190-K192 PolarHBondContact O-N 3Å
193	R	87.6	Confident	85.8	Confident	14 Å²	14	24.2 Å²	24.2	5%	0.053	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101	18.2	-175.2	-70.3	-165.4	171.1	-101.3	7.9	116	M13 N16 G17 R23 M25 C191 D449 I450	M13-R193 HydrophobicContact CE-CB 3.96Å; M13-R193 HydrophobicContact CE-CG 3.74Å; N16-R193 PolarHBondContact O-NH2 2.75Å; G17-R193 VanDerWaalsContact CA-NH1 3.28Å; R23-R193 WeakPolarHBondContact O-CD 3.31Å; M25-R193 PolarHBondContact N-O 3.09Å; C191-R193 PolarHBondContact O-N 3.4Å; R193-D449 HydrophobicContact CB-CB 4.23Å; R193-D449 WeakPolarHBondContact CD-OD2 3.26Å; R193-D449 HydrophobicContact CG-CB 3.95Å; R193-D449 IonicContact NE-OD2 2.65Å; R193-D449 PolarHBondContact NE-OD2 3.19Å; R193-I450 HydrophobicContact CB-CD1 4.42Å; R193-I450 HydrophobicContact CB-CG1 4.03Å
194	C	89.6	Confident	85.3	Confident	6 Å²	6	24.4 Å²	24.4	4%	0.041	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	128.3	176.8	-174.5	0	0	0	0	110.9	M25 C191	M25-C194 HydrophobicContact CB-CB 4.35Å; M25-C194 WeakPolarHBondContact O-CA 3.23Å; C191-C194 HydrophobicContact CB-CB 3.88Å; C191-C194 PolarHBondContact O-N 2.82Å
195	L	88.8	Confident	84.4	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	131.2	172.4	-71.8	175	0	0	0	110.5	M13 M25 F26 I27 V197 V203 T210	M13-L195 HydrophobicContact CB-CD1 3.82Å; M13-L195 HydrophobicContact CG-CD1 3.85Å; M13-L195 HydrophobicContact CG-CG 4.45Å; M25-L195 PolarHBondContact O-N 2.95Å; F26-L195 WeakPolarHBondContact CA-O 3.5Å; F26-L195 HydrophobicContact CD1-CB 3.89Å; F26-L195 HydrophobicContact CE1-CB 3.81Å; F26-L195 HydrophobicContact CE1-CD1 3.75Å; F26-L195 HydrophobicContact CE1-CG 4.36Å; F26-L195 HydrophobicContact CZ-CD1 4.21Å; I27-L195 PolarHBondContact N-O 2.84Å; L195-V197 HydrophobicContact CB-CG2 4.31Å; L195-V203 HydrophobicContact CD2-CG1 4.12Å; L195-T210 HydrophobicContact CD2-CG2 4.28Å
196	V	86.7	Confident	83.6	Confident	9 Å²	9	27.1 Å²	27.1	6%	0.055	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	128.8	172.1	-170.9	0	0	0	0	108.7	I27 I29 V203 L204 L206	I27-V196 HydrophobicContact CB-CG1 4.35Å; I27-V196 HydrophobicContact CB-CG2 4.23Å; I27-V196 HydrophobicContact CD1-CG2 4.22Å; I27-V196 HydrophobicContact CG2-CG1 4.37Å; I27-V196 WeakPolarHBondContact O-CA 3.22Å; I29-V196 HydrophobicContact CD1-CG1 3.52Å; I29-V196 HydrophobicContact CG1-CG1 4.27Å; V196-V203 WeakPolarHBondContact O-CA 3.35Å; V196-L204 HydrophobicContact CB-CB 4.43Å; V196-L204 HydrophobicContact CG1-CB 4.39Å; V196-L204 HydrophobicContact CG1-CD1 3.97Å; V196-L204 HydrophobicContact CG1-CG 4.49Å; V196-L204 PolarHBondContact O-N 3.32Å; V196-L206 HydrophobicContact CB-CB 4.48Å; V196-L206 HydrophobicContact CG2-CB 4.08Å; V196-L206 HydrophobicContact CG2-CD1 4.19Å; V196-L206 HydrophobicContact CG2-CD2 3.81Å; V196-L206 HydrophobicContact CG2-CG 4.25Å
197	V	87.6	Confident	82.6	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	142.6	-169	-172.3	0	0	0	0	108.6	I10 F26 I27 V28 I29 L195 L201 T202 V203	I10-V197 HydrophobicContact CD1-CG1 4.08Å; I10-V197 HydrophobicContact CD1-CG2 4.26Å; F26-V197 HydrophobicContact CD1-CG2 4Å; F26-V197 HydrophobicContact CE1-CG2 4.42Å; I27-V197 PolarHBondContact O-N 2.95Å; V28-V197 CarbonylContact C-O 3.58Å; V28-V197 WeakPolarHBondContact CA-O 3.43Å; I29-V197 PolarHBondContact N-O 3.4Å; L195-V197 HydrophobicContact CB-CG2 4.31Å; V197-L201 HydrophobicContact CG1-CB 4.3Å; V197-L201 HydrophobicContact CG1-CD2 3.83Å; V197-T202 WeakPolarHBondContact CA-O 3.46Å; V197-V203 HydrophobicContact CG2-CG2 4.4Å
198	N	86.1	Confident	81.3	Confident	30 Å²	30	31.8 Å²	31.8	16%	0.16	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	176.7	172.6	68	-5.3	0	0	0	112.4	I29 D200 L201 T202	I29-N198 CarbonylContact O-C 3.58Å; I29-N198 WeakPolarHBondContact O-CA 3.49Å; N198-D200 PolarHBondContact O-N 3.49Å; N198-D200 PolarHBondContact OD1-N 3Å; N198-L201 PolarHBondContact O-N 3.47Å; N198-L201 PolarHBondContact OD1-N 3.38Å; N198-T202 PolarHBondContact N-O 2.94Å; N198-T202 VanDerWaalsContact N-O 3.09Å; N198-T202 PolarHBondContact ND2-OG1 2.91Å; N198-T202 WeakPolarHBondContact OD1-CA 3.38Å; N198-T202 WeakPolarHBondContact OD1-CB 3.32Å; N198-T202 PolarHBondContact OD1-N 3.2Å; N198-T202 PolarHBondContact OD1-O 3.28Å; N198-T202 VanDerWaalsContact OD1-O 3.14Å; N198-T202 PolarHBondContact OD1-OG1 3.06Å
199	D	82.3	Confident	80.3	Confident	35 Å²	35	36.4 Å²	36.4	19%	0.187	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-26	175.6	-78.1	-11.6	0	0	0	114.9	I29 G30 D31 K32 A33 Q36 L201	I29-D199 PolarHBondContact O-N 2.87Å; G30-D199 WeakPolarHBondContact CA-OD1 3.21Å; G30-D199 VanDerWaalsContact CA-OD2 3.23Å; G30-D199 WeakPolarHBondContact CA-OD2 3.48Å; G30-D199 PolarHBondContact N-OD1 3.17Å; D31-D199 PolarHBondContact N-OD2 2.78Å; K32-D199 HydrophobicContact CB-CB 4.42Å; K32-D199 PolarHBondContact N-OD1 3.05Å; K32-D199 PolarHBondContact N-OD2 2.65Å; A33-D199 WeakPolarHBondContact CA-OD1 3.48Å; A33-D199 PolarHBondContact N-OD1 2.8Å; Q36-D199 WeakPolarHBondContact CG-O 3.33Å; Q36-D199 PolarHBondContact NE2-O 2.84Å; D199-L201 VanDerWaalsContact C-N 3.32Å
200	D	81.4	Confident	79.4	Confident	101 Å²	101	36 Å²	36	54%	0.54	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	7.5	-179.4	-93.3	9.4	0	0	0	113.9	K4 N198 T202	K4-D200 IonicContact NZ-OD2 3.17Å; K4-D200 PolarHBondContact NZ-OD2 3.22Å; N198-D200 PolarHBondContact O-N 3.49Å; N198-D200 PolarHBondContact OD1-N 3Å; D200-T202 HydrophobicContact CB-CG2 4.26Å; D200-T202 PolarHBondContact O-N 3.3Å
201	L	84.4	Confident	78.3	Confident	6 Å²	6	36.7 Å²	36.7	3%	0.031	20%	0.198	C	C	.	.	S	Bend	trans	57.4	30	-172.5	-66.8	175.6	0	0	0	114.6	I6 I10 Q36 I39 L40 V197 N198 D199	I6-L201 HydrophobicContact CD1-CD1 4.13Å; I6-L201 HydrophobicContact CG1-CD1 4.44Å; I6-L201 HydrophobicContact CG2-CB 4.41Å; I10-L201 HydrophobicContact CD1-CB 4.16Å; I10-L201 HydrophobicContact CD1-CD2 4.39Å; I10-L201 VanDerWaalsContact CD1-O 3.29Å; I10-L201 WeakPolarHBondContact CD1-O 3.32Å; Q36-L201 HydrophobicContact CB-CD2 4.03Å; Q36-L201 HydrophobicContact CB-CG 4.41Å; Q36-L201 HydrophobicContact CG-CD2 4.34Å; Q36-L201 HydrophobicContact CG-CG 4.36Å; I39-L201 HydrophobicContact CB-CD1 4.13Å; I39-L201 HydrophobicContact CD1-CD1 4.08Å; I39-L201 HydrophobicContact CG2-CD1 3.6Å; L40-L201 HydrophobicContact CD2-CD2 4.34Å; V197-L201 HydrophobicContact CG1-CB 4.3Å; V197-L201 HydrophobicContact CG1-CD2 3.83Å; N198-L201 PolarHBondContact O-N 3.47Å; N198-L201 PolarHBondContact OD1-N 3.38Å; D199-L201 VanDerWaalsContact C-N 3.32Å
202	T	84.8	Confident	77.3	Confident	35 Å²	35	42.7 Å²	42.7	22%	0.215	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-95.5	133.4	170.5	67.3	0	0	0	0	110.2	V197 N198 D200	V197-T202 WeakPolarHBondContact CA-O 3.46Å; N198-T202 PolarHBondContact N-O 2.94Å; N198-T202 VanDerWaalsContact N-O 3.09Å; N198-T202 PolarHBondContact ND2-OG1 2.91Å; N198-T202 WeakPolarHBondContact OD1-CA 3.38Å; N198-T202 WeakPolarHBondContact OD1-CB 3.32Å; N198-T202 PolarHBondContact OD1-N 3.2Å; N198-T202 PolarHBondContact OD1-O 3.28Å; N198-T202 VanDerWaalsContact OD1-O 3.14Å; N198-T202 PolarHBondContact OD1-OG1 3.06Å; D200-T202 HydrophobicContact CB-CG2 4.26Å; D200-T202 PolarHBondContact O-N 3.3Å
203	V	83.4	Confident	76.9	Confident	10 Å²	10	38.1 Å²	38.1	6%	0.061	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-79.3	126.4	-175.3	176.6	0	0	0	0	109.7	D7 R9 I10 L195 V196 V197	D7-V203 HydrophobicContact CB-CG2 4.18Å; R9-V203 HydrophobicContact CB-CG2 4.49Å; I10-V203 HydrophobicContact CD1-CG2 4.14Å; I10-V203 HydrophobicContact CG1-CG2 3.82Å; L195-V203 HydrophobicContact CD2-CG1 4.12Å; V196-V203 WeakPolarHBondContact O-CA 3.35Å; V197-V203 HydrophobicContact CG2-CG2 4.4Å
204	L	79.3	Confident	76.5	Confident	4 Å²	4	44.9 Å²	44.9	2%	0.021	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-81.8	139.1	175.5	-58.3	-176.7	0	0	0	110.4	I29 V196 L206 L656	I29-L204 HydrophobicContact CD1-CD1 4.06Å; V196-L204 HydrophobicContact CB-CB 4.43Å; V196-L204 HydrophobicContact CG1-CB 4.39Å; V196-L204 HydrophobicContact CG1-CD1 3.97Å; V196-L204 HydrophobicContact CG1-CG 4.49Å; V196-L204 PolarHBondContact O-N 3.32Å; L204-L206 PolarHBondContact O-N 3.49Å; L204-L656 HydrophobicContact CD2-CD2 3.74Å; L204-L656 HydrophobicContact CD2-CG 4.47Å
205	P	68.3	Low	76.1	Confident	49 Å²	49	48.7 Å²	48.7	32%	0.318	27%	0.269	S	S	.	.			trans	-79.1	66.5	-179.3	33.9	-35.4	0	0	0	111.7	L656	P205-L656 WeakPolarHBondContact CG-O 3.35Å
206	L	68	Low	75.7	Confident	22 Å²	22	51 Å²	51	12%	0.115	28%	0.282	C	S	.	.			trans	-77.1	-34.7	179.1	-162.4	102.5	0	0	0	112.7	L154 A189 V196 L204 I660	L154-L206 HydrophobicContact CD1-CD1 3.85Å; A189-L206 HydrophobicContact CB-CD2 3.73Å; A189-L206 HydrophobicContact CB-CG 4.35Å; V196-L206 HydrophobicContact CB-CB 4.48Å; V196-L206 HydrophobicContact CG2-CB 4.08Å; V196-L206 HydrophobicContact CG2-CD1 4.19Å; V196-L206 HydrophobicContact CG2-CD2 3.81Å; V196-L206 HydrophobicContact CG2-CG 4.25Å; L204-L206 PolarHBondContact O-N 3.49Å; L206-I660 HydrophobicContact CD1-CD1 3.54Å; L206-I660 HydrophobicContact CD1-CG1 4.41Å; L206-I660 HydrophobicContact CG-CD1 4.28Å
207	S	63.8	Low	75.1	Confident	13 Å²	13	56.5 Å²	56.5	9%	0.091	31%	0.312	C	S	.	.			trans	-129.5	138.6	-174.4	-178.9	0	0	0	0	111.2	A189 K209 T210 I211	A189-S207 WeakPolarHBondContact O-CB 3.19Å; A189-S207 PolarHBondContact O-OG 3.25Å; S207-K209 PolarHBondContact O-N 2.89Å; S207-K209 PolarHBondContact OG-N 3Å; S207-K209 VanDerWaalsContact OG-N 3.17Å; S207-T210 PolarHBondContact O-OG1 2.91Å; S207-I211 WeakPolarHBondContact O-CG1 3.36Å
208	S	61.5	Low	73.9	Confident	99 Å²	99	60.5 Å²	60.5	69%	0.692	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-66.1	-24.8	171.3	56.5	0	0	0	0	112.8
209	K	65.1	Low	72.5	Confident	108 Å²	108	64 Å²	64	47%	0.47	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-79.2	-18.7	-176	-65.9	-179.8	177.8	173.5	0	113.8	D190 S207	D190-K209 IonicContact OD1-NZ 2.68Å; D190-K209 PolarHBondContact OD1-NZ 3.25Å; S207-K209 PolarHBondContact O-N 2.89Å; S207-K209 PolarHBondContact OG-N 3Å; S207-K209 VanDerWaalsContact OG-N 3.17Å
210	T	62.7	Low	71	Confident	7 Å²	7	65.8 Å²	65.8	4%	0.043	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-104.4	6.5	-179.6	56.1	0	0	0	0	113	L195 S207	L195-T210 HydrophobicContact CD2-CG2 4.28Å; S207-T210 PolarHBondContact O-OG1 2.91Å
211	I	62.1	Low	69.7	Low	90 Å²	90	63.1 Å²	63.1	46%	0.462	39%	0.389	S	S	.	.	S	Bend	trans	-66.3	-42.6	176.9	-62	-179	0	0	0	110.4	S207	S207-I211 WeakPolarHBondContact O-CG1 3.36Å
212	N	65.6	Low	68.3	Low	132 Å²	132	66.2 Å²	66.2	71%	0.706	42%	0.422	S	S	*	.			trans	-116.6	96	179.6	-68.5	-11.4	0	0	0	110.7
213	V	76.2	Confident	67.1	Low	31 Å²	31	74.1 Å²	74.1	19%	0.188	45%	0.448	C	S	.	.			trans	-98	108.7	172.3	-176.8	0	0	0	0	108.8	V12 M13	V12-V213 HydrophobicContact CB-CG1 4.46Å; V12-V213 HydrophobicContact CG1-CG1 3.88Å; M13-V213 HydrophobicContact SD-CB 4.47Å; M13-V213 HydrophobicContact SD-CG1 3.56Å; M13-V213 VanDerWaalsContact SD-CG1 3.56Å; M13-V213 HydrophobicContact SD-CG2 4.03Å
214	E	79.4	Confident	66.2	Low	155 Å²	155	74.8 Å²	74.8	72%	0.724	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-93	144	177.5	-66.6	-176	175.8	0	0	111.7	N16	N16-E214 PolarHBondContact ND2-O 3.48Å
215	P	80.8	Confident	66.1	Low	87 Å²	87	79.2 Å²	79.2	57%	0.565	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-69.3	131.2	177.3	27.9	-32.9	0	0	0	111.1	V12	V12-P215 HydrophobicContact CG1-CB 4.12Å
216	V	80.5	Confident	66.6	Low	47 Å²	47	79.1 Å²	79.1	29%	0.285	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-84.4	132.5	179.6	-178.8	0	0	0	0	110.3	N16 L20	N16-V216 HydrophobicContact CB-CG2 4.49Å; N16-V216 PolarHBondContact OD1-N 3.41Å; L20-V216 HydrophobicContact CD1-CB 4.4Å; L20-V216 HydrophobicContact CD1-CG1 4.25Å; L20-V216 HydrophobicContact CD1-CG2 4.04Å; L20-V216 HydrophobicContact CD2-CG1 4.2Å; L20-V216 HydrophobicContact CG-CG1 4.38Å
217	N	73.9	Confident	67.2	Low	126 Å²	126	81.7 Å²	81.7	67%	0.674	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-83.2	119.7	172.3	-81.7	-23.9	0	0	0	110.6	A219 G220	N217-A219 PolarHBondContact O-N 3.13Å; N217-G220 PolarHBondContact O-N 2.97Å
218	P	61.8	Low	68.2	Low	83 Å²	83	84.1 Å²	84.1	54%	0.539	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-20.9	-175.6	24	-32.3	0	0	0	113.9	G220	P218-G220 VanDerWaalsContact C-N 3.32Å; P218-G220 PolarHBondContact O-N 3.36Å
219	A	57.2	Low	69.3	Low	105 Å²	105	81.2 Å²	81.2	87%	0.868	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-20.9	177.7	0	0	0	0	0	114	N217	N217-A219 PolarHBondContact O-N 3.13Å
220	G	50.7	Low	70.4	Confident	71 Å²	71	77 Å²	77	73%	0.732	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-10.9	177.2	0	0	0	0	0	114	N217 P218 G222	N217-G220 PolarHBondContact O-N 2.97Å; P218-G220 VanDerWaalsContact C-N 3.32Å; P218-G220 PolarHBondContact O-N 3.36Å; G220-G222 PolarHBondContact O-N 2.98Å; G220-G222 VanDerWaalsContact O-N 3.12Å
221	A	55.2	Low	71.6	Confident	46 Å²	46	82.3 Å²	82.3	38%	0.38	50%	0.496	S	S	.	.	S	Bend	trans	-79.4	90.1	170.8	0	0	0	0	0	107.7	L20 R223	L20-A221 HydrophobicContact CD2-CB 3.95Å; A221-R223 PolarHBondContact O-N 3.41Å
222	G	53.5	Low	72.9	Confident	70 Å²	70	84.6 Å²	84.6	72%	0.722	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-50.1	133.9	178.2	0	0	0	0	0	110.9	G220 S224	G220-G222 PolarHBondContact O-N 2.98Å; G220-G222 VanDerWaalsContact O-N 3.12Å; G222-S224 PolarHBondContact O-N 2.85Å
223	R	59.2	Low	74	Confident	202 Å²	202	79.9 Å²	79.9	76%	0.762	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-52.6	136.5	167.6	-73.5	-179.8	179.6	160.8	0.8	108	A221	A221-R223 PolarHBondContact O-N 3.41Å
224	S	66.2	Low	74.7	Confident	23 Å²	23	80.8 Å²	80.8	16%	0.161	48%	0.481	C	S	.	.	P	Polyproline II helix	trans	-60.7	142.9	178.9	58.7	0	0	0	0	109.3	G222 N226 E227	G222-S224 PolarHBondContact O-N 2.85Å; S224-N226 PolarHBondContact O-N 3.46Å; S224-N226 VanDerWaalsContact O-N 3.15Å; S224-E227 PolarHBondContact O-N 3.38Å; S224-E227 VanDerWaalsContact O-N 3.1Å; S224-E227 WeakPolarHBondContact OG-CG 3.45Å
225	P	75.6	Confident	75.1	Confident	98 Å²	98	80 Å²	80	64%	0.636	48%	0.477	S	S	*	.	H	α-helix	trans	-54.4	-34.1	176.9	21.4	-32.3	0	0	0	111.5	E227 A228 S229	P225-E227 VanDerWaalsContact C-N 3.34Å; P225-E227 PolarHBondContact O-N 3.36Å; P225-A228 WeakPolarHBondContact O-CB 3.31Å; P225-A228 PolarHBondContact O-N 2.83Å; P225-A228 VanDerWaalsContact O-N 3.17Å; P225-S229 PolarHBondContact O-N 2.9Å; P225-S229 PolarHBondContact O-OG 3.37Å
226	N	78.9	Confident	75.6	Confident	46 Å²	46	79.3 Å²	79.3	25%	0.246	48%	0.475	C	S	.	.	H	α-helix	trans	-65.5	-31.2	-179.8	-62.3	-21	0	0	0	113.8	S224 A228 S229 L230 E440 E446	S224-N226 PolarHBondContact O-N 3.46Å; S224-N226 VanDerWaalsContact O-N 3.15Å; N226-A228 VanDerWaalsContact C-N 3.31Å; N226-A228 PolarHBondContact O-N 3.49Å; N226-S229 PolarHBondContact O-N 3.3Å; N226-L230 WeakPolarHBondContact O-CB 3.21Å; N226-L230 PolarHBondContact O-N 2.98Å; N226-E440 WeakPolarHBondContact CB-OE1 3.43Å; N226-E440 PolarHBondContact ND2-OE1 3.04Å; N226-E446 PolarHBondContact ND2-OE1 2.79Å
227	E	80.9	Confident	75.9	Confident	77 Å²	77	78.8 Å²	78.8	36%	0.36	47%	0.47	S	S	.	.	H	α-helix	trans	-66.9	-33.2	174.8	-81.4	179	-173.3	0	0	112.4	S224 P225 K231 Q445	S224-E227 PolarHBondContact O-N 3.38Å; S224-E227 VanDerWaalsContact O-N 3.1Å; S224-E227 WeakPolarHBondContact OG-CG 3.45Å; P225-E227 VanDerWaalsContact C-N 3.34Å; P225-E227 PolarHBondContact O-N 3.36Å; E227-K231 PolarHBondContact O-N 3.34Å; E227-Q445 PolarHBondContact OE1-NE2 3.23Å
228	A	84.3	Confident	76.4	Confident	63 Å²	63	78.1 Å²	78.1	52%	0.521	47%	0.466	S	S	.	.	H	α-helix	trans	-70.8	-47.8	175.1	0	0	0	0	0	110.6	P225 N226 L230 K231 E232	P225-A228 WeakPolarHBondContact O-CB 3.31Å; P225-A228 PolarHBondContact O-N 2.83Å; P225-A228 VanDerWaalsContact O-N 3.17Å; N226-A228 VanDerWaalsContact C-N 3.31Å; N226-A228 PolarHBondContact O-N 3.49Å; A228-L230 VanDerWaalsContact C-N 3.28Å; A228-L230 PolarHBondContact O-N 2.99Å; A228-K231 PolarHBondContact O-N 2.86Å; A228-K231 VanDerWaalsContact O-N 3.1Å; A228-E232 PolarHBondContact O-N 2.9Å; A228-E232 VanDerWaalsContact O-N 3.14Å
229	S	86.3	Confident	77.3	Confident	39 Å²	39	80.4 Å²	80.4	27%	0.273	48%	0.478	S	S	.	.	H	α-helix	trans	-61.4	-33.8	177.3	-57.8	0	0	0	0	113.1	P225 N226 E232 L233	P225-S229 PolarHBondContact O-N 2.9Å; P225-S229 PolarHBondContact O-OG 3.37Å; N226-S229 PolarHBondContact O-N 3.3Å; S229-E232 PolarHBondContact O-N 3.2Å; S229-L233 WeakPolarHBondContact O-CB 3.33Å; S229-L233 PolarHBondContact O-N 3Å
230	L	87.1	Confident	78.6	Confident	20 Å²	20	78.9 Å²	78.9	11%	0.105	46%	0.458	C	S	.	.	H	α-helix	trans	-63	-41.7	173.9	177.2	62.4	0	0	0	112.2	N226 A228 L233 K234 K251 A256	N226-L230 WeakPolarHBondContact O-CB 3.21Å; N226-L230 PolarHBondContact O-N 2.98Å; A228-L230 VanDerWaalsContact C-N 3.28Å; A228-L230 PolarHBondContact O-N 2.99Å; L230-L233 PolarHBondContact O-N 3.01Å; L230-K234 HydrophobicContact CD1-CD 4.42Å; L230-K234 HydrophobicContact CD1-CG 4.32Å; L230-K234 HydrophobicContact CG-CD 4.43Å; L230-K234 WeakPolarHBondContact O-CB 3.18Å; L230-K234 WeakPolarHBondContact O-CG 3.48Å; L230-K234 PolarHBondContact O-N 3.45Å; L230-K251 WeakPolarHBondContact CD2-O 3.3Å; L230-A256 HydrophobicContact CD1-CB 3.68Å
231	K	88	Confident	80	Confident	118 Å²	118	83.6 Å²	83.6	51%	0.513	46%	0.461	S	S	.	.	H	α-helix	trans	-65.4	-46	178.5	-72.9	178.7	179	-177.8	0	111.1	E227 A228 L233 K234 E235	E227-K231 PolarHBondContact O-N 3.34Å; A228-K231 PolarHBondContact O-N 2.86Å; A228-K231 VanDerWaalsContact O-N 3.1Å; K231-L233 VanDerWaalsContact C-N 3.33Å; K231-L233 PolarHBondContact O-N 3.04Å; K231-K234 PolarHBondContact O-N 3.46Å; K231-E235 WeakPolarHBondContact O-CB 3.23Å; K231-E235 WeakPolarHBondContact O-CG 3.31Å; K231-E235 PolarHBondContact O-N 3.37Å
232	E	90.1	Very high	81.4	Confident	137 Å²	137	82.1 Å²	82.1	64%	0.64	45%	0.447	S	S	*	.	H	α-helix	trans	-57.8	-45.8	176.1	-174.3	178.4	-172.5	0	0	111.7	A228 S229 K234 E235 S236	A228-E232 PolarHBondContact O-N 2.9Å; A228-E232 VanDerWaalsContact O-N 3.14Å; S229-E232 PolarHBondContact O-N 3.2Å; E232-K234 PolarHBondContact O-N 2.73Å; E232-E235 PolarHBondContact O-N 3.43Å; E232-S236 WeakPolarHBondContact O-CB 3.14Å; E232-S236 PolarHBondContact O-N 3.46Å
233	L	88.2	Confident	83	Confident	34 Å²	34	79 Å²	79	18%	0.178	42%	0.415	C	S	.	.	H	α-helix	trans	-63.2	-43.6	177.5	-174.3	66	0	0	0	112	S229 L230 K231 E235 S236 L237 Y253 A256	S229-L233 WeakPolarHBondContact O-CB 3.33Å; S229-L233 PolarHBondContact O-N 3Å; L230-L233 PolarHBondContact O-N 3.01Å; K231-L233 VanDerWaalsContact C-N 3.33Å; K231-L233 PolarHBondContact O-N 3.04Å; L233-E235 VanDerWaalsContact C-N 3.34Å; L233-E235 PolarHBondContact O-N 3.4Å; L233-S236 PolarHBondContact O-N 3.38Å; L233-S236 PolarHBondContact O-OG 3.27Å; L233-L237 HydrophobicContact CD1-CD1 3.98Å; L233-L237 HydrophobicContact CG-CD1 4.23Å; L233-L237 PolarHBondContact O-N 3.4Å; L233-Y253 HydrophobicContact CB-CE2 4.34Å; L233-Y253 HydrophobicContact CD2-CD2 4.29Å; L233-Y253 HydrophobicContact CD2-CE2 4.06Å; L233-A256 HydrophobicContact CD2-CB 3.66Å
234	K	89.8	Confident	84.3	Confident	49 Å²	49	69.7 Å²	69.7	21%	0.213	38%	0.382	C	S	.	.	H	α-helix	trans	-60.7	-44.3	175.6	-75.9	-175.8	-178.2	-161.2	0	111.4	L230 K231 E232 S236 L237 L238 V247 N248 C250	L230-K234 HydrophobicContact CD1-CD 4.42Å; L230-K234 HydrophobicContact CD1-CG 4.32Å; L230-K234 HydrophobicContact CG-CD 4.43Å; L230-K234 WeakPolarHBondContact O-CB 3.18Å; L230-K234 WeakPolarHBondContact O-CG 3.48Å; L230-K234 PolarHBondContact O-N 3.45Å; K231-K234 PolarHBondContact O-N 3.46Å; E232-K234 PolarHBondContact O-N 2.73Å; K234-S236 PolarHBondContact O-N 2.83Å; K234-L237 PolarHBondContact O-N 2.8Å; K234-L238 WeakPolarHBondContact O-CG 3.3Å; K234-L238 PolarHBondContact O-N 3.05Å; K234-V247 HydrophobicContact CG-CG1 4.23Å; K234-N248 PolarHBondContact NZ-O 3.09Å; K234-C250 WeakPolarHBondContact CE-O 3.35Å; K234-C250 PolarHBondContact NZ-O 3.36Å
235	E	89.4	Confident	85.4	Confident	140 Å²	140	70.2 Å²	70.2	65%	0.654	39%	0.388	S	S	*	.	H	α-helix	trans	-62.9	-41.5	178.9	-74.4	172.1	-168	0	0	111.9	K231 E232 L233 L237	K231-E235 WeakPolarHBondContact O-CB 3.23Å; K231-E235 WeakPolarHBondContact O-CG 3.31Å; K231-E235 PolarHBondContact O-N 3.37Å; E232-E235 PolarHBondContact O-N 3.43Å; L233-E235 VanDerWaalsContact C-N 3.34Å; L233-E235 PolarHBondContact O-N 3.4Å; E235-L237 VanDerWaalsContact C-N 3.34Å; E235-L237 PolarHBondContact O-N 2.81Å
236	S	89.9	Confident	86.1	Confident	72 Å²	72	65.6 Å²	65.6	50%	0.503	36%	0.357	S	S	.	.	H	α-helix	trans	-65	-32.7	179.3	73.3	0	0	0	0	114.1	E232 L233 K234	E232-S236 WeakPolarHBondContact O-CB 3.14Å; E232-S236 PolarHBondContact O-N 3.46Å; L233-S236 PolarHBondContact O-N 3.38Å; L233-S236 PolarHBondContact O-OG 3.27Å; K234-S236 PolarHBondContact O-N 2.83Å
237	L	86.8	Confident	86.6	Confident	36 Å²	36	63.4 Å²	63.4	19%	0.188	35%	0.346	C	S	.	.	H	α-helix	trans	-100.3	-1.9	-173.9	-67.9	174.1	0	0	0	114	L233 K234 E235 T239 V240 G244 V247 A260	L233-L237 HydrophobicContact CD1-CD1 3.98Å; L233-L237 HydrophobicContact CG-CD1 4.23Å; L233-L237 PolarHBondContact O-N 3.4Å; K234-L237 PolarHBondContact O-N 2.8Å; E235-L237 VanDerWaalsContact C-N 3.34Å; E235-L237 PolarHBondContact O-N 2.81Å; L237-T239 PolarHBondContact O-N 3.07Å; L237-T239 VanDerWaalsContact O-N 3.15Å; L237-V240 PolarHBondContact O-N 3.15Å; L237-V240 VanDerWaalsContact O-N 3.1Å; L237-G244 WeakPolarHBondContact O-CA 3.27Å; L237-G244 PolarHBondContact O-N 2.81Å; L237-V247 HydrophobicContact CD1-CG1 4.33Å; L237-V247 HydrophobicContact CD1-CG2 4.08Å; L237-A260 HydrophobicContact CD1-CB 4.21Å
238	L	84.3	Confident	87.1	Confident	112 Å²	112	64.3 Å²	64.3	59%	0.586	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-36.9	-178.5	-94.6	162.1	0	0	0	113.4	K234	K234-L238 WeakPolarHBondContact O-CG 3.3Å; K234-L238 PolarHBondContact O-N 3.05Å
239	T	82.5	Confident	87.3	Confident	130 Å²	130	64.8 Å²	64.8	80%	0.798	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-14.1	-175.8	55.6	0	0	0	0	113.8	L237	L237-T239 PolarHBondContact O-N 3.07Å; L237-T239 VanDerWaalsContact O-N 3.15Å
240	V	84.3	Confident	87.5	Confident	73 Å²	73	63 Å²	63	44%	0.442	33%	0.334	S	S	.	.	S	Bend	trans	-94.9	101.6	-174.6	-176.9	0	0	0	0	109.3	L237 A243 G244	L237-V240 PolarHBondContact O-N 3.15Å; L237-V240 VanDerWaalsContact O-N 3.1Å; V240-A243 HydrophobicContact CB-CB 4.43Å; V240-A243 HydrophobicContact CG1-CB 4.16Å; V240-A243 CarbonylContact O-C 3.56Å; V240-A243 WeakPolarHBondContact O-CA 3.42Å; V240-A243 PolarHBondContact O-N 3.44Å; V240-G244 PolarHBondContact O-N 2.88Å
241	Q	79.8	Confident	87.5	Confident	171 Å²	171	69.3 Å²	69.3	80%	0.799	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	141.1	170.9	-68.6	-160.2	-3.7	0	0	111.2
242	P	84.5	Confident	87.6	Confident	14 Å²	14	64.2 Å²	64.2	9%	0.091	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	cis	-85.3	-1.9	1.4	33.8	-35.6	0	0	0	114.7	G244 L246 A298 F299 L328	P242-G244 PolarHBondContact O-N 2.84Å; P242-L246 HydrophobicContact CB-CD1 4.34Å; P242-L246 WeakPolarHBondContact O-CG 3.31Å; P242-L246 PolarHBondContact O-N 2.71Å; P242-A298 HydrophobicContact CB-CB 4.13Å; P242-A298 HydrophobicContact CG-CB 4.05Å; P242-F299 HydrophobicContact CG-CE1 4.37Å; P242-F299 HydrophobicContact CG-CE2 3.99Å; P242-F299 HydrophobicContact CG-CZ 3.85Å; P242-L328 HydrophobicContact CB-CD1 4.5Å; P242-L328 HydrophobicContact CB-CD2 3.61Å
243	A	86.2	Confident	87.6	Confident	5 Å²	5	61 Å²	61	4%	0.041	32%	0.322	C	S	.	.	H	α-helix	trans	-59.8	-45.4	-171.6	0	0	0	0	0	113.9	V240 A245 L246 V247 I263	V240-A243 HydrophobicContact CB-CB 4.43Å; V240-A243 HydrophobicContact CG1-CB 4.16Å; V240-A243 CarbonylContact O-C 3.56Å; V240-A243 WeakPolarHBondContact O-CA 3.42Å; V240-A243 PolarHBondContact O-N 3.44Å; A243-A245 PolarHBondContact O-N 3.05Å; A243-L246 PolarHBondContact O-N 3.43Å; A243-V247 VanDerWaalsContact O-CB 3.29Å; A243-V247 WeakPolarHBondContact O-CB 3.42Å; A243-V247 VanDerWaalsContact O-CG2 3.25Å; A243-V247 WeakPolarHBondContact O-CG2 3.31Å; A243-V247 PolarHBondContact O-N 2.93Å; A243-I263 HydrophobicContact CB-CD1 3.98Å; A243-I263 HydrophobicContact CB-CG2 4.33Å
244	G	87.2	Confident	87.7	Confident	7 Å²	7	61 Å²	61	7%	0.072	32%	0.322	C	S	.	.	H	α-helix	trans	-59.5	-46.1	-177.4	0	0	0	0	0	113.2	L237 V240 P242 L246 N248	L237-G244 WeakPolarHBondContact O-CA 3.27Å; L237-G244 PolarHBondContact O-N 2.81Å; V240-G244 PolarHBondContact O-N 2.88Å; P242-G244 PolarHBondContact O-N 2.84Å; G244-L246 PolarHBondContact O-N 2.63Å; G244-N248 VanDerWaalsContact O-CB 3.3Å; G244-N248 WeakPolarHBondContact O-CB 3.36Å; G244-N248 PolarHBondContact O-N 2.82Å
245	A	89.3	Confident	87.7	Confident	34 Å²	34	58.9 Å²	58.9	28%	0.281	31%	0.313	S	S	.	.	H	α-helix	trans	-62.4	-43.3	178.6	0	0	0	0	0	111.8	A243 L328	A243-A245 PolarHBondContact O-N 3.05Å; A245-L328 HydrophobicContact CB-CD2 4.26Å
246	L	90.4	Very high	87.8	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-76	-41.1	-177.1	-62.8	174.4	0	0	0	112.7	P242 A243 G244 N248 L249 I263 L291 A294 A295 L328	P242-L246 HydrophobicContact CB-CD1 4.34Å; P242-L246 WeakPolarHBondContact O-CG 3.31Å; P242-L246 PolarHBondContact O-N 2.71Å; A243-L246 PolarHBondContact O-N 3.43Å; G244-L246 PolarHBondContact O-N 2.63Å; L246-N248 VanDerWaalsContact C-N 3.26Å; L246-N248 PolarHBondContact O-N 3.42Å; L246-L249 WeakPolarHBondContact O-CB 3.44Å; L246-L249 PolarHBondContact O-N 3.41Å; L246-I263 HydrophobicContact CD1-CD1 4.39Å; L246-L291 HydrophobicContact CD2-CD2 4.13Å; L246-A294 HydrophobicContact CD2-CB 4.26Å; L246-A295 HydrophobicContact CD1-CB 3.54Å; L246-L328 HydrophobicContact CD1-CD1 4.46Å; L246-L328 HydrophobicContact CD2-CD1 4.26Å; L246-L328 HydrophobicContact CD2-CG 4.29Å
247	V	89.8	Confident	87.9	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-66.4	-31.4	176.7	171.8	0	0	0	0	110.9	K234 L237 A243 L249 C250 A256 V259	K234-V247 HydrophobicContact CG-CG1 4.23Å; L237-V247 HydrophobicContact CD1-CG1 4.33Å; L237-V247 HydrophobicContact CD1-CG2 4.08Å; A243-V247 VanDerWaalsContact O-CB 3.29Å; A243-V247 WeakPolarHBondContact O-CB 3.42Å; A243-V247 VanDerWaalsContact O-CG2 3.25Å; A243-V247 WeakPolarHBondContact O-CG2 3.31Å; A243-V247 PolarHBondContact O-N 2.93Å; V247-L249 PolarHBondContact O-N 3.38Å; V247-C250 VanDerWaalsContact O-CB 3.3Å; V247-C250 WeakPolarHBondContact O-CB 3.42Å; V247-C250 PolarHBondContact O-N 3.03Å; V247-A256 HydrophobicContact CG1-CB 3.91Å; V247-V259 HydrophobicContact CG2-CG1 4.32Å
248	N	90.3	Very high	88.1	Confident	97 Å²	97	49.8 Å²	49.8	52%	0.519	26%	0.264	S	S	.	.	H	α-helix	trans	-62.7	-30.3	175.3	-164.7	21.8	0	0	0	112.9	K234 G244 L246 C250	K234-N248 PolarHBondContact NZ-O 3.09Å; G244-N248 VanDerWaalsContact O-CB 3.3Å; G244-N248 WeakPolarHBondContact O-CB 3.36Å; G244-N248 PolarHBondContact O-N 2.82Å; L246-N248 VanDerWaalsContact C-N 3.26Å; L246-N248 PolarHBondContact O-N 3.42Å; N248-C250 VanDerWaalsContact C-N 3.25Å; N248-C250 PolarHBondContact O-N 2.65Å
249	L	89.8	Confident	88.5	Confident	72 Å²	72	44.5 Å²	44.5	38%	0.377	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-16.9	175.1	-63.8	174.6	0	0	0	113.7	L246 V247 L291 A327	L246-L249 WeakPolarHBondContact O-CB 3.44Å; L246-L249 PolarHBondContact O-N 3.41Å; V247-L249 PolarHBondContact O-N 3.38Å; L249-L291 HydrophobicContact CB-CD1 4.44Å; L249-L291 HydrophobicContact CB-CD2 4.36Å; L249-L291 HydrophobicContact CD1-CD2 3.61Å; L249-A327 HydrophobicContact CD1-CB 3.75Å; L249-A327 HydrophobicContact CG-CB 4.32Å
250	C	90.1	Very high	89	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.007	21%	0.207	C	C	.	.			trans	-71.9	142.1	-178.7	-63.6	0	0	0	0	111.5	K234 V247 N248 Q255 A256	K234-C250 WeakPolarHBondContact CE-O 3.35Å; K234-C250 PolarHBondContact NZ-O 3.36Å; V247-C250 VanDerWaalsContact O-CB 3.3Å; V247-C250 WeakPolarHBondContact O-CB 3.42Å; V247-C250 PolarHBondContact O-N 3.03Å; N248-C250 VanDerWaalsContact C-N 3.25Å; N248-C250 PolarHBondContact O-N 2.65Å; C250-Q255 HydrophobicContact CB-CB 4.36Å; C250-Q255 HydrophobicContact CB-CG 4.14Å; C250-A256 HydrophobicContact CB-CB 3.9Å
251	K	87.7	Confident	89.2	Confident	154 Å²	154	38.2 Å²	38.2	67%	0.67	20%	0.197	S	C	*	.			trans	-94.7	-33.8	-178.6	-75.1	-172.1	174	-173.2	0	113.7	L230	L230-K251 WeakPolarHBondContact CD2-O 3.3Å
252	T	88.9	Confident	89.8	Confident	11 Å²	11	30 Å²	30	7%	0.067	16%	0.158	C	C	.	.	S	Bend	trans	-115.6	156.1	-174.8	53.5	0	0	0	0	110.6	Q255 A256 E440 I442	T252-Q255 PolarHBondContact O-N 3.31Å; T252-Q255 WeakPolarHBondContact OG1-CB 3.23Å; T252-Q255 PolarHBondContact OG1-N 3.19Å; T252-A256 PolarHBondContact O-N 3.3Å; T252-A256 VanDerWaalsContact O-N 3.15Å; T252-E440 WeakPolarHBondContact CB-OE2 3.18Å; T252-E440 HydrophobicContact CG2-CB 3.8Å; T252-I442 HydrophobicContact CG2-CG2 4.09Å
253	Y	90.1	Very high	90.1	Very high	69 Å²	69	30 Å²	30	27%	0.271	16%	0.157	S	C	.	.	H	α-helix	trans	-63.3	-46.9	177.9	175.7	-103.2	0	0	0	111.1	L233 Q255 A256 N257 E440	L233-Y253 HydrophobicContact CB-CE2 4.34Å; L233-Y253 HydrophobicContact CD2-CD2 4.29Å; L233-Y253 HydrophobicContact CD2-CE2 4.06Å; Y253-Q255 VanDerWaalsContact C-N 3.27Å; Y253-Q255 PolarHBondContact O-N 3.28Å; Y253-A256 PolarHBondContact O-N 2.9Å; Y253-A256 VanDerWaalsContact O-N 3.12Å; Y253-N257 WeakPolarHBondContact O-CB 3.48Å; Y253-N257 PolarHBondContact O-N 3.47Å; Y253-E440 PolarHBondContact N-OE2 3.15Å
254	D	90.4	Very high	90.2	Very high	33 Å²	33	34.3 Å²	34.3	18%	0.176	18%	0.176	C	C	.	.	H	α-helix	trans	-53.4	-43.7	176.3	-74	-9.9	0	0	0	112.6	A258 L438 E439 E440	D254-A258 WeakPolarHBondContact O-CB 3.46Å; D254-A258 PolarHBondContact O-N 3.02Å; D254-L438 HydrophobicContact CB-CD2 3.76Å; D254-L438 WeakPolarHBondContact O-CD2 3.3Å; D254-E439 PolarHBondContact OD2-N 3.46Å; D254-E440 PolarHBondContact OD2-N 3.25Å
255	Q	91.2	Very high	90.3	Very high	6 Å²	6	34.6 Å²	34.6	3%	0.028	18%	0.178	C	C	.	.	H	α-helix	trans	-66.5	-44.5	179.6	-174.1	-174.7	31.4	0	0	111.3	C250 T252 Y253 A258 V259 A288	C250-Q255 HydrophobicContact CB-CB 4.36Å; C250-Q255 HydrophobicContact CB-CG 4.14Å; T252-Q255 PolarHBondContact O-N 3.31Å; T252-Q255 WeakPolarHBondContact OG1-CB 3.23Å; T252-Q255 PolarHBondContact OG1-N 3.19Å; Y253-Q255 VanDerWaalsContact C-N 3.27Å; Y253-Q255 PolarHBondContact O-N 3.28Å; Q255-A258 PolarHBondContact O-N 2.98Å; Q255-V259 WeakPolarHBondContact O-CG2 3.39Å; Q255-V259 PolarHBondContact O-N 3.34Å; Q255-A288 HydrophobicContact CG-CB 4.19Å
256	A	91.2	Very high	90.3	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.6	-44.8	178.3	0	0	0	0	0	111.7	L230 L233 V247 C250 T252 Y253 V259 A260	L230-A256 HydrophobicContact CD1-CB 3.68Å; L233-A256 HydrophobicContact CD2-CB 3.66Å; V247-A256 HydrophobicContact CG1-CB 3.91Å; C250-A256 HydrophobicContact CB-CB 3.9Å; T252-A256 PolarHBondContact O-N 3.3Å; T252-A256 VanDerWaalsContact O-N 3.15Å; Y253-A256 PolarHBondContact O-N 2.9Å; Y253-A256 VanDerWaalsContact O-N 3.12Å; A256-V259 PolarHBondContact O-N 3.45Å; A256-A260 WeakPolarHBondContact O-CB 3.45Å; A256-A260 PolarHBondContact O-N 3.37Å
257	N	91.4	Very high	90.2	Very high	54 Å²	54	37 Å²	37	29%	0.289	19%	0.19	S	C	.	.	H	α-helix	trans	-62.6	-43.6	176.1	-172.9	13	0	0	0	111.6	Y253 V259 A260 Q261	Y253-N257 WeakPolarHBondContact O-CB 3.48Å; Y253-N257 PolarHBondContact O-N 3.47Å; N257-V259 PolarHBondContact O-N 3.3Å; N257-A260 PolarHBondContact O-N 2.78Å; N257-Q261 WeakPolarHBondContact O-CG 3.23Å; N257-Q261 PolarHBondContact O-N 3.01Å; N257-Q261 PolarHBondContact OD1-NE2 3.27Å
258	A	91.9	Very high	90	Very high	3 Å²	3	40.7 Å²	40.7	3%	0.025	21%	0.209	C	C	.	.	H	α-helix	trans	-61.6	-45	176.8	0	0	0	0	0	112.4	D254 Q255 Q261 F262 L277 L438	D254-A258 WeakPolarHBondContact O-CB 3.46Å; D254-A258 PolarHBondContact O-N 3.02Å; Q255-A258 PolarHBondContact O-N 2.98Å; A258-Q261 PolarHBondContact O-N 2.92Å; A258-F262 WeakPolarHBondContact O-CD2 3.46Å; A258-F262 PolarHBondContact O-N 2.78Å; A258-L277 HydrophobicContact CB-CD1 4.17Å; A258-L438 HydrophobicContact CB-CD2 3.92Å
259	V	92.6	Very high	89.4	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.5	-41.6	176.8	172.1	0	0	0	0	111.1	V247 Q255 A256 N257 Q261 F262 I263 A288 L291	V247-V259 HydrophobicContact CG2-CG1 4.32Å; Q255-V259 WeakPolarHBondContact O-CG2 3.39Å; Q255-V259 PolarHBondContact O-N 3.34Å; A256-V259 PolarHBondContact O-N 3.45Å; N257-V259 PolarHBondContact O-N 3.3Å; V259-Q261 PolarHBondContact O-N 3.44Å; V259-F262 PolarHBondContact O-N 3.37Å; V259-I263 HydrophobicContact CG1-CD1 3.82Å; V259-I263 HydrophobicContact CG1-CG1 4.45Å; V259-I263 WeakPolarHBondContact O-CB 3.31Å; V259-I263 VanDerWaalsContact O-CG1 3.28Å; V259-I263 WeakPolarHBondContact O-CG1 3.44Å; V259-I263 PolarHBondContact O-N 3.06Å; V259-A288 HydrophobicContact CG2-CB 4.04Å; V259-L291 HydrophobicContact CG2-CB 4.29Å; V259-L291 HydrophobicContact CG2-CD1 4.36Å
260	A	91.1	Very high	88.4	Confident	23 Å²	23	44.2 Å²	44.2	19%	0.19	22%	0.218	C	C	.	.	H	α-helix	trans	-59.9	-44.3	176.5	0	0	0	0	0	112.1	L237 A256 N257 I263 E264	L237-A260 HydrophobicContact CD1-CB 4.21Å; A256-A260 WeakPolarHBondContact O-CB 3.45Å; A256-A260 PolarHBondContact O-N 3.37Å; N257-A260 PolarHBondContact O-N 2.78Å; A260-I263 WeakPolarHBondContact O-CB 3.4Å; A260-I263 PolarHBondContact O-N 3.09Å; A260-E264 PolarHBondContact O-N 3.18Å
261	Q	90.1	Very high	87.5	Confident	48 Å²	48	49 Å²	49	22%	0.224	24%	0.243	C	C	.	.	H	α-helix	trans	-69.5	-34.6	178	-69.9	-173.5	43.9	0	0	113.4	N257 A258 V259 I263 E264 A265 L436	N257-Q261 WeakPolarHBondContact O-CG 3.23Å; N257-Q261 PolarHBondContact O-N 3.01Å; N257-Q261 PolarHBondContact OD1-NE2 3.27Å; A258-Q261 PolarHBondContact O-N 2.92Å; V259-Q261 PolarHBondContact O-N 3.44Å; Q261-I263 VanDerWaalsContact C-N 3.32Å; Q261-E264 PolarHBondContact O-N 2.63Å; Q261-A265 PolarHBondContact O-N 2.9Å; Q261-L436 HydrophobicContact CB-CD1 4.15Å; Q261-L436 VanDerWaalsContact CD-CD2 3.47Å
262	F	91.2	Very high	86.5	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.9	-40.5	171.3	-78.6	-57.8	0	0	0	111.6	A258 V259 A265 L266 M275 L277 L289 S292 F403	A258-F262 WeakPolarHBondContact O-CD2 3.46Å; A258-F262 PolarHBondContact O-N 2.78Å; V259-F262 PolarHBondContact O-N 3.37Å; F262-A265 PolarHBondContact O-N 3.45Å; F262-L266 VanDerWaalsContact O-CG 3.3Å; F262-L266 WeakPolarHBondContact O-CG 3.01Å; F262-L266 PolarHBondContact O-N 3.46Å; F262-M275 HydrophobicContact CD1-CG 4.2Å; F262-M275 HydrophobicContact CD1-SD 3.35Å; F262-M275 WeakPolarHBondContact CD1-SD 3.42Å; F262-M275 HydrophobicContact CE1-CB 4.21Å; F262-M275 HydrophobicContact CE1-CG 3.77Å; F262-M275 HydrophobicContact CE1-SD 3.51Å; F262-M275 VanDerWaalsContact CE1-SD 3.51Å; F262-M275 HydrophobicContact CG-SD 4.13Å; F262-M275 HydrophobicContact CZ-SD 4.41Å; F262-L277 HydrophobicContact CE2-CB 4.44Å; F262-L277 HydrophobicContact CE2-CD2 4.14Å; F262-L277 HydrophobicContact CZ-CB 3.99Å; F262-L277 HydrophobicContact CZ-CD2 4.41Å; F262-L289 HydrophobicContact CE2-CD2 4.3Å; F262-L289 HydrophobicContact CZ-CD2 4.09Å; F262-S292 WeakPolarHBondContact CB-OG 3.19Å; F262-S292 WeakPolarHBondContact CD2-OG 3.35Å; F262-F403 HydrophobicContact CB-CE2 4.23Å; F262-F403 HydrophobicContact CB-CZ 4.4Å; F262-F403 AromaticContact CD1-CD1 3.83Å; F262-F403 HydrophobicContact CD1-CD1 3.83Å; F262-F403 AromaticContact CD1-CD2 3.65Å; F262-F403 HydrophobicContact CD1-CD2 3.65Å; F262-F403 AromaticContact CD1-CE1 3.79Å; F262-F403 HydrophobicContact CD1-CE1 3.79Å; F262-F403 AromaticContact CD1-CE2 3.61Å; F262-F403 HydrophobicContact CD1-CE2 3.61Å; F262-F403 AromaticContact CD1-CG 3.76Å; F262-F403 HydrophobicContact CD1-CG 3.76Å; F262-F403 AromaticContact CD1-CZ 3.68Å; F262-F403 HydrophobicContact CD1-CZ 3.68Å; F262-F403 HydrophobicContact CE1-CB 4.02Å; F262-F403 AromaticContact CE1-CD1 3.84Å; F262-F403 HydrophobicContact CE1-CD1 3.84Å; F262-F403 AromaticContact CE1-CD2 3.96Å; F262-F403 HydrophobicContact CE1-CD2 3.96Å; F262-F403 HydrophobicContact CE1-CE1 4.25Å; F262-F403 HydrophobicContact CE1-CE2 4.36Å; F262-F403 AromaticContact CE1-CG 3.67Å; F262-F403 HydrophobicContact CE1-CG 3.67Å; F262-F403 HydrophobicContact CE1-CZ 4.5Å; F262-F403 HydrophobicContact CG-CD2 4.46Å; F262-F403 HydrophobicContact CG-CE2 4.25Å; F262-F403 HydrophobicContact CG-CZ 4.5Å
263	I	90.7	Very high	85.7	Confident	13 Å²	13	49 Å²	49	7%	0.067	25%	0.246	C	C	.	.	H	α-helix	trans	-63.2	-45.3	176.1	-72.9	171.3	0	0	0	110.9	A243 L246 V259 A260 Q261 A265 L266 V267 A295 F299	A243-I263 HydrophobicContact CB-CD1 3.98Å; A243-I263 HydrophobicContact CB-CG2 4.33Å; L246-I263 HydrophobicContact CD1-CD1 4.39Å; V259-I263 HydrophobicContact CG1-CD1 3.82Å; V259-I263 HydrophobicContact CG1-CG1 4.45Å; V259-I263 WeakPolarHBondContact O-CB 3.31Å; V259-I263 VanDerWaalsContact O-CG1 3.28Å; V259-I263 WeakPolarHBondContact O-CG1 3.44Å; V259-I263 PolarHBondContact O-N 3.06Å; A260-I263 WeakPolarHBondContact O-CB 3.4Å; A260-I263 PolarHBondContact O-N 3.09Å; Q261-I263 VanDerWaalsContact C-N 3.32Å; I263-A265 VanDerWaalsContact C-N 3.31Å; I263-A265 PolarHBondContact O-N 3.41Å; I263-L266 WeakPolarHBondContact O-CB 3.25Å; I263-L266 PolarHBondContact O-N 2.99Å; I263-L266 VanDerWaalsContact O-N 3.14Å; I263-V267 WeakPolarHBondContact O-CG2 3.32Å; I263-V267 PolarHBondContact O-N 3.12Å; I263-A295 HydrophobicContact CD1-CB 4.15Å; I263-A295 HydrophobicContact CG1-CB 3.76Å; I263-F299 HydrophobicContact CG2-CE2 3.82Å; I263-F299 HydrophobicContact CG2-CZ 3.85Å
264	E	89.1	Confident	85.3	Confident	95 Å²	95	46.3 Å²	46.3	44%	0.444	24%	0.237	S	C	.	.	H	α-helix	trans	-56.4	-45.2	175	-171.1	-173.9	171.7	0	0	111.5	A260 Q261 L266 V267 D268	A260-E264 PolarHBondContact O-N 3.18Å; Q261-E264 PolarHBondContact O-N 2.63Å; E264-L266 VanDerWaalsContact C-N 3.33Å; E264-L266 PolarHBondContact O-N 3.26Å; E264-V267 PolarHBondContact O-N 3.07Å; E264-V267 VanDerWaalsContact O-N 3.12Å; E264-D268 PolarHBondContact O-N 3.14Å
265	A	88.4	Confident	85.1	Confident	13 Å²	13	45.9 Å²	45.9	11%	0.107	23%	0.234	C	C	.	.	H	α-helix	trans	-65.5	-32.2	177.7	0	0	0	0	0	113.9	Q261 F262 I263 V267 K269 M275 F403	Q261-A265 PolarHBondContact O-N 2.9Å; F262-A265 PolarHBondContact O-N 3.45Å; I263-A265 VanDerWaalsContact C-N 3.31Å; I263-A265 PolarHBondContact O-N 3.41Å; A265-V267 VanDerWaalsContact C-N 3.34Å; A265-K269 PolarHBondContact O-N 3.03Å; A265-M275 HydrophobicContact CB-CE 3.54Å; A265-M275 HydrophobicContact CB-SD 4.37Å; A265-F403 HydrophobicContact CB-CE1 4.27Å; A265-F403 HydrophobicContact CB-CZ 4.33Å
266	L	89.8	Confident	85	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-68.5	-34.1	173.4	-70.1	166.5	0	0	0	111.7	F262 I263 E264 A295 A296 F299 Y301 L379 L401 F403	F262-L266 VanDerWaalsContact O-CG 3.3Å; F262-L266 WeakPolarHBondContact O-CG 3.01Å; F262-L266 PolarHBondContact O-N 3.46Å; I263-L266 WeakPolarHBondContact O-CB 3.25Å; I263-L266 PolarHBondContact O-N 2.99Å; I263-L266 VanDerWaalsContact O-N 3.14Å; E264-L266 VanDerWaalsContact C-N 3.33Å; E264-L266 PolarHBondContact O-N 3.26Å; L266-A295 HydrophobicContact CD1-CB 4.21Å; L266-A296 HydrophobicContact CD1-CB 3.89Å; L266-A296 HydrophobicContact CD2-CB 3.87Å; L266-F299 HydrophobicContact CB-CD2 4.02Å; L266-F299 HydrophobicContact CB-CE2 4.37Å; L266-F299 HydrophobicContact CD1-CD2 4.33Å; L266-Y301 HydrophobicContact CB-CE2 4.21Å; L266-Y301 HydrophobicContact CD2-CD2 4.27Å; L266-Y301 HydrophobicContact CD2-CE2 3.66Å; L266-Y301 PolarHBondContact O-OH 3.44Å; L266-Y301 VanDerWaalsContact O-OH 3.06Å; L266-L379 HydrophobicContact CD2-CD2 4.01Å; L266-L401 HydrophobicContact CD2-CD2 3.69Å; L266-F403 HydrophobicContact CD1-CE2 4.37Å; L266-F403 HydrophobicContact CD2-CE2 4.01Å; L266-F403 HydrophobicContact CD2-CZ 3.98Å; L266-F403 HydrophobicContact CG-CE2 4.09Å; L266-F403 HydrophobicContact CG-CZ 3.95Å
267	V	89	Confident	84.9	Confident	85 Å²	85	46.2 Å²	46.2	52%	0.515	24%	0.237	S	C	.	.	H	α-helix	trans	-71.6	-44.9	176.9	174.6	0	0	0	0	111	I263 E264 A265 K269 F299	I263-V267 WeakPolarHBondContact O-CG2 3.32Å; I263-V267 PolarHBondContact O-N 3.12Å; E264-V267 PolarHBondContact O-N 3.07Å; E264-V267 VanDerWaalsContact O-N 3.12Å; A265-V267 VanDerWaalsContact C-N 3.34Å; V267-K269 PolarHBondContact O-N 3.38Å; V267-F299 HydrophobicContact CG2-CD1 4.4Å; V267-F299 HydrophobicContact CG2-CE1 3.71Å; V267-F299 HydrophobicContact CG2-CE2 4.22Å; V267-F299 HydrophobicContact CG2-CZ 3.61Å
268	D	84.3	Confident	84.7	Confident	76 Å²	76	44 Å²	44	41%	0.406	23%	0.226	S	C	.	.	H	α-helix	trans	-66.7	-21	-178.8	-82.9	-4.4	0	0	0	113.6	E264 Q270	E264-D268 PolarHBondContact O-N 3.14Å; D268-Q270 HydrophobicContact CB-CG 4.19Å; D268-Q270 PolarHBondContact O-N 3.35Å
269	K	79.2	Confident	84.4	Confident	144 Å²	144	43.9 Å²	43.9	63%	0.626	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.9	26.5	-176.9	-62	-176	178.9	-177.3	0	114.1	A265 V267 L271	A265-K269 PolarHBondContact O-N 3.03Å; V267-K269 PolarHBondContact O-N 3.38Å; K269-L271 PolarHBondContact O-N 3.39Å; K269-L271 VanDerWaalsContact O-N 3.12Å
270	Q	68.9	Low	83.7	Confident	100 Å²	100	44.8 Å²	44.8	47%	0.467	23%	0.232	S	C	.	.			trans	-70	109.1	177.7	-75.2	-177.2	9.4	0	0	110.4	D268 K272 L401	D268-Q270 HydrophobicContact CB-CG 4.19Å; D268-Q270 PolarHBondContact O-N 3.35Å; Q270-K272 VanDerWaalsContact C-N 3.25Å; Q270-K272 PolarHBondContact O-N 3.05Å; Q270-L401 VanDerWaalsContact O-CD1 3.32Å; Q270-L401 WeakPolarHBondContact O-CD1 3.29Å
271	L	70.6	Confident	83.3	Confident	101 Å²	101	45.8 Å²	45.8	53%	0.529	23%	0.231	S	C	.	.			trans	-66.4	-26	-177.4	-63.7	166.5	0	0	0	113.1	K269	K269-L271 PolarHBondContact O-N 3.39Å; K269-L271 VanDerWaalsContact O-N 3.12Å
272	K	67.5	Low	82.8	Confident	129 Å²	129	44 Å²	44	56%	0.561	23%	0.226	S	C	*	.	S	Bend	trans	-143.1	144.9	179.2	-68	-176.9	179.9	179.7	0	109.3	Q270	Q270-K272 VanDerWaalsContact C-N 3.25Å; Q270-K272 PolarHBondContact O-N 3.05Å
273	P	71.8	Confident	82.6	Confident	37 Å²	37	45.1 Å²	45.1	24%	0.24	23%	0.23	C	C	.	.	S	Bend	cis	-84.5	162.6	0.3	29.3	-30.5	0	0	0	114.6	N430 A432	P273-N430 HydrophobicContact CB-CB 4.13Å; P273-A432 HydrophobicContact CB-CB 3.7Å; P273-A432 HydrophobicContact CG-CB 4.17Å
274	P	81.3	Confident	82.4	Confident	12 Å²	12	45 Å²	45	8%	0.078	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-65.5	140.6	178.8	28.7	-36.1	0	0	0	111.9	V402 L426	P274-V402 HydrophobicContact CB-CB 4.06Å; P274-L426 HydrophobicContact CG-CD1 3.97Å; P274-L426 HydrophobicContact CG-CD2 4.05Å
275	M	86.7	Confident	82.4	Confident	23 Å²	23	40.9 Å²	40.9	11%	0.113	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	132.2	175.9	-171.2	173.9	-76.8	0	0	110	F262 A265 V402 F403 M404 L436	F262-M275 HydrophobicContact CD1-CG 4.2Å; F262-M275 HydrophobicContact CD1-SD 3.35Å; F262-M275 WeakPolarHBondContact CD1-SD 3.42Å; F262-M275 HydrophobicContact CE1-CB 4.21Å; F262-M275 HydrophobicContact CE1-CG 3.77Å; F262-M275 HydrophobicContact CE1-SD 3.51Å; F262-M275 VanDerWaalsContact CE1-SD 3.51Å; F262-M275 HydrophobicContact CG-SD 4.13Å; F262-M275 HydrophobicContact CZ-SD 4.41Å; A265-M275 HydrophobicContact CB-CE 3.54Å; A265-M275 HydrophobicContact CB-SD 4.37Å; M275-V402 PolarHBondContact N-O 3.45Å; M275-V402 VanDerWaalsContact N-O 3.09Å; M275-F403 HydrophobicContact CB-CD1 3.86Å; M275-F403 HydrophobicContact CB-CE1 4.09Å; M275-F403 WeakPolarHBondContact O-CA 3.46Å; M275-M404 PolarHBondContact O-N 2.94Å; M275-L436 HydrophobicContact CG-CD1 4.34Å; M275-L436 HydrophobicContact SD-CD1 3.96Å
276	S	87.8	Confident	82.5	Confident	13 Å²	13	41.3 Å²	41.3	9%	0.091	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	136.9	-177.5	56.8	0	0	0	0	112	M404 P435 L436	S276-M404 CarbonylContact C-O 3.55Å; S276-M404 WeakPolarHBondContact CA-O 3.11Å; S276-P435 CarbonylContact O-C 3.57Å; S276-P435 WeakPolarHBondContact O-CA 3.11Å; S276-P435 WeakPolarHBondContact OG-CB 3.45Å; S276-L436 PolarHBondContact O-N 3Å
277	L	89.3	Confident	82.5	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	126.6	176.4	-179.4	69.7	0	0	0	109.1	A258 F262 K285 M404 A405 S406 L436 L438	A258-L277 HydrophobicContact CB-CD1 4.17Å; F262-L277 HydrophobicContact CE2-CB 4.44Å; F262-L277 HydrophobicContact CE2-CD2 4.14Å; F262-L277 HydrophobicContact CZ-CB 3.99Å; F262-L277 HydrophobicContact CZ-CD2 4.41Å; L277-K285 HydrophobicContact CD2-CB 4.47Å; L277-K285 HydrophobicContact CD2-CG 3.73Å; L277-K285 HydrophobicContact CG-CG 4.35Å; L277-M404 PolarHBondContact N-O 3Å; L277-A405 HydrophobicContact CB-CB 4.46Å; L277-A405 CarbonylContact O-C 3.59Å; L277-A405 WeakPolarHBondContact O-CA 3.1Å; L277-S406 PolarHBondContact O-N 3.42Å; L277-L436 HydrophobicContact CD1-CB 3.62Å; L277-L438 HydrophobicContact CD1-CD1 4.14Å; L277-L438 HydrophobicContact CD1-CD2 4.1Å; L277-L438 HydrophobicContact CD1-CG 3.8Å; L277-L438 HydrophobicContact CD2-CD1 4.11Å; L277-L438 HydrophobicContact CG-CD1 4.41Å; L277-L438 HydrophobicContact CG-CG 4.5Å
278	T	86.9	Confident	82.7	Confident	8 Å²	8	37.5 Å²	37.5	5%	0.049	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	131	178.5	58.3	0	0	0	0	109.6	S406 I408 I423 P435 L436 K437 L438	T278-S406 WeakPolarHBondContact CA-O 3.41Å; T278-I408 HydrophobicContact CG2-CG2 4.47Å; T278-I423 HydrophobicContact CG2-CD1 3.83Å; T278-P435 HydrophobicContact CG2-CB 3.94Å; T278-L436 PolarHBondContact N-O 3.49Å; T278-L436 PolarHBondContact OG1-O 3.12Å; T278-L436 VanDerWaalsContact OG1-O 3.09Å; T278-K437 VanDerWaalsContact O-CA 3.26Å; T278-K437 WeakPolarHBondContact O-CA 3.47Å; T278-L438 PolarHBondContact O-N 3.32Å
279	A	85.2	Confident	83.1	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	149.2	-176.4	0	0	0	0	0	111	R283 K285 S406 T407 I408 L438	A279-R283 HydrophobicContact CB-CB 4.23Å; A279-K285 HydrophobicContact CB-CB 4.23Å; A279-S406 PolarHBondContact N-O 2.98Å; A279-S406 VanDerWaalsContact N-O 3.16Å; A279-T407 CarbonylContact O-C 3.59Å; A279-T407 VanDerWaalsContact O-CA 3.24Å; A279-T407 WeakPolarHBondContact O-CA 3.2Å; A279-I408 VanDerWaalsContact C-CG1 3.4Å; A279-I408 WeakPolarHBondContact O-CG1 3.25Å; A279-I408 PolarHBondContact O-N 3.33Å; A279-L438 HydrophobicContact CB-CB 3.7Å; A279-L438 HydrophobicContact CB-CD1 4Å; A279-L438 HydrophobicContact CB-CG 4.07Å
280	A	79.8	Confident	83.8	Confident	19 Å²	19	27.1 Å²	27.1	16%	0.157	14%	0.143	C	C	.	.			trans	-64.3	165.3	164.3	0	0	0	0	0	111	R283 I408	A280-R283 HydrophobicContact CB-CG 3.83Å; A280-R283 VanDerWaalsContact O-CG 3.23Å; A280-R283 WeakPolarHBondContact O-CG 3.47Å; A280-I408 VanDerWaalsContact CA-O 3.31Å; A280-I408 WeakPolarHBondContact CA-O 3.3Å
281	R	80.9	Confident	84.9	Confident	44 Å²	44	22.3 Å²	22.3	17%	0.166	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	144.8	173.3	-160.3	-175.4	-169.4	141.1	21.3	110.1	L111 E136 R283 Y411 E412	L111-R281 VanDerWaalsContact CD1-NH2 3.29Å; L111-R281 VanDerWaalsContact CD2-NH1 3.34Å; E136-R281 VanDerWaalsContact OE1-C 3.27Å; E136-R281 WeakPolarHBondContact OE1-CB 3.35Å; E136-R281 WeakPolarHBondContact OE1-CD 3.45Å; E136-R281 WeakPolarHBondContact OE1-CG 3.47Å; E136-R281 WeakPolarHBondContact OE2-CB 3.3Å; E136-R281 VanDerWaalsContact OE2-CD 3.23Å; E136-R281 WeakPolarHBondContact OE2-CD 3.39Å; R281-R283 VanDerWaalsContact C-N 3.34Å; R281-R283 PolarHBondContact O-N 3.49Å; R281-Y411 VanDerWaalsContact CD-OH 3.26Å; R281-Y411 WeakPolarHBondContact CD-OH 3.27Å; R281-Y411 PolarHBondContact NE-OH 2.92Å; R281-Y411 PolarHBondContact NH1-OH 2.77Å; R281-E412 IonicContact CZ-OE1 2.64Å; R281-E412 IonicContact CZ-OE2 3.17Å; R281-E412 VanDerWaalsContact NH1-CG 3.32Å; R281-E412 IonicContact NH1-OE1 2.86Å; R281-E412 PolarHBondContact NH1-OE1 2.99Å; R281-E412 IonicContact NH1-OE2 2.97Å; R281-E412 IonicContact NH2-OE1 3.78Å; R281-E412 PolarHBondContact NH2-OE1 3Å; R281-E412 IonicContact NH2-OE2 3.89Å
282	G	79.9	Confident	86	Confident	11 Å²	11	17.5 Å²	17.5	11%	0.113	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	13.2	177.4	0	0	0	0	0	114.7	E136 I442	E136-G282 WeakPolarHBondContact OE1-CA 3.33Å; E136-G282 PolarHBondContact OE1-N 2.73Å; G282-I442 WeakPolarHBondContact O-CG1 3.42Å; G282-I442 PolarHBondContact O-N 3.4Å
283	R	87.1	Confident	87.3	Confident	23 Å²	23	11.4 Å²	11.4	9%	0.087	7%	0.069	C	C	.	.	S	Bend	trans	-98	5.4	178.8	-48.7	-58.2	174.8	158.6	-2.5	114.6	A279 A280 R281 L438 E439 E440 E451	A279-R283 HydrophobicContact CB-CB 4.23Å; A280-R283 HydrophobicContact CB-CG 3.83Å; A280-R283 VanDerWaalsContact O-CG 3.23Å; A280-R283 WeakPolarHBondContact O-CG 3.47Å; R281-R283 VanDerWaalsContact C-N 3.34Å; R281-R283 PolarHBondContact O-N 3.49Å; R283-L438 HydrophobicContact CB-CB 3.96Å; R283-E439 WeakPolarHBondContact CD-O 3.41Å; R283-E439 PolarHBondContact NE-O 2.81Å; R283-E439 PolarHBondContact NH1-O 2.82Å; R283-E440 WeakPolarHBondContact CD-O 3.44Å; R283-E451 IonicContact CZ-OE1 2.72Å; R283-E451 IonicContact CZ-OE2 2.9Å; R283-E451 IonicContact NH1-OE2 3.22Å; R283-E451 IonicContact NH2-OE1 3.73Å; R283-E451 PolarHBondContact NH2-OE1 3Å; R283-E451 IonicContact NH2-OE2 3.27Å; R283-E451 PolarHBondContact NH2-OE2 2.86Å
284	G	87.3	Confident	88.4	Confident	9 Å²	9	9.6 Å²	9.6	9%	0.093	6%	0.057	C	C	.	.			trans	86.1	18.4	174.7	0	0	0	0	0	116.5	S286 A287 A288	G284-S286 PolarHBondContact O-N 3.02Å; G284-A287 WeakPolarHBondContact O-CB 3.45Å; G284-A287 PolarHBondContact O-N 3.47Å; G284-A287 VanDerWaalsContact O-N 3.13Å; G284-A288 PolarHBondContact O-N 3.48Å
285	K	89.2	Confident	88.9	Confident	10 Å²	10	9 Å²	9	4%	0.043	5%	0.054	C	C	.	.	H	α-helix	trans	-50.3	-56.7	179.3	-172.8	-168.9	62.8	152.6	0	114	L277 A279 A287 A288 L289 D383 E384 A405 L438	L277-K285 HydrophobicContact CD2-CB 4.47Å; L277-K285 HydrophobicContact CD2-CG 3.73Å; L277-K285 HydrophobicContact CG-CG 4.35Å; A279-K285 HydrophobicContact CB-CB 4.23Å; K285-A287 PolarHBondContact O-N 3.15Å; K285-A288 PolarHBondContact O-N 3.33Å; K285-L289 PolarHBondContact O-N 3.2Å; K285-L289 VanDerWaalsContact O-N 3.09Å; K285-D383 WeakPolarHBondContact CE-OD1 3.49Å; K285-D383 IonicContact NZ-OD1 2.73Å; K285-D383 PolarHBondContact NZ-OD1 3.23Å; K285-E384 IonicContact NZ-OE1 3.13Å; K285-E384 PolarHBondContact NZ-OE1 2.88Å; K285-E384 IonicContact NZ-OE2 2.93Å; K285-E384 PolarHBondContact NZ-OE2 3.09Å; K285-A405 HydrophobicContact CD-CB 3.64Å; K285-A405 HydrophobicContact CG-CB 3.78Å; K285-L438 HydrophobicContact CB-CD1 4.43Å
286	S	89.3	Confident	89.2	Confident	21 Å²	21	8 Å²	8	15%	0.147	5%	0.048	C	C	.	.	H	α-helix	trans	-65.2	-27.4	-179.2	-51	0	0	0	0	112.6	G284 G290 T316 D383	G284-S286 PolarHBondContact O-N 3.02Å; S286-G290 PolarHBondContact O-N 3.39Å; S286-T316 WeakPolarHBondContact CB-OG1 3.48Å; S286-D383 PolarHBondContact OG-OD2 2.8Å
287	A	90.8	Very high	89.4	Confident	7 Å²	7	7.4 Å²	7.4	6%	0.058	4%	0.044	C	C	.	.	H	α-helix	trans	-69.8	-43.9	173.3	0	0	0	0	0	111.9	G284 K285 L289 G290 L291 F320	G284-A287 WeakPolarHBondContact O-CB 3.45Å; G284-A287 PolarHBondContact O-N 3.47Å; G284-A287 VanDerWaalsContact O-N 3.13Å; K285-A287 PolarHBondContact O-N 3.15Å; A287-L289 PolarHBondContact O-N 3.32Å; A287-G290 PolarHBondContact O-N 3.27Å; A287-L291 WeakPolarHBondContact O-CG 3.49Å; A287-L291 PolarHBondContact O-N 2.91Å; A287-F320 HydrophobicContact CB-CB 4.42Å; A287-F320 HydrophobicContact CB-CD1 3.63Å; A287-F320 HydrophobicContact CB-CD2 3.62Å; A287-F320 HydrophobicContact CB-CE1 3.63Å; A287-F320 HydrophobicContact CB-CE2 3.62Å; A287-F320 HydrophobicContact CB-CG 3.61Å; A287-F320 HydrophobicContact CB-CZ 3.61Å
288	A	92.6	Very high	89.5	Confident	0 Å²	0	9.4 Å²	9.4	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-61.2	-42.6	175.4	0	0	0	0	0	112	Q255 V259 G284 K285 L291 S292	Q255-A288 HydrophobicContact CG-CB 4.19Å; V259-A288 HydrophobicContact CG2-CB 4.04Å; G284-A288 PolarHBondContact O-N 3.48Å; K285-A288 PolarHBondContact O-N 3.33Å; A288-L291 PolarHBondContact O-N 3.03Å; A288-S292 WeakPolarHBondContact O-CB 3.42Å; A288-S292 PolarHBondContact O-N 3.01Å; A288-S292 PolarHBondContact O-OG 3.26Å
289	L	92.6	Very high	89.6	Confident	1 Å²	1	12.5 Å²	12.5	1%	0.005	7%	0.074	C	C	.	.	H	α-helix	trans	-64.5	-43.1	175.3	-64	174	0	0	0	112.2	F262 K285 A287 L291 S292 I293 L317 L381 D383 A405	F262-L289 HydrophobicContact CE2-CD2 4.3Å; F262-L289 HydrophobicContact CZ-CD2 4.09Å; K285-L289 PolarHBondContact O-N 3.2Å; K285-L289 VanDerWaalsContact O-N 3.09Å; A287-L289 PolarHBondContact O-N 3.32Å; L289-L291 PolarHBondContact O-N 3.11Å; L289-S292 WeakPolarHBondContact O-CB 3.49Å; L289-S292 PolarHBondContact O-N 2.7Å; L289-S292 VanDerWaalsContact O-N 3.15Å; L289-I293 WeakPolarHBondContact O-CG1 3.28Å; L289-I293 PolarHBondContact O-N 3.43Å; L289-L317 HydrophobicContact CB-CD1 3.93Å; L289-L317 HydrophobicContact CD1-CD1 4.28Å; L289-L381 HydrophobicContact CB-CD2 4.35Å; L289-L381 HydrophobicContact CD2-CD2 4.25Å; L289-D383 HydrophobicContact CD1-CB 4.21Å; L289-A405 HydrophobicContact CD1-CB 3.27Å; L289-A405 HydrophobicContact CD2-CB 4.09Å; L289-A405 HydrophobicContact CG-CB 4.07Å
290	G	93.8	Very high	89.8	Confident	0 Å²	0	14.3 Å²	14.3	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-60	-43.9	177.6	0	0	0	0	0	112.6	S286 A287 S292 I293 A294	S286-G290 PolarHBondContact O-N 3.39Å; A287-G290 PolarHBondContact O-N 3.27Å; G290-S292 VanDerWaalsContact C-N 3.32Å; G290-S292 PolarHBondContact O-N 2.96Å; G290-I293 PolarHBondContact O-N 3.2Å; G290-A294 PolarHBondContact O-N 3.38Å
291	L	93.8	Very high	90.3	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-63.5	-38	174	-67.6	173.7	0	0	0	112.1	L246 L249 V259 A287 A288 L289 I293 A294 A295 F320	L246-L291 HydrophobicContact CD2-CD2 4.13Å; L249-L291 HydrophobicContact CB-CD1 4.44Å; L249-L291 HydrophobicContact CB-CD2 4.36Å; L249-L291 HydrophobicContact CD1-CD2 3.61Å; V259-L291 HydrophobicContact CG2-CB 4.29Å; V259-L291 HydrophobicContact CG2-CD1 4.36Å; A287-L291 WeakPolarHBondContact O-CG 3.49Å; A287-L291 PolarHBondContact O-N 2.91Å; A288-L291 PolarHBondContact O-N 3.03Å; L289-L291 PolarHBondContact O-N 3.11Å; L291-I293 VanDerWaalsContact C-N 3.34Å; L291-I293 PolarHBondContact O-N 3.02Å; L291-A294 PolarHBondContact O-N 2.99Å; L291-A295 PolarHBondContact O-N 3.16Å; L291-F320 HydrophobicContact CG-CD1 4.4Å
292	S	93.4	Very high	90.8	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-66.7	-34.2	177.3	-54.3	0	0	0	0	112.3	F262 A288 L289 G290 A295 A296	F262-S292 WeakPolarHBondContact CB-OG 3.19Å; F262-S292 WeakPolarHBondContact CD2-OG 3.35Å; A288-S292 WeakPolarHBondContact O-CB 3.42Å; A288-S292 PolarHBondContact O-N 3.01Å; A288-S292 PolarHBondContact O-OG 3.26Å; L289-S292 WeakPolarHBondContact O-CB 3.49Å; L289-S292 PolarHBondContact O-N 2.7Å; L289-S292 VanDerWaalsContact O-N 3.15Å; G290-S292 VanDerWaalsContact C-N 3.32Å; G290-S292 PolarHBondContact O-N 2.96Å; S292-A295 WeakPolarHBondContact O-CB 3.31Å; S292-A295 PolarHBondContact O-N 2.88Å; S292-A296 PolarHBondContact O-N 3.49Å
293	I	94.6	Very high	91.4	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-65.7	-42.9	173	-69.2	165.7	0	0	0	110.8	L289 G290 L291 A295 A296 V297 I304 V306 L317 V321 I363 L381	L289-I293 WeakPolarHBondContact O-CG1 3.28Å; L289-I293 PolarHBondContact O-N 3.43Å; G290-I293 PolarHBondContact O-N 3.2Å; L291-I293 VanDerWaalsContact C-N 3.34Å; L291-I293 PolarHBondContact O-N 3.02Å; I293-A295 VanDerWaalsContact C-N 3.27Å; I293-A295 PolarHBondContact O-N 3.09Å; I293-A296 WeakPolarHBondContact O-CB 3.2Å; I293-A296 PolarHBondContact O-N 3.17Å; I293-A296 VanDerWaalsContact O-N 3.13Å; I293-V297 WeakPolarHBondContact O-CG2 3.48Å; I293-V297 PolarHBondContact O-N 2.98Å; I293-I304 HydrophobicContact CG1-CG2 4.45Å; I293-I304 HydrophobicContact CG2-CD1 4.42Å; I293-I304 HydrophobicContact CG2-CG2 4.3Å; I293-V306 HydrophobicContact CD1-CG2 3.83Å; I293-L317 HydrophobicContact CD1-CD1 4.36Å; I293-L317 HydrophobicContact CD1-CD2 3.66Å; I293-L317 HydrophobicContact CD1-CG 4.28Å; I293-V321 HydrophobicContact CB-CG2 3.98Å; I293-V321 HydrophobicContact CD1-CG2 4.13Å; I293-V321 HydrophobicContact CG2-CG1 4.3Å; I293-V321 HydrophobicContact CG2-CG2 3.91Å; I293-I363 HydrophobicContact CG2-CD1 3.59Å; I293-I363 HydrophobicContact CG2-CG1 4.13Å; I293-I363 HydrophobicContact CG2-CG2 4.37Å; I293-L381 HydrophobicContact CD1-CD1 3.93Å; I293-L381 HydrophobicContact CD1-CD2 3.88Å; I293-L381 HydrophobicContact CD1-CG 4.43Å; I293-L381 HydrophobicContact CG1-CD1 3.6Å; I293-L381 HydrophobicContact CG1-CD2 3.58Å; I293-L381 HydrophobicContact CG1-CG 4.23Å
294	A	93.7	Very high	91.8	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-60.3	-39.4	175.8	0	0	0	0	0	111.4	L246 G290 L291 V297 A298 F325 L328	L246-A294 HydrophobicContact CD2-CB 4.26Å; G290-A294 PolarHBondContact O-N 3.38Å; L291-A294 PolarHBondContact O-N 2.99Å; A294-V297 PolarHBondContact O-N 3.28Å; A294-A298 PolarHBondContact O-N 3.03Å; A294-F325 HydrophobicContact CB-CD1 4.1Å; A294-F325 HydrophobicContact CB-CE1 4.19Å; A294-L328 HydrophobicContact CB-CD1 4.36Å
295	A	92.5	Very high	92.2	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-62.3	-44.7	171.8	0	0	0	0	0	112.6	L246 I263 L266 L291 S292 I293 V297 A298 F299	L246-A295 HydrophobicContact CD1-CB 3.54Å; I263-A295 HydrophobicContact CD1-CB 4.15Å; I263-A295 HydrophobicContact CG1-CB 3.76Å; L266-A295 HydrophobicContact CD1-CB 4.21Å; L291-A295 PolarHBondContact O-N 3.16Å; S292-A295 WeakPolarHBondContact O-CB 3.31Å; S292-A295 PolarHBondContact O-N 2.88Å; I293-A295 VanDerWaalsContact C-N 3.27Å; I293-A295 PolarHBondContact O-N 3.09Å; A295-V297 VanDerWaalsContact C-N 3.3Å; A295-V297 PolarHBondContact O-N 3.13Å; A295-A298 WeakPolarHBondContact O-CB 3.39Å; A295-A298 PolarHBondContact O-N 3.31Å; A295-A298 VanDerWaalsContact O-N 3.08Å; A295-F299 HydrophobicContact CB-CD2 4.45Å; A295-F299 HydrophobicContact CB-CE2 4.25Å; A295-F299 WeakPolarHBondContact O-CD2 3.44Å; A295-F299 PolarHBondContact O-N 3.15Å
296	A	92.6	Very high	92.4	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-60.6	-39.2	179.1	0	0	0	0	0	112.3	L266 S292 I293 A298 F299 G300 Y301 I304 L379	L266-A296 HydrophobicContact CD1-CB 3.89Å; L266-A296 HydrophobicContact CD2-CB 3.87Å; S292-A296 PolarHBondContact O-N 3.49Å; I293-A296 WeakPolarHBondContact O-CB 3.2Å; I293-A296 PolarHBondContact O-N 3.17Å; I293-A296 VanDerWaalsContact O-N 3.13Å; A296-A298 VanDerWaalsContact C-N 3.35Å; A296-F299 PolarHBondContact O-N 2.95Å; A296-G300 PolarHBondContact O-N 3.14Å; A296-Y301 HydrophobicContact CB-CD2 4.09Å; A296-Y301 HydrophobicContact CB-CG 4.39Å; A296-Y301 WeakPolarHBondContact O-CD2 3.42Å; A296-Y301 PolarHBondContact O-N 3.24Å; A296-Y301 VanDerWaalsContact O-N 3.16Å; A296-I304 HydrophobicContact CB-CD1 3.9Å; A296-L379 HydrophobicContact CB-CD2 3.63Å
297	V	92.6	Very high	92.6	Very high	1 Å²	1	14.9 Å²	14.9	1%	0.006	9%	0.091	C	C	.	.	H	α-helix	trans	-60.8	-45.3	172.7	172.8	0	0	0	0	110.7	I293 A294 A295 F299 G300 I304 F325 Y330 I355 Q361 I363	I293-V297 WeakPolarHBondContact O-CG2 3.48Å; I293-V297 PolarHBondContact O-N 2.98Å; A294-V297 PolarHBondContact O-N 3.28Å; A295-V297 VanDerWaalsContact C-N 3.3Å; A295-V297 PolarHBondContact O-N 3.13Å; V297-F299 VanDerWaalsContact C-N 3.31Å; V297-F299 PolarHBondContact O-N 3.35Å; V297-G300 PolarHBondContact O-N 2.87Å; V297-I304 HydrophobicContact CG2-CD1 3.61Å; V297-F325 HydrophobicContact CB-CE1 4.07Å; V297-F325 HydrophobicContact CB-CZ 4.47Å; V297-F325 HydrophobicContact CG1-CE1 4.03Å; V297-F325 HydrophobicContact CG1-CZ 4.31Å; V297-F325 HydrophobicContact CG2-CE1 4.14Å; V297-F325 HydrophobicContact CG2-CZ 4.12Å; V297-Y330 HydrophobicContact CG1-CE1 4.41Å; V297-I355 HydrophobicContact CG1-CD1 4Å; V297-I355 HydrophobicContact CG1-CG2 4.28Å; V297-I355 HydrophobicContact CG2-CD1 3.93Å; V297-Q361 PolarHBondContact O-NE2 3.46Å; V297-I363 HydrophobicContact CG2-CD1 3.97Å; V297-I363 HydrophobicContact CG2-CG1 4.29Å
298	A	90.4	Very high	92.5	Very high	43 Å²	43	14.6 Å²	14.6	36%	0.355	9%	0.088	S	C	.	.	H	α-helix	trans	-63.4	-33.1	177.6	0	0	0	0	0	113.2	P242 A294 A295 A296 G300 L328	P242-A298 HydrophobicContact CB-CB 4.13Å; P242-A298 HydrophobicContact CG-CB 4.05Å; A294-A298 PolarHBondContact O-N 3.03Å; A295-A298 WeakPolarHBondContact O-CB 3.39Å; A295-A298 PolarHBondContact O-N 3.31Å; A295-A298 VanDerWaalsContact O-N 3.08Å; A296-A298 VanDerWaalsContact C-N 3.35Å; A298-G300 VanDerWaalsContact C-N 3.26Å; A298-G300 PolarHBondContact O-N 3.46Å; A298-L328 HydrophobicContact CB-CD1 4.18Å
299	F	89.8	Confident	91.9	Very high	74 Å²	74	17 Å²	17	33%	0.325	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-2.4	174.2	-70.4	-60	0	0	0	114.6	P242 I263 L266 V267 A295 A296 V297 Y301	P242-F299 HydrophobicContact CG-CE1 4.37Å; P242-F299 HydrophobicContact CG-CE2 3.99Å; P242-F299 HydrophobicContact CG-CZ 3.85Å; I263-F299 HydrophobicContact CG2-CE2 3.82Å; I263-F299 HydrophobicContact CG2-CZ 3.85Å; L266-F299 HydrophobicContact CB-CD2 4.02Å; L266-F299 HydrophobicContact CB-CE2 4.37Å; L266-F299 HydrophobicContact CD1-CD2 4.33Å; V267-F299 HydrophobicContact CG2-CD1 4.4Å; V267-F299 HydrophobicContact CG2-CE1 3.71Å; V267-F299 HydrophobicContact CG2-CE2 4.22Å; V267-F299 HydrophobicContact CG2-CZ 3.61Å; A295-F299 HydrophobicContact CB-CD2 4.45Å; A295-F299 HydrophobicContact CB-CE2 4.25Å; A295-F299 WeakPolarHBondContact O-CD2 3.44Å; A295-F299 PolarHBondContact O-N 3.15Å; A296-F299 PolarHBondContact O-N 2.95Å; V297-F299 VanDerWaalsContact C-N 3.31Å; V297-F299 PolarHBondContact O-N 3.35Å; F299-Y301 HydrophobicContact CB-CD2 4.2Å; F299-Y301 HydrophobicContact CB-CE2 4.24Å
300	G	89.3	Confident	91.3	Very high	37 Å²	37	20.1 Å²	20.1	38%	0.381	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.2	19.5	172.5	0	0	0	0	0	116	A296 V297 A298	A296-G300 PolarHBondContact O-N 3.14Å; V297-G300 PolarHBondContact O-N 2.87Å; A298-G300 VanDerWaalsContact C-N 3.26Å; A298-G300 PolarHBondContact O-N 3.46Å
301	Y	90.7	Very high	90.7	Very high	24 Å²	24	20.3 Å²	20.3	9%	0.094	12%	0.12	C	C	.	.			trans	-66.9	133.4	172	-75.9	-98	0	0	0	110.7	L266 A296 F299 Q361 D378 L379	L266-Y301 HydrophobicContact CB-CE2 4.21Å; L266-Y301 HydrophobicContact CD2-CD2 4.27Å; L266-Y301 HydrophobicContact CD2-CE2 3.66Å; L266-Y301 PolarHBondContact O-OH 3.44Å; L266-Y301 VanDerWaalsContact O-OH 3.06Å; A296-Y301 HydrophobicContact CB-CD2 4.09Å; A296-Y301 HydrophobicContact CB-CG 4.39Å; A296-Y301 WeakPolarHBondContact O-CD2 3.42Å; A296-Y301 PolarHBondContact O-N 3.24Å; A296-Y301 VanDerWaalsContact O-N 3.16Å; F299-Y301 HydrophobicContact CB-CD2 4.2Å; F299-Y301 HydrophobicContact CB-CE2 4.24Å; Y301-Q361 WeakPolarHBondContact O-CG 3.42Å; Y301-Q361 PolarHBondContact O-NE2 2.63Å; Y301-D378 HydrophobicContact CD1-CB 3.77Å; Y301-D378 HydrophobicContact CE1-CB 4.48Å; Y301-L379 HydrophobicContact CD1-CB 4.14Å
302	V	91.5	Very high	90	Very high	59 Å²	59	22.6 Å²	22.6	36%	0.358	13%	0.13	S	C	.	.	S	Bend	trans	-91.3	-54.7	-170.5	178.4	0	0	0	0	111.2	R360 Q361 T362 D378	V302-R360 WeakPolarHBondContact CG1-O 3.33Å; V302-Q361 CarbonylContact O-C 3.54Å; V302-Q361 WeakPolarHBondContact O-CA 3.46Å; V302-T362 PolarHBondContact O-N 3.43Å; V302-D378 WeakPolarHBondContact CB-OD2 3.24Å; V302-D378 PolarHBondContact N-OD2 2.94Å
303	N	93.1	Very high	89.2	Confident	43 Å²	43	25.8 Å²	25.8	23%	0.23	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	100.5	-177.5	-67.3	-34	0	0	0	110.4	Y305 T362 A376 D378 L379	N303-Y305 HydrophobicContact CB-CE1 4.33Å; N303-T362 PolarHBondContact OD1-OG1 3.22Å; N303-A376 WeakPolarHBondContact CB-O 3.02Å; N303-A376 PolarHBondContact ND2-O 3.07Å; N303-D378 PolarHBondContact N-OD2 3.3Å; N303-D378 PolarHBondContact O-N 3.39Å; N303-L379 PolarHBondContact O-N 3.41Å
304	I	94.9	Very high	88.7	Confident	1 Å²	1	25.8 Å²	25.8	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	115.9	177.1	-56.4	170.7	0	0	0	108.6	I293 A296 V297 T362 I363 Q364 L379 L381	I293-I304 HydrophobicContact CG1-CG2 4.45Å; I293-I304 HydrophobicContact CG2-CD1 4.42Å; I293-I304 HydrophobicContact CG2-CG2 4.3Å; A296-I304 HydrophobicContact CB-CD1 3.9Å; V297-I304 HydrophobicContact CG2-CD1 3.61Å; I304-T362 PolarHBondContact N-O 3.21Å; I304-I363 HydrophobicContact CB-CG1 4.3Å; I304-I363 HydrophobicContact CD1-CG1 4.36Å; I304-I363 CarbonylContact O-C 3.49Å; I304-I363 VanDerWaalsContact O-CA 3.29Å; I304-I363 WeakPolarHBondContact O-CA 2.87Å; I304-Q364 PolarHBondContact O-N 3.01Å; I304-L379 HydrophobicContact CG1-CB 4.44Å; I304-L379 HydrophobicContact CG1-CD2 4.47Å; I304-L379 HydrophobicContact CG2-CD2 4.11Å; I304-L379 HydrophobicContact CG2-CG 4.34Å; I304-L381 HydrophobicContact CG2-CD1 3.56Å
305	Y	94.9	Very high	88.4	Confident	22 Å²	22	29.9 Å²	29.9	9%	0.086	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	138.8	178.7	-62.5	-25.6	0	0	0	111.8	N303 Q364 I366 L373 L374 A377 L379 L380 L381	N303-Y305 HydrophobicContact CB-CE1 4.33Å; Y305-Q364 WeakPolarHBondContact CA-O 3.38Å; Y305-Q364 HydrophobicContact CD1-CB 3.97Å; Y305-Q364 HydrophobicContact CE1-CB 4.12Å; Y305-I366 HydrophobicContact CD1-CD1 3.71Å; Y305-I366 HydrophobicContact CD1-CG1 4.34Å; Y305-I366 HydrophobicContact CD2-CD1 3.2Å; Y305-I366 HydrophobicContact CD2-CG1 4.45Å; Y305-I366 HydrophobicContact CE1-CD1 4.06Å; Y305-I366 HydrophobicContact CE2-CD1 3.58Å; Y305-I366 HydrophobicContact CG-CD1 3.29Å; Y305-I366 HydrophobicContact CG-CG1 4.14Å; Y305-L373 WeakPolarHBondContact CE2-O 3.45Å; Y305-L374 HydrophobicContact CD2-CD2 4.01Å; Y305-A377 HydrophobicContact CD2-CB 3.41Å; Y305-A377 VanDerWaalsContact CD2-CB 3.41Å; Y305-A377 HydrophobicContact CE2-CB 3.77Å; Y305-A377 HydrophobicContact CG-CB 4.27Å; Y305-L379 PolarHBondContact N-O 2.81Å; Y305-L380 CarbonylContact O-C 3.6Å; Y305-L380 WeakPolarHBondContact O-CA 3.38Å; Y305-L381 PolarHBondContact O-N 3.28Å
306	V	94.3	Very high	88.1	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	130.9	178.6	-173.9	0	0	0	0	108.6	I293 L314 L317 I363 Q364 Y365 I366 L381	I293-V306 HydrophobicContact CD1-CG2 3.83Å; V306-L314 HydrophobicContact CG1-CD1 3.83Å; V306-L314 HydrophobicContact CG1-CD2 3.67Å; V306-L314 HydrophobicContact CG1-CG 4.39Å; V306-L317 HydrophobicContact CG1-CD1 4.19Å; V306-L317 HydrophobicContact CG1-CD2 4.23Å; V306-L317 HydrophobicContact CG2-CD2 4.48Å; V306-I363 HydrophobicContact CG2-CG2 4.16Å; V306-Q364 PolarHBondContact N-O 3.46Å; V306-Y365 CarbonylContact O-C 3.58Å; V306-Y365 VanDerWaalsContact O-CA 3.27Å; V306-Y365 WeakPolarHBondContact O-CA 3.46Å; V306-Y365 WeakPolarHBondContact O-CD2 3.43Å; V306-I366 PolarHBondContact O-N 3.39Å; V306-L381 CarbonylContact C-O 3.55Å; V306-L381 WeakPolarHBondContact CA-O 3.49Å; V306-L381 HydrophobicContact CG2-CB 4.5Å; V306-L381 HydrophobicContact CG2-CD1 4.33Å
307	T	92.1	Very high	88	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.006	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	138.1	179.3	-66.4	0	0	0	0	110.3	I366 P368 L381 D383 I388 M396	T307-I366 PolarHBondContact OG1-O 3.24Å; T307-P368 HydrophobicContact CG2-CB 4.24Å; T307-P368 HydrophobicContact CG2-CG 3.68Å; T307-L381 PolarHBondContact N-O 2.79Å; T307-D383 PolarHBondContact O-N 3.37Å; T307-I388 HydrophobicContact CG2-CD1 4.03Å; T307-M396 HydrophobicContact CG2-CE 4.03Å; T307-M396 HydrophobicContact CG2-SD 4.2Å
308	S	88.6	Confident	88	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.18	C	C	.	.			trans	-147.4	164.4	172.5	66.1	0	0	0	0	109	H310 L314 Y365 P368	S308-H310 VanDerWaalsContact C-N 3.25Å; S308-H310 PolarHBondContact O-N 3.46Å; S308-H310 PolarHBondContact OG-O 2.96Å; S308-L314 WeakPolarHBondContact OG-CD1 3.18Å; S308-L314 WeakPolarHBondContact OG-CG 3.45Å; S308-Y365 PolarHBondContact O-OH 2.99Å; S308-P368 VanDerWaalsContact O-CD 3.31Å; S308-P368 WeakPolarHBondContact O-CD 3.46Å; S308-P368 VanDerWaalsContact O-CG 3.3Å; S308-P368 WeakPolarHBondContact O-CG 3.31Å
309	P	81.8	Confident	88	Confident	52 Å²	52	34.5 Å²	34.5	34%	0.338	19%	0.185	S	C	.	.	S	Bend	trans	-60.6	-33.7	174.6	-22.6	30.9	0	0	0	113.7	A387 I388	P309-A387 HydrophobicContact CG-CB 3.63Å; P309-I388 HydrophobicContact CG-CG1 3.97Å
310	H	80.1	Confident	88.1	Confident	65 Å²	65	33.3 Å²	33.3	30%	0.301	18%	0.18	S	C	.	.	S	Bend	trans	-144.3	140.6	178.5	-160.2	-95.1	0	0	0	110.5	S308 E312 N313	S308-H310 VanDerWaalsContact C-N 3.25Å; S308-H310 PolarHBondContact O-N 3.46Å; S308-H310 PolarHBondContact OG-O 2.96Å; H310-E312 IonicContact CE1-OE1 2.9Å; H310-E312 WeakPolarHBondContact ND1-CG 3.36Å; H310-E312 PolarHBondContact ND1-N 2.94Å; H310-E312 PolarHBondContact O-N 3.36Å; H310-E312 VanDerWaalsContact O-N 3.16Å; H310-N313 PolarHBondContact O-N 2.75Å; H310-N313 VanDerWaalsContact O-N 3.16Å
311	P	81.2	Confident	88.4	Confident	4 Å²	4	31.5 Å²	31.5	3%	0.026	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-58.9	-28.2	-179.7	-26.3	34.2	0	0	0	114.5	N313 L314 Y346 A349 Y365	P311-N313 PolarHBondContact O-N 3.33Å; P311-L314 WeakPolarHBondContact O-CB 3.49Å; P311-L314 PolarHBondContact O-N 3Å; P311-Y346 HydrophobicContact CB-CG 4.48Å; P311-Y346 HydrophobicContact CG-CD1 3.69Å; P311-Y346 HydrophobicContact CG-CD2 4.25Å; P311-Y346 HydrophobicContact CG-CE1 3.83Å; P311-Y346 HydrophobicContact CG-CE2 4.39Å; P311-Y346 HydrophobicContact CG-CG 3.92Å; P311-A349 HydrophobicContact CB-CB 4.04Å; P311-Y365 HydrophobicContact CG-CD1 4.18Å; P311-Y365 HydrophobicContact CG-CE1 3.62Å; P311-Y365 HydrophobicContact CG-CE2 4.38Å
312	E	77.4	Confident	88.5	Confident	48 Å²	48	32 Å²	32	22%	0.224	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-59.5	-30.3	178.5	-72.1	-176.7	-167.6	0	0	113.2	H310 L314 I315 K347	H310-E312 IonicContact CE1-OE1 2.9Å; H310-E312 WeakPolarHBondContact ND1-CG 3.36Å; H310-E312 PolarHBondContact ND1-N 2.94Å; H310-E312 PolarHBondContact O-N 3.36Å; H310-E312 VanDerWaalsContact O-N 3.16Å; E312-L314 PolarHBondContact O-N 2.84Å; E312-I315 WeakPolarHBondContact O-CD1 3.5Å; E312-I315 VanDerWaalsContact O-CG1 3.28Å; E312-I315 WeakPolarHBondContact O-CG1 3.36Å; E312-I315 PolarHBondContact O-N 3.01Å; E312-K347 VanDerWaalsContact CD-NZ 3.26Å; E312-K347 WeakPolarHBondContact OE1-CD 3.5Å; E312-K347 WeakPolarHBondContact OE1-CE 3.17Å; E312-K347 WeakPolarHBondContact OE1-CG 3.47Å; E312-K347 IonicContact OE1-NZ 2.71Å; E312-K347 PolarHBondContact OE1-NZ 3.43Å; E312-K347 IonicContact OE2-NZ 3.45Å; E312-K347 PolarHBondContact OE2-NZ 2.96Å
313	N	76.8	Confident	88.6	Confident	67 Å²	67	33.9 Å²	33.9	36%	0.358	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-67.7	-22	179.1	-66	-8.6	0	0	0	111.9	H310 P311	H310-N313 PolarHBondContact O-N 2.75Å; H310-N313 VanDerWaalsContact O-N 3.16Å; P311-N313 PolarHBondContact O-N 3.33Å
314	L	84.9	Confident	88.5	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.005	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-89	-1.7	-175.7	-60.7	176.5	0	0	0	113.9	V306 S308 P311 E312 T316 L317 F318 Y365 D383	V306-L314 HydrophobicContact CG1-CD1 3.83Å; V306-L314 HydrophobicContact CG1-CD2 3.67Å; V306-L314 HydrophobicContact CG1-CG 4.39Å; S308-L314 WeakPolarHBondContact OG-CD1 3.18Å; S308-L314 WeakPolarHBondContact OG-CG 3.45Å; P311-L314 WeakPolarHBondContact O-CB 3.49Å; P311-L314 PolarHBondContact O-N 3Å; E312-L314 PolarHBondContact O-N 2.84Å; L314-T316 VanDerWaalsContact C-N 3.28Å; L314-T316 PolarHBondContact O-N 2.84Å; L314-L317 HydrophobicContact CD2-CB 4.32Å; L314-L317 HydrophobicContact CD2-CD1 4.07Å; L314-L317 PolarHBondContact O-N 3.11Å; L314-L317 VanDerWaalsContact O-N 3.12Å; L314-F318 HydrophobicContact CB-CD2 3.89Å; L314-F318 HydrophobicContact CB-CE2 3.87Å; L314-F318 HydrophobicContact CD1-CE2 4.23Å; L314-F318 VanDerWaalsContact O-CD2 3.31Å; L314-F318 WeakPolarHBondContact O-CD2 3.3Å; L314-F318 PolarHBondContact O-N 2.83Å; L314-Y365 HydrophobicContact CD1-CD2 3.34Å; L314-Y365 HydrophobicContact CD1-CE2 3.86Å; L314-Y365 HydrophobicContact CD1-CG 4.27Å; L314-D383 HydrophobicContact CD2-CB 4.1Å
315	I	86.3	Confident	88.5	Confident	85 Å²	85	31.8 Å²	31.8	44%	0.436	16%	0.158	S	C	.	.	H	α-helix	trans	-54.5	-49.3	179	-64.7	169.4	0	0	0	110	E312 L317 F318 E319	E312-I315 WeakPolarHBondContact O-CD1 3.5Å; E312-I315 VanDerWaalsContact O-CG1 3.28Å; E312-I315 WeakPolarHBondContact O-CG1 3.36Å; E312-I315 PolarHBondContact O-N 3.01Å; I315-L317 PolarHBondContact O-N 3.2Å; I315-F318 PolarHBondContact O-N 2.77Å; I315-E319 WeakPolarHBondContact O-CG 3.4Å; I315-E319 PolarHBondContact O-N 3.28Å
316	T	86.8	Confident	88.4	Confident	39 Å²	39	35.7 Å²	35.7	24%	0.239	18%	0.18	C	C	.	.	H	α-helix	trans	-67	-37.4	179.4	61.7	0	0	0	0	112.3	S286 L314 E319 F320	S286-T316 WeakPolarHBondContact CB-OG1 3.48Å; L314-T316 VanDerWaalsContact C-N 3.28Å; L314-T316 PolarHBondContact O-N 2.84Å; T316-E319 PolarHBondContact O-N 2.77Å; T316-F320 WeakPolarHBondContact O-CD2 3.24Å; T316-F320 PolarHBondContact O-N 2.91Å; T316-F320 VanDerWaalsContact O-N 3.16Å
317	L	91.3	Very high	88.2	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61	-50.4	177.2	179.8	148.2	0	0	0	110.7	L289 I293 V306 L314 I315 E319 F320 V321	L289-L317 HydrophobicContact CB-CD1 3.93Å; L289-L317 HydrophobicContact CD1-CD1 4.28Å; I293-L317 HydrophobicContact CD1-CD1 4.36Å; I293-L317 HydrophobicContact CD1-CD2 3.66Å; I293-L317 HydrophobicContact CD1-CG 4.28Å; V306-L317 HydrophobicContact CG1-CD1 4.19Å; V306-L317 HydrophobicContact CG1-CD2 4.23Å; V306-L317 HydrophobicContact CG2-CD2 4.48Å; L314-L317 HydrophobicContact CD2-CB 4.32Å; L314-L317 HydrophobicContact CD2-CD1 4.07Å; L314-L317 PolarHBondContact O-N 3.11Å; L314-L317 VanDerWaalsContact O-N 3.12Å; I315-L317 PolarHBondContact O-N 3.2Å; L317-E319 PolarHBondContact O-N 3.33Å; L317-F320 PolarHBondContact O-N 3.42Å; L317-F320 VanDerWaalsContact O-N 3.15Å; L317-V321 HydrophobicContact CD2-CG2 4.22Å; L317-V321 WeakPolarHBondContact O-CG2 3.44Å; L317-V321 PolarHBondContact O-N 2.88Å
318	F	92.2	Very high	88.1	Confident	3 Å²	3	38.5 Å²	38.5	1%	0.013	20%	0.2	C	C	.	.	H	α-helix	trans	-66.7	-34.9	178.7	-75.6	-66	0	0	0	113	L314 I315 F320 V321 L322 I350 I353 I363	L314-F318 HydrophobicContact CB-CD2 3.89Å; L314-F318 HydrophobicContact CB-CE2 3.87Å; L314-F318 HydrophobicContact CD1-CE2 4.23Å; L314-F318 VanDerWaalsContact O-CD2 3.31Å; L314-F318 WeakPolarHBondContact O-CD2 3.3Å; L314-F318 PolarHBondContact O-N 2.83Å; I315-F318 PolarHBondContact O-N 2.77Å; F318-F320 PolarHBondContact O-N 2.81Å; F318-V321 WeakPolarHBondContact O-CB 3.34Å; F318-V321 PolarHBondContact O-N 3.46Å; F318-L322 WeakPolarHBondContact O-CG 3.5Å; F318-L322 PolarHBondContact O-N 3.19Å; F318-I350 HydrophobicContact CB-CB 4.44Å; F318-I350 HydrophobicContact CB-CD1 3.91Å; F318-I350 HydrophobicContact CD1-CG2 4.06Å; F318-I350 HydrophobicContact CD2-CB 4.02Å; F318-I350 HydrophobicContact CD2-CG2 4.27Å; F318-I350 HydrophobicContact CE1-CG2 4.23Å; F318-I350 HydrophobicContact CE2-CB 4.41Å; F318-I350 HydrophobicContact CE2-CG2 4.44Å; F318-I350 WeakPolarHBondContact CE2-O 3.44Å; F318-I350 HydrophobicContact CG-CB 4.12Å; F318-I350 HydrophobicContact CG-CD1 4.47Å; F318-I350 HydrophobicContact CG-CG2 4.09Å; F318-I350 HydrophobicContact CZ-CG2 4.42Å; F318-I353 HydrophobicContact CD1-CD1 3.76Å; F318-I353 HydrophobicContact CE1-CD1 4.16Å; F318-I363 HydrophobicContact CE1-CG2 3.88Å
319	E	90.7	Very high	88.2	Confident	100 Å²	100	45.8 Å²	45.8	47%	0.467	23%	0.234	S	C	.	.	H	α-helix	trans	-57.7	-38	171.6	-79.2	176.9	-178.9	0	0	112.1	I315 T316 L317 L322 K323	I315-E319 WeakPolarHBondContact O-CG 3.4Å; I315-E319 PolarHBondContact O-N 3.28Å; T316-E319 PolarHBondContact O-N 2.77Å; L317-E319 PolarHBondContact O-N 3.33Å; E319-L322 PolarHBondContact O-N 3.4Å; E319-K323 WeakPolarHBondContact O-CG 3.47Å; E319-K323 PolarHBondContact O-N 3.37Å
320	F	92.2	Very high	88.6	Confident	48 Å²	48	44.4 Å²	44.4	21%	0.211	22%	0.222	C	C	.	.	H	α-helix	trans	-80.4	-24.2	177.2	-85	-90.9	0	0	0	113.8	A287 L291 T316 L317 F318 L322 K323 G324	A287-F320 HydrophobicContact CB-CB 4.42Å; A287-F320 HydrophobicContact CB-CD1 3.63Å; A287-F320 HydrophobicContact CB-CD2 3.62Å; A287-F320 HydrophobicContact CB-CE1 3.63Å; A287-F320 HydrophobicContact CB-CE2 3.62Å; A287-F320 HydrophobicContact CB-CG 3.61Å; A287-F320 HydrophobicContact CB-CZ 3.61Å; L291-F320 HydrophobicContact CG-CD1 4.4Å; T316-F320 WeakPolarHBondContact O-CD2 3.24Å; T316-F320 PolarHBondContact O-N 2.91Å; T316-F320 VanDerWaalsContact O-N 3.16Å; L317-F320 PolarHBondContact O-N 3.42Å; L317-F320 VanDerWaalsContact O-N 3.15Å; F318-F320 PolarHBondContact O-N 2.81Å; F320-L322 VanDerWaalsContact C-N 3.35Å; F320-K323 HydrophobicContact CD1-CD 4.28Å; F320-K323 HydrophobicContact CE1-CD 4.3Å; F320-G324 PolarHBondContact O-N 3.04Å
321	V	94.5	Very high	89	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-60.5	-48	165.4	175.5	0	0	0	0	109.8	I293 L317 F318 G324 F325 I353 I363	I293-V321 HydrophobicContact CB-CG2 3.98Å; I293-V321 HydrophobicContact CD1-CG2 4.13Å; I293-V321 HydrophobicContact CG2-CG1 4.3Å; I293-V321 HydrophobicContact CG2-CG2 3.91Å; L317-V321 HydrophobicContact CD2-CG2 4.22Å; L317-V321 WeakPolarHBondContact O-CG2 3.44Å; L317-V321 PolarHBondContact O-N 2.88Å; F318-V321 WeakPolarHBondContact O-CB 3.34Å; F318-V321 PolarHBondContact O-N 3.46Å; V321-G324 WeakPolarHBondContact O-CA 3.37Å; V321-G324 PolarHBondContact O-N 3.22Å; V321-G324 VanDerWaalsContact O-N 3.15Å; V321-F325 HydrophobicContact CG1-CD2 4.23Å; V321-F325 HydrophobicContact CG1-CE1 4.21Å; V321-F325 HydrophobicContact CG1-CE2 3.74Å; V321-F325 HydrophobicContact CG1-CZ 3.73Å; V321-F325 WeakPolarHBondContact O-CG 3.47Å; V321-F325 PolarHBondContact O-N 3.3Å; V321-I353 HydrophobicContact CG1-CD1 4.38Å; V321-I363 HydrophobicContact CG1-CD1 3.89Å
322	L	93.4	Very high	89.3	Confident	34 Å²	34	51.8 Å²	51.8	18%	0.178	26%	0.257	C	S	.	.	H	α-helix	trans	-63.8	-42.6	179	-62.8	177	0	0	0	111.9	F318 E319 F320 G324 F325 D326 Y336 I338 I353	F318-L322 WeakPolarHBondContact O-CG 3.5Å; F318-L322 PolarHBondContact O-N 3.19Å; E319-L322 PolarHBondContact O-N 3.4Å; F320-L322 VanDerWaalsContact C-N 3.35Å; L322-G324 VanDerWaalsContact C-N 3.27Å; L322-G324 PolarHBondContact O-N 2.97Å; L322-F325 HydrophobicContact CD2-CD2 4.32Å; L322-F325 WeakPolarHBondContact O-CA 3.26Å; L322-F325 WeakPolarHBondContact O-CB 3.23Å; L322-F325 PolarHBondContact O-N 3.37Å; L322-F325 VanDerWaalsContact O-N 3.1Å; L322-D326 PolarHBondContact O-N 3.42Å; L322-Y336 HydrophobicContact CD2-CD2 4.5Å; L322-Y336 HydrophobicContact CD2-CE2 3.63Å; L322-I338 HydrophobicContact CD1-CD1 3.99Å; L322-I338 HydrophobicContact CD2-CD1 3.92Å; L322-I353 HydrophobicContact CD2-CD1 4.43Å
323	K	92.5	Very high	89.9	Confident	99 Å²	99	56.6 Å²	56.6	43%	0.43	28%	0.279	S	S	.	.	H	α-helix	trans	-62.3	-34.5	173.2	-72.5	178.2	179.6	176.9	0	113.2	E319 F320 A327	E319-K323 WeakPolarHBondContact O-CG 3.47Å; E319-K323 PolarHBondContact O-N 3.37Å; F320-K323 HydrophobicContact CD1-CD 4.28Å; F320-K323 HydrophobicContact CE1-CD 4.3Å; K323-A327 PolarHBondContact O-N 3.19Å; K323-A327 VanDerWaalsContact O-N 3.14Å
324	G	92.8	Very high	90.4	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-65.5	-41.1	172.7	0	0	0	0	0	111.6	F320 V321 L322 A327 L328	F320-G324 PolarHBondContact O-N 3.04Å; V321-G324 WeakPolarHBondContact O-CA 3.37Å; V321-G324 PolarHBondContact O-N 3.22Å; V321-G324 VanDerWaalsContact O-N 3.15Å; L322-G324 VanDerWaalsContact C-N 3.27Å; L322-G324 PolarHBondContact O-N 2.97Å; G324-A327 PolarHBondContact O-N 3.36Å; G324-L328 WeakPolarHBondContact O-CB 3.48Å; G324-L328 VanDerWaalsContact O-CG 3.28Å; G324-L328 WeakPolarHBondContact O-CG 3.29Å; G324-L328 PolarHBondContact O-N 3Å
325	F	93.3	Very high	90.6	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-62.5	-43.1	173.1	-73.2	-10.7	0	0	0	112.7	A294 V297 V321 L322 A327 L328 E329 Y330 Y336 I353 I355 I363	A294-F325 HydrophobicContact CB-CD1 4.1Å; A294-F325 HydrophobicContact CB-CE1 4.19Å; V297-F325 HydrophobicContact CB-CE1 4.07Å; V297-F325 HydrophobicContact CB-CZ 4.47Å; V297-F325 HydrophobicContact CG1-CE1 4.03Å; V297-F325 HydrophobicContact CG1-CZ 4.31Å; V297-F325 HydrophobicContact CG2-CE1 4.14Å; V297-F325 HydrophobicContact CG2-CZ 4.12Å; V321-F325 HydrophobicContact CG1-CD2 4.23Å; V321-F325 HydrophobicContact CG1-CE1 4.21Å; V321-F325 HydrophobicContact CG1-CE2 3.74Å; V321-F325 HydrophobicContact CG1-CZ 3.73Å; V321-F325 WeakPolarHBondContact O-CG 3.47Å; V321-F325 PolarHBondContact O-N 3.3Å; L322-F325 HydrophobicContact CD2-CD2 4.32Å; L322-F325 WeakPolarHBondContact O-CA 3.26Å; L322-F325 WeakPolarHBondContact O-CB 3.23Å; L322-F325 PolarHBondContact O-N 3.37Å; L322-F325 VanDerWaalsContact O-N 3.1Å; F325-A327 VanDerWaalsContact C-N 3.3Å; F325-A327 PolarHBondContact O-N 3.5Å; F325-L328 CarbonylContact O-C 3.5Å; F325-L328 PolarHBondContact O-N 3.29Å; F325-L328 VanDerWaalsContact O-N 3.11Å; F325-E329 PolarHBondContact O-N 3.16Å; F325-Y330 HydrophobicContact CB-CG 4.48Å; F325-Y330 HydrophobicContact CD1-CD2 4.5Å; F325-Y330 HydrophobicContact CD1-CG 4.43Å; F325-Y330 HydrophobicContact CG-CG 4.48Å; F325-Y330 PolarHBondContact O-N 2.98Å; F325-Y336 HydrophobicContact CB-CE1 4.37Å; F325-Y336 HydrophobicContact CD2-CD1 4.04Å; F325-Y336 HydrophobicContact CD2-CE1 4.02Å; F325-Y336 HydrophobicContact CD2-CG 4.32Å; F325-Y336 HydrophobicContact CE2-CG 4.45Å; F325-I353 HydrophobicContact CE2-CG2 4.32Å; F325-I355 HydrophobicContact CE2-CD1 4.39Å; F325-I355 HydrophobicContact CE2-CG1 4.33Å; F325-I355 HydrophobicContact CZ-CD1 3.88Å; F325-I355 HydrophobicContact CZ-CG1 4.17Å; F325-I363 HydrophobicContact CZ-CD1 3.93Å
326	D	92.8	Very high	90.9	Very high	104 Å²	104	53.8 Å²	53.8	56%	0.556	27%	0.272	S	S	*	.	H	α-helix	trans	-58.2	-43.4	174.6	-64.5	-26.3	0	0	0	111.3	L322 L328 E329	L322-D326 PolarHBondContact O-N 3.42Å; D326-L328 VanDerWaalsContact C-N 3.29Å; D326-L328 PolarHBondContact O-N 3.07Å; D326-E329 PolarHBondContact O-N 3.01Å
327	A	90.7	Very high	91.2	Very high	36 Å²	36	54.8 Å²	54.8	30%	0.298	28%	0.278	S	S	.	.	H	α-helix	trans	-71.6	-21.1	178.3	0	0	0	0	0	114.1	L249 K323 G324 F325	L249-A327 HydrophobicContact CD1-CB 3.75Å; L249-A327 HydrophobicContact CG-CB 4.32Å; K323-A327 PolarHBondContact O-N 3.19Å; K323-A327 VanDerWaalsContact O-N 3.14Å; G324-A327 PolarHBondContact O-N 3.36Å; F325-A327 VanDerWaalsContact C-N 3.3Å; F325-A327 PolarHBondContact O-N 3.5Å
328	L	89.6	Confident	91.3	Very high	24 Å²	24	56.4 Å²	56.4	13%	0.126	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	11.1	173.7	-63.5	173.6	0	0	0	112.4	P242 A245 L246 A294 A298 G324 F325 D326 Y330 R357	P242-L328 HydrophobicContact CB-CD1 4.5Å; P242-L328 HydrophobicContact CB-CD2 3.61Å; A245-L328 HydrophobicContact CB-CD2 4.26Å; L246-L328 HydrophobicContact CD1-CD1 4.46Å; L246-L328 HydrophobicContact CD2-CD1 4.26Å; L246-L328 HydrophobicContact CD2-CG 4.29Å; A294-L328 HydrophobicContact CB-CD1 4.36Å; A298-L328 HydrophobicContact CB-CD1 4.18Å; G324-L328 WeakPolarHBondContact O-CB 3.48Å; G324-L328 VanDerWaalsContact O-CG 3.28Å; G324-L328 WeakPolarHBondContact O-CG 3.29Å; G324-L328 PolarHBondContact O-N 3Å; F325-L328 CarbonylContact O-C 3.5Å; F325-L328 PolarHBondContact O-N 3.29Å; F325-L328 VanDerWaalsContact O-N 3.11Å; D326-L328 VanDerWaalsContact C-N 3.29Å; D326-L328 PolarHBondContact O-N 3.07Å; L328-Y330 VanDerWaalsContact C-N 3.31Å; L328-Y330 HydrophobicContact CB-CD2 3.72Å; L328-Y330 HydrophobicContact CB-CE2 3.89Å; L328-Y330 WeakPolarHBondContact O-CD2 3.41Å; L328-Y330 PolarHBondContact O-N 3.47Å; L328-R357 PolarHBondContact O-NH1 2.99Å; L328-R357 VanDerWaalsContact O-NH1 3.1Å
329	E	90.9	Very high	91.2	Very high	152 Å²	152	59.7 Å²	59.7	71%	0.71	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	35.1	177	-52.5	179.1	166.3	0	0	114	F325 D326 R357	F325-E329 PolarHBondContact O-N 3.16Å; D326-E329 PolarHBondContact O-N 3.01Å; E329-R357 PolarHBondContact O-NH1 3Å
330	Y	89.6	Confident	91.2	Very high	23 Å²	23	62.4 Å²	62.4	9%	0.09	31%	0.31	C	S	.	.			trans	-84.2	135.8	169.8	-79.2	-109.4	0	0	0	110.1	V297 F325 L328 D335 I355 R357	V297-Y330 HydrophobicContact CG1-CE1 4.41Å; F325-Y330 HydrophobicContact CB-CG 4.48Å; F325-Y330 HydrophobicContact CD1-CD2 4.5Å; F325-Y330 HydrophobicContact CD1-CG 4.43Å; F325-Y330 HydrophobicContact CG-CG 4.48Å; F325-Y330 PolarHBondContact O-N 2.98Å; L328-Y330 VanDerWaalsContact C-N 3.31Å; L328-Y330 HydrophobicContact CB-CD2 3.72Å; L328-Y330 HydrophobicContact CB-CE2 3.89Å; L328-Y330 WeakPolarHBondContact O-CD2 3.41Å; L328-Y330 PolarHBondContact O-N 3.47Å; Y330-D335 WeakPolarHBondContact CA-OD2 3.41Å; Y330-D335 HydrophobicContact CD1-CB 3.91Å; Y330-I355 HydrophobicContact CD1-CG2 4.36Å; Y330-I355 HydrophobicContact CE1-CG2 3.94Å; Y330-R357 HydrophobicContact CD1-CB 4.37Å; Y330-R357 VanDerWaalsContact CD2-NH1 3.25Å; Y330-R357 HydrophobicContact CE1-CB 3.92Å; Y330-R357 HydrophobicContact CE1-CG 4.37Å; Y330-R357 VanDerWaalsContact CE2-NH1 3.34Å
331	Q	89.5	Confident	90.8	Very high	131 Å²	131	60.6 Å²	60.6	61%	0.612	30%	0.303	S	S	*	.			trans	-105.3	134.5	-178.1	-64.6	-175.1	2.1	0	0	112.9	A334 D335 Y336	Q331-A334 HydrophobicContact CB-CB 4.06Å; Q331-A334 PolarHBondContact O-N 3.45Å; Q331-D335 PolarHBondContact N-OD2 2.98Å; Q331-D335 WeakPolarHBondContact O-CB 3.45Å; Q331-D335 PolarHBondContact O-N 2.94Å; Q331-Y336 PolarHBondContact O-N 2.73Å
332	E	88.1	Confident	90.3	Very high	94 Å²	94	67.7 Å²	67.7	44%	0.439	35%	0.347	S	S	.	.	B	Isolated β-bridge	trans	-63.6	140.9	173.4	-164.3	172.6	-176.6	0	0	110.7	A334 Y336 I338	E332-A334 PolarHBondContact O-N 3.48Å; E332-Y336 HydrophobicContact CB-CE1 4.25Å; E332-Y336 HydrophobicContact CB-CE2 3.98Å; E332-Y336 HydrophobicContact CG-CD2 4.45Å; E332-Y336 HydrophobicContact CG-CE2 3.76Å; E332-I338 WeakPolarHBondContact OE1-CD1 3.01Å
333	H	88.5	Confident	89.7	Confident	149 Å²	149	69.2 Å²	69.2	69%	0.69	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.8	-18.9	-176.7	-51.9	-60.2	0	0	0	116.6	Y336	H333-Y336 WeakPolarHBondContact CA-O 3.34Å; H333-Y336 PolarHBondContact N-O 3.41Å
334	A	87.5	Confident	88.8	Confident	59 Å²	59	68.5 Å²	68.5	49%	0.488	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-54.8	170.1	0	0	0	0	0	111.2	Q331 E332	Q331-A334 HydrophobicContact CB-CB 4.06Å; Q331-A334 PolarHBondContact O-N 3.45Å; E332-A334 PolarHBondContact O-N 3.48Å
335	D	90.1	Very high	87.8	Confident	27 Å²	27	73.7 Å²	73.7	14%	0.144	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-28.8	-175.3	-65.7	-43.7	0	0	0	113.2	Y330 Q331 I355 T356 R357	Y330-D335 WeakPolarHBondContact CA-OD2 3.41Å; Y330-D335 HydrophobicContact CD1-CB 3.91Å; Q331-D335 PolarHBondContact N-OD2 2.98Å; Q331-D335 WeakPolarHBondContact O-CB 3.45Å; Q331-D335 PolarHBondContact O-N 2.94Å; D335-I355 CarbonylContact O-C 3.52Å; D335-I355 WeakPolarHBondContact O-CA 3.21Å; D335-T356 PolarHBondContact O-N 3.03Å; D335-T356 PolarHBondContact O-OG1 3.1Å; D335-R357 HydrophobicContact CB-CB 4.07Å; D335-R357 WeakPolarHBondContact OD1-CG 3.45Å
336	Y	92.5	Very high	86.8	Confident	7 Å²	7	77 Å²	77	3%	0.027	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	157.6	179.8	70.3	-89.9	0	0	0	113.7	L322 F325 Q331 E332 H333 I338 I353 N354	L322-Y336 HydrophobicContact CD2-CD2 4.5Å; L322-Y336 HydrophobicContact CD2-CE2 3.63Å; F325-Y336 HydrophobicContact CB-CE1 4.37Å; F325-Y336 HydrophobicContact CD2-CD1 4.04Å; F325-Y336 HydrophobicContact CD2-CE1 4.02Å; F325-Y336 HydrophobicContact CD2-CG 4.32Å; F325-Y336 HydrophobicContact CE2-CG 4.45Å; Q331-Y336 PolarHBondContact O-N 2.73Å; E332-Y336 HydrophobicContact CB-CE1 4.25Å; E332-Y336 HydrophobicContact CB-CE2 3.98Å; E332-Y336 HydrophobicContact CG-CD2 4.45Å; E332-Y336 HydrophobicContact CG-CE2 3.76Å; H333-Y336 WeakPolarHBondContact CA-O 3.34Å; H333-Y336 PolarHBondContact N-O 3.41Å; Y336-I338 HydrophobicContact CD2-CG1 4.1Å; Y336-I338 HydrophobicContact CE2-CD1 4.07Å; Y336-I338 HydrophobicContact CE2-CG1 3.92Å; Y336-I353 HydrophobicContact CD2-CG2 4Å; Y336-I353 HydrophobicContact CG-CG2 4.42Å; Y336-N354 CarbonylContact C-O 3.55Å; Y336-N354 WeakPolarHBondContact CA-O 3.28Å; Y336-N354 WeakPolarHBondContact CB-O 3.24Å
337	T	93	Very high	85.9	Confident	60 Å²	60	78.2 Å²	78.2	37%	0.368	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	136.7	177.2	54.9	0	0	0	0	111	I353 N354	T337-I353 WeakPolarHBondContact O-CA 3.31Å; T337-N354 PolarHBondContact N-O 3.15Å; T337-N354 PolarHBondContact O-N 3.22Å
338	I	92.8	Very high	85.3	Confident	35 Å²	35	83.9 Å²	83.9	18%	0.179	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	126.4	-178	-52.8	178.3	0	0	0	109.9	L322 E332 Y336 R340 I350	L322-I338 HydrophobicContact CD1-CD1 3.99Å; L322-I338 HydrophobicContact CD2-CD1 3.92Å; E332-I338 WeakPolarHBondContact OE1-CD1 3.01Å; Y336-I338 HydrophobicContact CD2-CG1 4.1Å; Y336-I338 HydrophobicContact CE2-CD1 4.07Å; Y336-I338 HydrophobicContact CE2-CG1 3.92Å; I338-R340 HydrophobicContact CG2-CG 4.37Å; I338-I350 HydrophobicContact CG2-CB 4.39Å; I338-I350 HydrophobicContact CG2-CD1 4.02Å; I338-I350 HydrophobicContact CG2-CG1 3.81Å; I338-I350 HydrophobicContact CG2-CG2 3.82Å
339	I	90.9	Very high	84.9	Confident	72 Å²	72	83.2 Å²	83.2	37%	0.369	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	122.5	174.2	-58.8	170.5	0	0	0	108.9	I351 R352 N354	I339-I351 PolarHBondContact O-N 3.02Å; I339-R352 HydrophobicContact CB-CB 4.24Å; I339-R352 HydrophobicContact CD1-CB 4.43Å; I339-R352 PolarHBondContact N-O 3.36Å; I339-R352 PolarHBondContact O-N 3.04Å; I339-N354 WeakPolarHBondContact CD1-ND2 3.5Å
340	R	89.4	Confident	84.7	Confident	156 Å²	156	77.3 Å²	77.3	59%	0.589	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	154.2	178.7	-61	-174.4	-174.7	-156	3.6	111.4	I338 A349 I350	I338-R340 HydrophobicContact CG2-CG 4.37Å; R340-A349 CarbonylContact C-O 3.57Å; R340-A349 WeakPolarHBondContact CA-O 3.43Å; R340-I350 HydrophobicContact CG-CG1 4.44Å
341	S	85.3	Confident	84.6	Confident	10 Å²	10	78.3 Å²	78.3	7%	0.07	40%	0.404	C	S	.	.			trans	-60.5	137.1	175.4	-171.5	0	0	0	0	112.7	N343 Y346 A349 I351	S341-N343 PolarHBondContact OG-N 3.05Å; S341-Y346 WeakPolarHBondContact OG-CB 3.45Å; S341-Y346 WeakPolarHBondContact OG-CD2 3.31Å; S341-A349 PolarHBondContact N-O 2.91Å; S341-I351 VanDerWaalsContact CA-CD1 3.46Å; S341-I351 VanDerWaalsContact CB-CD1 3.4Å
342	T	83.6	Confident	84.7	Confident	150 Å²	150	76.3 Å²	76.3	92%	0.92	39%	0.391	S	S	*	.			trans	-86.1	-18.7	164.5	51.4	0	0	0	0	112.7
343	N	79.6	Confident	84.9	Confident	66 Å²	66	71.8 Å²	71.8	35%	0.353	37%	0.37	S	S	.	.			trans	-70.4	131.9	179.3	-168.1	-0.3	0	0	0	111	S341 D345 Y346	S341-N343 PolarHBondContact OG-N 3.05Å; N343-D345 VanDerWaalsContact C-N 3.28Å; N343-D345 PolarHBondContact O-N 2.89Å; N343-D345 PolarHBondContact OD1-N 2.81Å; N343-Y346 HydrophobicContact CB-CD2 3.98Å; N343-Y346 HydrophobicContact CB-CE2 4.43Å; N343-Y346 HydrophobicContact CB-CG 4.38Å; N343-Y346 PolarHBondContact O-N 2.69Å
344	A	75	Confident	85.2	Confident	84 Å²	84	66.8 Å²	66.8	69%	0.694	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-61.7	-36.7	178.8	0	0	0	0	0	112	Y346 K347	A344-Y346 PolarHBondContact O-N 2.94Å; A344-K347 PolarHBondContact O-N 2.98Å; A344-K347 VanDerWaalsContact O-N 3.11Å
345	D	70.1	Confident	85.5	Confident	109 Å²	109	64 Å²	64	58%	0.583	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-62	-28.2	-179.6	-61.3	-29.6	0	0	0	112.5	N343	N343-D345 VanDerWaalsContact C-N 3.28Å; N343-D345 PolarHBondContact O-N 2.89Å; N343-D345 PolarHBondContact OD1-N 2.81Å
346	Y	73.4	Confident	85.5	Confident	69 Å²	69	66.7 Å²	66.7	27%	0.271	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-93.3	7.9	-178.3	-58.9	-21.8	0	0	0	113.2	P311 S341 N343 A344 K348 A349 I351	P311-Y346 HydrophobicContact CB-CG 4.48Å; P311-Y346 HydrophobicContact CG-CD1 3.69Å; P311-Y346 HydrophobicContact CG-CD2 4.25Å; P311-Y346 HydrophobicContact CG-CE1 3.83Å; P311-Y346 HydrophobicContact CG-CE2 4.39Å; P311-Y346 HydrophobicContact CG-CG 3.92Å; S341-Y346 WeakPolarHBondContact OG-CB 3.45Å; S341-Y346 WeakPolarHBondContact OG-CD2 3.31Å; N343-Y346 HydrophobicContact CB-CD2 3.98Å; N343-Y346 HydrophobicContact CB-CE2 4.43Å; N343-Y346 HydrophobicContact CB-CG 4.38Å; N343-Y346 PolarHBondContact O-N 2.69Å; A344-Y346 PolarHBondContact O-N 2.94Å; Y346-K348 PolarHBondContact O-N 3.11Å; Y346-A349 WeakPolarHBondContact O-CB 3.49Å; Y346-A349 PolarHBondContact O-N 2.8Å; Y346-I351 HydrophobicContact CD2-CD1 4.35Å
347	K	74.1	Confident	85	Confident	129 Å²	129	72 Å²	72	56%	0.561	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	44	40.2	174.6	-60.3	-174.5	-170.2	134.7	0	114.7	E312 A344 A349	E312-K347 VanDerWaalsContact CD-NZ 3.26Å; E312-K347 WeakPolarHBondContact OE1-CD 3.5Å; E312-K347 WeakPolarHBondContact OE1-CE 3.17Å; E312-K347 WeakPolarHBondContact OE1-CG 3.47Å; E312-K347 IonicContact OE1-NZ 2.71Å; E312-K347 PolarHBondContact OE1-NZ 3.43Å; E312-K347 IonicContact OE2-NZ 3.45Å; E312-K347 PolarHBondContact OE2-NZ 2.96Å; A344-K347 PolarHBondContact O-N 2.98Å; A344-K347 VanDerWaalsContact O-N 3.11Å; K347-A349 VanDerWaalsContact C-N 3.29Å; K347-A349 PolarHBondContact O-N 3.3Å
348	K	77.6	Confident	84.2	Confident	156 Å²	156	73.7 Å²	73.7	68%	0.678	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	31.3	-176.4	-55.7	-179.7	176.1	-177.5	0	114.7	Y346	Y346-K348 PolarHBondContact O-N 3.11Å
349	A	81.2	Confident	83.8	Confident	9 Å²	9	74.3 Å²	74.3	7%	0.074	38%	0.384	C	S	.	.			trans	-59	152.5	172.3	0	0	0	0	0	111.7	P311 R340 S341 Y346 K347 I351	P311-A349 HydrophobicContact CB-CB 4.04Å; R340-A349 CarbonylContact C-O 3.57Å; R340-A349 WeakPolarHBondContact CA-O 3.43Å; S341-A349 PolarHBondContact N-O 2.91Å; Y346-A349 WeakPolarHBondContact O-CB 3.49Å; Y346-A349 PolarHBondContact O-N 2.8Å; K347-A349 VanDerWaalsContact C-N 3.29Å; K347-A349 PolarHBondContact O-N 3.3Å; A349-I351 PolarHBondContact O-N 3.18Å
350	I	86.3	Confident	83.7	Confident	29 Å²	29	81.1 Å²	81.1	15%	0.149	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	123.7	174	-61.5	171.3	0	0	0	107.8	F318 I338 R340 I353	F318-I350 HydrophobicContact CB-CB 4.44Å; F318-I350 HydrophobicContact CB-CD1 3.91Å; F318-I350 HydrophobicContact CD1-CG2 4.06Å; F318-I350 HydrophobicContact CD2-CB 4.02Å; F318-I350 HydrophobicContact CD2-CG2 4.27Å; F318-I350 HydrophobicContact CE1-CG2 4.23Å; F318-I350 HydrophobicContact CE2-CB 4.41Å; F318-I350 HydrophobicContact CE2-CG2 4.44Å; F318-I350 WeakPolarHBondContact CE2-O 3.44Å; F318-I350 HydrophobicContact CG-CB 4.12Å; F318-I350 HydrophobicContact CG-CD1 4.47Å; F318-I350 HydrophobicContact CG-CG2 4.09Å; F318-I350 HydrophobicContact CZ-CG2 4.42Å; I338-I350 HydrophobicContact CG2-CB 4.39Å; I338-I350 HydrophobicContact CG2-CD1 4.02Å; I338-I350 HydrophobicContact CG2-CG1 3.81Å; I338-I350 HydrophobicContact CG2-CG2 3.82Å; R340-I350 HydrophobicContact CG-CG1 4.44Å; I350-I353 HydrophobicContact CG2-CD1 4.28Å; I350-I353 HydrophobicContact CG2-CG1 3.9Å
351	I	87.6	Confident	83.9	Confident	43 Å²	43	73.8 Å²	73.8	22%	0.221	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	-39.3	178.1	-63.5	-176.1	0	0	0	110.5	I339 S341 Y346 A349 Q364 Y365	I339-I351 PolarHBondContact O-N 3.02Å; S341-I351 VanDerWaalsContact CA-CD1 3.46Å; S341-I351 VanDerWaalsContact CB-CD1 3.4Å; Y346-I351 HydrophobicContact CD2-CD1 4.35Å; A349-I351 PolarHBondContact O-N 3.18Å; I351-Q364 WeakPolarHBondContact O-CA 3.35Å; I351-Y365 PolarHBondContact O-N 3.25Å
352	R	91.9	Very high	84.3	Confident	89 Å²	89	74.9 Å²	74.9	34%	0.336	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	141.7	-175	-172.3	-177.5	-74	153.5	-8.1	111.2	I339 N354 I363 Q364	I339-R352 HydrophobicContact CB-CB 4.24Å; I339-R352 HydrophobicContact CD1-CB 4.43Å; I339-R352 PolarHBondContact N-O 3.36Å; I339-R352 PolarHBondContact O-N 3.04Å; R352-N354 VanDerWaalsContact CD-OD1 3.32Å; R352-N354 WeakPolarHBondContact CD-OD1 3.28Å; R352-I363 CarbonylContact C-O 3.56Å; R352-I363 VanDerWaalsContact CA-O 3.23Å; R352-I363 WeakPolarHBondContact CA-O 3.38Å; R352-I363 WeakPolarHBondContact CG-O 3.5Å; R352-Q364 HydrophobicContact CG-CB 4.3Å; R352-Q364 VanDerWaalsContact NE-OE1 3.1Å; R352-Q364 VanDerWaalsContact NH2-NE2 3.17Å
353	I	93.6	Very high	84.9	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	122.3	168.6	-55.7	175.6	0	0	0	107.2	F318 V321 L322 F325 Y336 T337 I350 I355 T362 I363	F318-I353 HydrophobicContact CD1-CD1 3.76Å; F318-I353 HydrophobicContact CE1-CD1 4.16Å; V321-I353 HydrophobicContact CG1-CD1 4.38Å; L322-I353 HydrophobicContact CD2-CD1 4.43Å; F325-I353 HydrophobicContact CE2-CG2 4.32Å; Y336-I353 HydrophobicContact CD2-CG2 4Å; Y336-I353 HydrophobicContact CG-CG2 4.42Å; T337-I353 WeakPolarHBondContact O-CA 3.31Å; I350-I353 HydrophobicContact CG2-CD1 4.28Å; I350-I353 HydrophobicContact CG2-CG1 3.9Å; I353-I355 HydrophobicContact CG2-CD1 4.42Å; I353-I355 HydrophobicContact CG2-CG1 4.24Å; I353-T362 WeakPolarHBondContact O-CA 3.36Å; I353-I363 HydrophobicContact CB-CB 4.32Å; I353-I363 PolarHBondContact N-O 2.82Å; I353-I363 PolarHBondContact O-N 2.77Å
354	N	93.8	Very high	85.5	Confident	44 Å²	44	66.2 Å²	66.2	24%	0.235	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	130.6	173.9	-60	-37.4	0	0	0	108.7	Y336 T337 I339 R352	Y336-N354 CarbonylContact C-O 3.55Å; Y336-N354 WeakPolarHBondContact CA-O 3.28Å; Y336-N354 WeakPolarHBondContact CB-O 3.24Å; T337-N354 PolarHBondContact N-O 3.15Å; T337-N354 PolarHBondContact O-N 3.22Å; I339-N354 WeakPolarHBondContact CD1-ND2 3.5Å; R352-N354 VanDerWaalsContact CD-OD1 3.32Å; R352-N354 WeakPolarHBondContact CD-OD1 3.28Å
355	I	93.8	Very high	86.4	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.005	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	138.4	179.9	-58.2	125.4	0	0	0	108.7	V297 F325 Y330 D335 I353 S359 R360 Q361 I363	V297-I355 HydrophobicContact CG1-CD1 4Å; V297-I355 HydrophobicContact CG1-CG2 4.28Å; V297-I355 HydrophobicContact CG2-CD1 3.93Å; F325-I355 HydrophobicContact CE2-CD1 4.39Å; F325-I355 HydrophobicContact CE2-CG1 4.33Å; F325-I355 HydrophobicContact CZ-CD1 3.88Å; F325-I355 HydrophobicContact CZ-CG1 4.17Å; Y330-I355 HydrophobicContact CD1-CG2 4.36Å; Y330-I355 HydrophobicContact CE1-CG2 3.94Å; D335-I355 CarbonylContact O-C 3.52Å; D335-I355 WeakPolarHBondContact O-CA 3.21Å; I353-I355 HydrophobicContact CG2-CD1 4.42Å; I353-I355 HydrophobicContact CG2-CG1 4.24Å; I355-S359 VanDerWaalsContact O-O 3.13Å; I355-R360 WeakPolarHBondContact O-CA 3.35Å; I355-Q361 HydrophobicContact CB-CB 4.25Å; I355-Q361 HydrophobicContact CD1-CB 4.36Å; I355-Q361 PolarHBondContact N-O 2.64Å; I355-Q361 PolarHBondContact O-N 3.14Å; I355-I363 HydrophobicContact CD1-CD1 3.92Å; I355-I363 HydrophobicContact CD1-CG1 4.07Å
356	T	89.8	Confident	87.4	Confident	83 Å²	83	58.1 Å²	58.1	51%	0.509	28%	0.275	S	S	.	.			trans	-130.8	2.7	-173.9	48.9	0	0	0	0	114.7	D335 S358	D335-T356 PolarHBondContact O-N 3.03Å; D335-T356 PolarHBondContact O-OG1 3.1Å; T356-S358 PolarHBondContact O-N 3.27Å
357	R	82.3	Confident	88.1	Confident	119 Å²	119	55.9 Å²	55.9	45%	0.449	27%	0.27	S	S	.	.	S	Bend	trans	-56	-51.1	-174.4	-171.2	173.5	-179.1	179.7	3.5	114	L328 E329 Y330 D335	L328-R357 PolarHBondContact O-NH1 2.99Å; L328-R357 VanDerWaalsContact O-NH1 3.1Å; E329-R357 PolarHBondContact O-NH1 3Å; Y330-R357 HydrophobicContact CD1-CB 4.37Å; Y330-R357 VanDerWaalsContact CD2-NH1 3.25Å; Y330-R357 HydrophobicContact CE1-CB 3.92Å; Y330-R357 HydrophobicContact CE1-CG 4.37Å; Y330-R357 VanDerWaalsContact CE2-NH1 3.34Å; D335-R357 HydrophobicContact CB-CB 4.07Å; D335-R357 WeakPolarHBondContact OD1-CG 3.45Å
358	S	75.8	Confident	88.7	Confident	94 Å²	94	50.6 Å²	50.6	66%	0.657	25%	0.249	S	C	*	.	S	Bend	trans	-118.5	-47.6	-177.7	54.5	0	0	0	0	112.2	T356	T356-S358 PolarHBondContact O-N 3.27Å
359	S	83.9	Confident	89.1	Confident	49 Å²	49	46.6 Å²	46.6	34%	0.343	24%	0.241	S	C	.	.	S	Bend	trans	-137.6	162.6	173.4	61	0	0	0	0	109.5	I355 Q361	I355-S359 VanDerWaalsContact O-O 3.13Å; S359-Q361 PolarHBondContact O-N 2.89Å; S359-Q361 VanDerWaalsContact O-N 3.07Å; S359-Q361 WeakPolarHBondContact OG-CG 3.49Å
360	R	89.4	Confident	89.4	Confident	215 Å²	215	48.9 Å²	48.9	81%	0.811	25%	0.252	S	S	*	.			trans	-73.4	100.5	174.7	-72.1	-174.7	177.8	177.7	0.5	108.9	V302 I355	V302-R360 WeakPolarHBondContact CG1-O 3.33Å; I355-R360 WeakPolarHBondContact O-CA 3.35Å
361	Q	94.3	Very high	89.3	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.009	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	149.6	177.4	-54.9	167.9	-71.9	0	0	109.3	V297 Y301 V302 I355 S359	V297-Q361 PolarHBondContact O-NE2 3.46Å; Y301-Q361 WeakPolarHBondContact O-CG 3.42Å; Y301-Q361 PolarHBondContact O-NE2 2.63Å; V302-Q361 CarbonylContact O-C 3.54Å; V302-Q361 WeakPolarHBondContact O-CA 3.46Å; I355-Q361 HydrophobicContact CB-CB 4.25Å; I355-Q361 HydrophobicContact CD1-CB 4.36Å; I355-Q361 PolarHBondContact N-O 2.64Å; I355-Q361 PolarHBondContact O-N 3.14Å; S359-Q361 PolarHBondContact O-N 2.89Å; S359-Q361 VanDerWaalsContact O-N 3.07Å; S359-Q361 WeakPolarHBondContact OG-CG 3.49Å
362	T	94.3	Very high	89.2	Confident	32 Å²	32	53.1 Å²	53.1	20%	0.196	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	130.7	-180	66.1	0	0	0	0	110.9	V302 N303 I304 I353	V302-T362 PolarHBondContact O-N 3.43Å; N303-T362 PolarHBondContact OD1-OG1 3.22Å; I304-T362 PolarHBondContact N-O 3.21Å; I353-T362 WeakPolarHBondContact O-CA 3.36Å
363	I	94.8	Very high	88.9	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	121.9	166.4	-54.1	166.2	0	0	0	106.7	I293 V297 I304 V306 F318 V321 F325 R352 I353 I355	I293-I363 HydrophobicContact CG2-CD1 3.59Å; I293-I363 HydrophobicContact CG2-CG1 4.13Å; I293-I363 HydrophobicContact CG2-CG2 4.37Å; V297-I363 HydrophobicContact CG2-CD1 3.97Å; V297-I363 HydrophobicContact CG2-CG1 4.29Å; I304-I363 HydrophobicContact CB-CG1 4.3Å; I304-I363 HydrophobicContact CD1-CG1 4.36Å; I304-I363 CarbonylContact O-C 3.49Å; I304-I363 VanDerWaalsContact O-CA 3.29Å; I304-I363 WeakPolarHBondContact O-CA 2.87Å; V306-I363 HydrophobicContact CG2-CG2 4.16Å; F318-I363 HydrophobicContact CE1-CG2 3.88Å; V321-I363 HydrophobicContact CG1-CD1 3.89Å; F325-I363 HydrophobicContact CZ-CD1 3.93Å; R352-I363 CarbonylContact C-O 3.56Å; R352-I363 VanDerWaalsContact CA-O 3.23Å; R352-I363 WeakPolarHBondContact CA-O 3.38Å; R352-I363 WeakPolarHBondContact CG-O 3.5Å; I353-I363 HydrophobicContact CB-CB 4.32Å; I353-I363 PolarHBondContact N-O 2.82Å; I353-I363 PolarHBondContact O-N 2.77Å; I355-I363 HydrophobicContact CD1-CD1 3.92Å; I355-I363 HydrophobicContact CD1-CG1 4.07Å
364	Q	92.9	Very high	88.6	Confident	35 Å²	35	52.8 Å²	52.8	16%	0.164	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	137.2	-176.4	177.3	175	-12.7	0	0	112.6	I304 Y305 V306 I351 R352 I366	I304-Q364 PolarHBondContact O-N 3.01Å; Y305-Q364 WeakPolarHBondContact CA-O 3.38Å; Y305-Q364 HydrophobicContact CD1-CB 3.97Å; Y305-Q364 HydrophobicContact CE1-CB 4.12Å; V306-Q364 PolarHBondContact N-O 3.46Å; I351-Q364 WeakPolarHBondContact O-CA 3.35Å; R352-Q364 HydrophobicContact CG-CB 4.3Å; R352-Q364 VanDerWaalsContact NE-OE1 3.1Å; R352-Q364 VanDerWaalsContact NH2-NE2 3.17Å; Q364-I366 HydrophobicContact CG-CG1 4.37Å
365	Y	93.1	Very high	88.2	Confident	18 Å²	18	57.2 Å²	57.2	7%	0.071	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	130.4	165.4	171.1	-102.6	0	0	0	111.3	V306 S308 P311 L314 I351 A367	V306-Y365 CarbonylContact O-C 3.58Å; V306-Y365 VanDerWaalsContact O-CA 3.27Å; V306-Y365 WeakPolarHBondContact O-CA 3.46Å; V306-Y365 WeakPolarHBondContact O-CD2 3.43Å; S308-Y365 PolarHBondContact O-OH 2.99Å; P311-Y365 HydrophobicContact CG-CD1 4.18Å; P311-Y365 HydrophobicContact CG-CE1 3.62Å; P311-Y365 HydrophobicContact CG-CE2 4.38Å; L314-Y365 HydrophobicContact CD1-CD2 3.34Å; L314-Y365 HydrophobicContact CD1-CE2 3.86Å; L314-Y365 HydrophobicContact CD1-CG 4.27Å; I351-Y365 PolarHBondContact O-N 3.25Å; Y365-A367 HydrophobicContact CE1-CB 4.45Å
366	I	91.6	Very high	87.9	Confident	5 Å²	5	59.8 Å²	59.8	3%	0.026	32%	0.321	C	S	.	.			trans	-123.5	130.8	173.1	-61.3	-176.6	0	0	0	109	Y305 V306 T307 Q364 D370 L373 L374	Y305-I366 HydrophobicContact CD1-CD1 3.71Å; Y305-I366 HydrophobicContact CD1-CG1 4.34Å; Y305-I366 HydrophobicContact CD2-CD1 3.2Å; Y305-I366 HydrophobicContact CD2-CG1 4.45Å; Y305-I366 HydrophobicContact CE1-CD1 4.06Å; Y305-I366 HydrophobicContact CE2-CD1 3.58Å; Y305-I366 HydrophobicContact CG-CD1 3.29Å; Y305-I366 HydrophobicContact CG-CG1 4.14Å; V306-I366 PolarHBondContact O-N 3.39Å; T307-I366 PolarHBondContact OG1-O 3.24Å; Q364-I366 HydrophobicContact CG-CG1 4.37Å; I366-D370 HydrophobicContact CG2-CB 4.07Å; I366-L373 HydrophobicContact CD1-CB 4Å; I366-L374 HydrophobicContact CD1-CD2 3.99Å; I366-L374 HydrophobicContact CG2-CD2 4.37Å
367	A	88.5	Confident	87.9	Confident	21 Å²	21	56.2 Å²	56.2	17%	0.174	30%	0.3	C	S	.	.			trans	-65.9	143.5	176.5	0	0	0	0	0	110.7	Y365 S369 D370	Y365-A367 HydrophobicContact CE1-CB 4.45Å; A367-S369 PolarHBondContact O-N 3.03Å; A367-D370 PolarHBondContact O-N 3.17Å
368	P	87.3	Confident	88.3	Confident	18 Å²	18	53.6 Å²	53.6	12%	0.117	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-23.8	-179.7	-31.3	36.1	0	0	0	116.4	T307 S308 I388 M396	T307-P368 HydrophobicContact CG2-CB 4.24Å; T307-P368 HydrophobicContact CG2-CG 3.68Å; S308-P368 VanDerWaalsContact O-CD 3.31Å; S308-P368 WeakPolarHBondContact O-CD 3.46Å; S308-P368 VanDerWaalsContact O-CG 3.3Å; S308-P368 WeakPolarHBondContact O-CG 3.31Å; P368-I388 HydrophobicContact CB-CD1 4.49Å; P368-I388 HydrophobicContact CB-CG2 4.22Å; P368-I388 HydrophobicContact CG-CD1 4.06Å; P368-I388 HydrophobicContact CG-CG1 4.42Å; P368-M396 HydrophobicContact CB-CE 3.52Å; P368-M396 HydrophobicContact CG-CE 4.45Å; P368-M396 WeakPolarHBondContact O-CE 3.36Å
369	S	85.6	Confident	89.1	Confident	73 Å²	73	49.1 Å²	49.1	51%	0.51	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-29.7	177.4	48.8	0	0	0	0	113.2	A367 T371	A367-S369 PolarHBondContact O-N 3.03Å; S369-T371 VanDerWaalsContact C-N 3.26Å; S369-T371 PolarHBondContact O-N 3.12Å
370	D	87.3	Confident	89.5	Confident	57 Å²	57	46.8 Å²	46.8	31%	0.305	25%	0.247	S	C	.	.			trans	-94.6	52.3	-161.9	-57.7	-11.8	0	0	0	111.4	I366 A367 H372 L373	I366-D370 HydrophobicContact CG2-CB 4.07Å; A367-D370 PolarHBondContact O-N 3.17Å; D370-H372 PolarHBondContact O-N 2.97Å; D370-H372 VanDerWaalsContact O-N 3.16Å; D370-L373 HydrophobicContact CB-CD1 4.09Å; D370-L373 PolarHBondContact O-N 2.84Å
371	T	83.9	Confident	89.7	Confident	34 Å²	34	36.6 Å²	36.6	21%	0.209	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-60.4	-25	-175.3	50.1	0	0	0	0	114.2	S369 L373 L374 K395 M396	S369-T371 VanDerWaalsContact C-N 3.26Å; S369-T371 PolarHBondContact O-N 3.12Å; T371-L373 VanDerWaalsContact C-N 3.27Å; T371-L373 PolarHBondContact O-N 3.31Å; T371-L374 HydrophobicContact CG2-CD1 4.46Å; T371-L374 WeakPolarHBondContact O-CB 3.32Å; T371-L374 PolarHBondContact O-N 3.23Å; T371-L374 VanDerWaalsContact O-N 3.16Å; T371-K395 HydrophobicContact CG2-CB 3.99Å; T371-M396 HydrophobicContact CG2-CG 4.05Å
372	H	84.8	Confident	89.6	Confident	126 Å²	126	36.5 Å²	36.5	58%	0.583	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-65.9	-27.4	179.6	34.6	-85.8	0	0	0	113.2	D370 L374	D370-H372 PolarHBondContact O-N 2.97Å; D370-H372 VanDerWaalsContact O-N 3.16Å; H372-L374 VanDerWaalsContact C-N 3.27Å; H372-L374 PolarHBondContact O-N 2.99Å
373	L	86.1	Confident	89.3	Confident	81 Å²	81	35.1 Å²	35.1	42%	0.424	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-73.5	-21.1	176.7	-63.4	175.9	0	0	0	112.4	Y305 I366 D370 T371 N375 A376	Y305-L373 WeakPolarHBondContact CE2-O 3.45Å; I366-L373 HydrophobicContact CD1-CB 4Å; D370-L373 HydrophobicContact CB-CD1 4.09Å; D370-L373 PolarHBondContact O-N 2.84Å; T371-L373 VanDerWaalsContact C-N 3.27Å; T371-L373 PolarHBondContact O-N 3.31Å; L373-N375 PolarHBondContact O-N 3.11Å; L373-A376 PolarHBondContact O-N 3.06Å
374	L	87.1	Confident	88.8	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.01	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-70.8	-16.1	-175.7	-59.7	175.4	0	0	0	113.5	Y305 I366 T371 H372 A376 A377 L380 M396 Y400	Y305-L374 HydrophobicContact CD2-CD2 4.01Å; I366-L374 HydrophobicContact CD1-CD2 3.99Å; I366-L374 HydrophobicContact CG2-CD2 4.37Å; T371-L374 HydrophobicContact CG2-CD1 4.46Å; T371-L374 WeakPolarHBondContact O-CB 3.32Å; T371-L374 PolarHBondContact O-N 3.23Å; T371-L374 VanDerWaalsContact O-N 3.16Å; H372-L374 VanDerWaalsContact C-N 3.27Å; H372-L374 PolarHBondContact O-N 2.99Å; L374-A376 PolarHBondContact O-N 3.42Å; L374-A376 VanDerWaalsContact O-N 3.16Å; L374-A377 WeakPolarHBondContact O-CB 3.5Å; L374-A377 PolarHBondContact O-N 3.26Å; L374-L380 HydrophobicContact CD1-CD2 4.09Å; L374-L380 HydrophobicContact CD2-CD1 3.74Å; L374-L380 HydrophobicContact CD2-CD2 4.25Å; L374-M396 HydrophobicContact CD1-CB 3.91Å; L374-M396 HydrophobicContact CD1-CG 3.69Å; L374-Y400 HydrophobicContact CB-CE1 4.22Å; L374-Y400 WeakPolarHBondContact CB-OH 3.47Å; L374-Y400 WeakPolarHBondContact O-CE1 2.97Å
375	N	85	Confident	88.2	Confident	137 Å²	137	34.7 Å²	34.7	73%	0.733	20%	0.199	S	C	*	.	G	3₁₀ helix	trans	-62.6	-22.4	178.5	-70.6	-20.1	0	0	0	113.5	L373	L373-N375 PolarHBondContact O-N 3.11Å
376	A	87.1	Confident	87.4	Confident	54 Å²	54	34 Å²	34	45%	0.446	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-92.3	3.1	177.1	0	0	0	0	0	113.6	N303 L373 L374	N303-A376 WeakPolarHBondContact CB-O 3.02Å; N303-A376 PolarHBondContact ND2-O 3.07Å; L373-A376 PolarHBondContact O-N 3.06Å; L374-A376 PolarHBondContact O-N 3.42Å; L374-A376 VanDerWaalsContact O-N 3.16Å
377	A	89.8	Confident	86.7	Confident	8 Å²	8	35.1 Å²	35.1	7%	0.066	21%	0.207	C	C	.	.			trans	-80.4	138.2	-175.7	0	0	0	0	0	112	Y305 L374 Y400	Y305-A377 HydrophobicContact CD2-CB 3.41Å; Y305-A377 VanDerWaalsContact CD2-CB 3.41Å; Y305-A377 HydrophobicContact CE2-CB 3.77Å; Y305-A377 HydrophobicContact CG-CB 4.27Å; L374-A377 WeakPolarHBondContact O-CB 3.5Å; L374-A377 PolarHBondContact O-N 3.26Å; A377-Y400 HydrophobicContact CB-CD1 4.36Å; A377-Y400 HydrophobicContact CB-CG 4.4Å; A377-Y400 WeakPolarHBondContact O-CB 3.47Å
378	D	90.9	Very high	86.3	Confident	64 Å²	64	34.2 Å²	34.2	34%	0.342	20%	0.199	S	C	.	.	S	Bend	trans	-90.7	-36.8	166.7	-56.9	-39.2	0	0	0	110.8	Y301 V302 N303 L401	Y301-D378 HydrophobicContact CD1-CB 3.77Å; Y301-D378 HydrophobicContact CE1-CB 4.48Å; V302-D378 WeakPolarHBondContact CB-OD2 3.24Å; V302-D378 PolarHBondContact N-OD2 2.94Å; N303-D378 PolarHBondContact N-OD2 3.3Å; N303-D378 PolarHBondContact O-N 3.39Å; D378-L401 PolarHBondContact O-N 2.95Å
379	L	92.3	Very high	85.9	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	126.2	180	174	62.3	0	0	0	110.1	L266 A296 Y301 N303 I304 Y305 L381 L401 F403	L266-L379 HydrophobicContact CD2-CD2 4.01Å; A296-L379 HydrophobicContact CB-CD2 3.63Å; Y301-L379 HydrophobicContact CD1-CB 4.14Å; N303-L379 PolarHBondContact O-N 3.41Å; I304-L379 HydrophobicContact CG1-CB 4.44Å; I304-L379 HydrophobicContact CG1-CD2 4.47Å; I304-L379 HydrophobicContact CG2-CD2 4.11Å; I304-L379 HydrophobicContact CG2-CG 4.34Å; Y305-L379 PolarHBondContact N-O 2.81Å; L379-L381 HydrophobicContact CD1-CD1 4.48Å; L379-L381 HydrophobicContact CD2-CD1 3.87Å; L379-L381 HydrophobicContact CG-CD1 3.79Å; L379-L381 HydrophobicContact CG-CG 4.45Å; L379-L401 WeakPolarHBondContact CA-O 3.16Å; L379-L401 HydrophobicContact CD1-CB 4.01Å; L379-L401 HydrophobicContact CD1-CD2 3.9Å; L379-L401 HydrophobicContact CD1-CG 3.79Å; L379-F403 HydrophobicContact CD1-CD2 3.98Å; L379-F403 HydrophobicContact CD1-CE2 4.11Å; L379-F403 HydrophobicContact CD1-CG 4.23Å; L379-F403 HydrophobicContact CD1-CZ 4.47Å
380	L	93.4	Very high	85.5	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	125.1	172.3	178.1	61.3	0	0	0	110.6	Y305 L374 I382 M396 Y400 L401 V402 F403	Y305-L380 CarbonylContact O-C 3.6Å; Y305-L380 WeakPolarHBondContact O-CA 3.38Å; L374-L380 HydrophobicContact CD1-CD2 4.09Å; L374-L380 HydrophobicContact CD2-CD1 3.74Å; L374-L380 HydrophobicContact CD2-CD2 4.25Å; L380-I382 HydrophobicContact CD2-CD1 4.11Å; L380-I382 HydrophobicContact CD2-CG1 4.13Å; L380-I382 HydrophobicContact CG-CG1 4.03Å; L380-M396 HydrophobicContact CD2-CB 4.02Å; L380-M396 WeakPolarHBondContact CD2-O 3.34Å; L380-Y400 HydrophobicContact CB-CD2 3.92Å; L380-Y400 HydrophobicContact CB-CE2 3.68Å; L380-Y400 HydrophobicContact CD2-CE2 3.67Å; L380-Y400 HydrophobicContact CG-CE2 4.33Å; L380-L401 PolarHBondContact N-O 3.18Å; L380-V402 HydrophobicContact CB-CG2 4.42Å; L380-V402 CarbonylContact O-C 3.56Å; L380-V402 WeakPolarHBondContact O-CA 3.24Å; L380-F403 PolarHBondContact O-N 3.3Å
381	L	93.4	Very high	85.1	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	126.3	170.1	-61.2	99.7	0	0	0	110.5	L289 I293 I304 Y305 V306 T307 L379 F403	L289-L381 HydrophobicContact CB-CD2 4.35Å; L289-L381 HydrophobicContact CD2-CD2 4.25Å; I293-L381 HydrophobicContact CD1-CD1 3.93Å; I293-L381 HydrophobicContact CD1-CD2 3.88Å; I293-L381 HydrophobicContact CD1-CG 4.43Å; I293-L381 HydrophobicContact CG1-CD1 3.6Å; I293-L381 HydrophobicContact CG1-CD2 3.58Å; I293-L381 HydrophobicContact CG1-CG 4.23Å; I304-L381 HydrophobicContact CG2-CD1 3.56Å; Y305-L381 PolarHBondContact O-N 3.28Å; V306-L381 CarbonylContact C-O 3.55Å; V306-L381 WeakPolarHBondContact CA-O 3.49Å; V306-L381 HydrophobicContact CG2-CB 4.5Å; V306-L381 HydrophobicContact CG2-CD1 4.33Å; T307-L381 PolarHBondContact N-O 2.79Å; L379-L381 HydrophobicContact CD1-CD1 4.48Å; L379-L381 HydrophobicContact CD2-CD1 3.87Å; L379-L381 HydrophobicContact CG-CD1 3.79Å; L379-L381 HydrophobicContact CG-CG 4.45Å; L381-F403 CarbonylContact C-O 3.55Å; L381-F403 WeakPolarHBondContact CA-O 3.39Å; L381-F403 HydrophobicContact CD2-CB 4.21Å; L381-F403 HydrophobicContact CD2-CD2 4.07Å; L381-F403 HydrophobicContact CG-CB 4.2Å; L381-F403 HydrophobicContact CG-CD2 4.43Å
382	I	91.4	Very high	85.1	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	104.4	176.9	-51.1	179.5	0	0	0	108.3	L380 A385 I388 M396 V402 F403 M404 A405	L380-I382 HydrophobicContact CD2-CD1 4.11Å; L380-I382 HydrophobicContact CD2-CG1 4.13Å; L380-I382 HydrophobicContact CG-CG1 4.03Å; I382-A385 HydrophobicContact CB-CB 4.47Å; I382-A385 HydrophobicContact CG2-CB 3.75Å; I382-I388 HydrophobicContact CG2-CD1 3.77Å; I382-M396 HydrophobicContact CD1-CB 4.22Å; I382-M396 HydrophobicContact CD1-SD 4.06Å; I382-V402 HydrophobicContact CD1-CG1 4.22Å; I382-F403 PolarHBondContact N-O 2.91Å; I382-M404 HydrophobicContact CB-CG 4.38Å; I382-M404 HydrophobicContact CD1-CG 4.27Å; I382-A405 PolarHBondContact O-N 3.1Å
383	D	89.1	Confident	85.1	Confident	3 Å²	3	27.8 Å²	27.8	2%	0.016	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	138.4	172.3	-161.3	10.5	0	0	0	110.7	K285 S286 L289 T307 L314	K285-D383 WeakPolarHBondContact CE-OD1 3.49Å; K285-D383 IonicContact NZ-OD1 2.73Å; K285-D383 PolarHBondContact NZ-OD1 3.23Å; S286-D383 PolarHBondContact OG-OD2 2.8Å; L289-D383 HydrophobicContact CD1-CB 4.21Å; T307-D383 PolarHBondContact O-N 3.37Å; L314-D383 HydrophobicContact CD2-CB 4.1Å
384	E	83.4	Confident	84.9	Confident	22 Å²	22	28.3 Å²	28.3	10%	0.103	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	55	48.2	-171.4	-60.3	-61.4	165.2	0	0	113.8	K285 A386 A387 A405 T407	K285-E384 IonicContact NZ-OE1 3.13Å; K285-E384 PolarHBondContact NZ-OE1 2.88Å; K285-E384 IonicContact NZ-OE2 2.93Å; K285-E384 PolarHBondContact NZ-OE2 3.09Å; E384-A386 PolarHBondContact O-N 3.36Å; E384-A387 HydrophobicContact CB-CB 4.3Å; E384-A387 WeakPolarHBondContact O-CB 3.42Å; E384-A387 PolarHBondContact O-N 2.83Å; E384-A405 WeakPolarHBondContact CA-O 3.46Å; E384-A405 PolarHBondContact N-O 2.85Å; E384-T407 WeakPolarHBondContact OE1-CG2 3.46Å; E384-T407 WeakPolarHBondContact OE2-CB 3.37Å; E384-T407 WeakPolarHBondContact OE2-CG2 3.47Å; E384-T407 PolarHBondContact OE2-N 3.34Å; E384-T407 PolarHBondContact OE2-OG1 3.04Å
385	A	80.8	Confident	84.8	Confident	4 Å²	4	35.1 Å²	35.1	3%	0.033	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-55	-27.4	179.9	0	0	0	0	0	113.9	I382 A387 I388 M404 A405	I382-A385 HydrophobicContact CB-CB 4.47Å; I382-A385 HydrophobicContact CG2-CB 3.75Å; A385-A387 VanDerWaalsContact C-N 3.26Å; A385-A387 PolarHBondContact O-N 2.95Å; A385-I388 PolarHBondContact O-N 3.13Å; A385-M404 HydrophobicContact CB-CE 4.01Å; A385-A405 PolarHBondContact N-O 3.38Å
386	A	75.9	Confident	84.9	Confident	3 Å²	3	28.7 Å²	28.7	3%	0.025	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-74.7	-11.3	177.5	0	0	0	0	0	114.4	E384 S406 T414	E384-A386 PolarHBondContact O-N 3.36Å; A386-S406 VanDerWaalsContact CB-OG 3.24Å; A386-S406 WeakPolarHBondContact CB-OG 3.44Å; A386-T414 HydrophobicContact CB-CG2 4.49Å
387	A	76.7	Confident	84.8	Confident	30 Å²	30	28.2 Å²	28.2	25%	0.248	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-92.8	-10.8	173.4	0	0	0	0	0	112.5	P309 E384 A385	P309-A387 HydrophobicContact CG-CB 3.63Å; E384-A387 HydrophobicContact CB-CB 4.3Å; E384-A387 WeakPolarHBondContact O-CB 3.42Å; E384-A387 PolarHBondContact O-N 2.83Å; A385-A387 VanDerWaalsContact C-N 3.26Å; A385-A387 PolarHBondContact O-N 2.95Å
388	I	80.9	Confident	84.4	Confident	2 Å²	2	28.7 Å²	28.7	1%	0.01	16%	0.155	C	C	.	.	S	Bend	trans	-94.2	134.5	177.5	-57.4	177.1	0	0	0	109	T307 P309 P368 I382 A385 L390 L392 V393 M396 Y511	T307-I388 HydrophobicContact CG2-CD1 4.03Å; P309-I388 HydrophobicContact CG-CG1 3.97Å; P368-I388 HydrophobicContact CB-CD1 4.49Å; P368-I388 HydrophobicContact CB-CG2 4.22Å; P368-I388 HydrophobicContact CG-CD1 4.06Å; P368-I388 HydrophobicContact CG-CG1 4.42Å; I382-I388 HydrophobicContact CG2-CD1 3.77Å; A385-I388 PolarHBondContact O-N 3.13Å; I388-L390 PolarHBondContact O-N 3.07Å; I388-L392 HydrophobicContact CG2-CB 3.98Å; I388-V393 HydrophobicContact CB-CG2 3.73Å; I388-V393 HydrophobicContact CG2-CG2 3.63Å; I388-M396 HydrophobicContact CG2-CE 4.33Å; I388-Y511 PolarHBondContact O-OH 3.39Å
389	P	78.8	Confident	84.1	Confident	8 Å²	8	30.5 Å²	30.5	5%	0.052	17%	0.17	C	C	.	.			trans	-50.6	133.9	174.7	-28.5	33.6	0	0	0	113.4	P391 L392 V393 Y511 L715 A717	P389-P391 VanDerWaalsContact C-CD 3.42Å; P389-P391 VanDerWaalsContact C-N 3.35Å; P389-L392 HydrophobicContact CB-CB 4.47Å; P389-L392 HydrophobicContact CB-CD1 4.2Å; P389-L392 HydrophobicContact CB-CG 4.33Å; P389-L392 HydrophobicContact CG-CD1 3.99Å; P389-L392 WeakPolarHBondContact O-CB 3.45Å; P389-L392 PolarHBondContact O-N 3.18Å; P389-V393 PolarHBondContact O-N 2.87Å; P389-Y511 WeakPolarHBondContact CA-OH 3.5Å; P389-L715 WeakPolarHBondContact CG-O 3.09Å; P389-A717 HydrophobicContact CB-CB 4.08Å; P389-A717 HydrophobicContact CG-CB 3.88Å
390	L	78.2	Confident	83.9	Confident	41 Å²	41	31.1 Å²	31.1	22%	0.215	17%	0.172	C	C	.	.	H	α-helix	trans	-51.9	-43	179.7	-177	62.6	0	0	0	114.2	I388 L392 V393 K394 L418 L422	I388-L390 PolarHBondContact O-N 3.07Å; L390-L392 VanDerWaalsContact C-N 3.26Å; L390-L392 PolarHBondContact O-N 3.08Å; L390-V393 PolarHBondContact O-N 3.38Å; L390-K394 HydrophobicContact CD1-CG 4.26Å; L390-K394 HydrophobicContact CG-CD 4.39Å; L390-K394 HydrophobicContact CG-CG 4.46Å; L390-K394 WeakPolarHBondContact O-CG 3.45Å; L390-K394 PolarHBondContact O-N 3.46Å; L390-L418 HydrophobicContact CB-CD1 3.65Å; L390-L418 HydrophobicContact CB-CD2 4.33Å; L390-L418 HydrophobicContact CD1-CD1 4Å; L390-L418 HydrophobicContact CD1-CG 4.48Å; L390-L418 HydrophobicContact CD2-CD1 3.87Å; L390-L418 HydrophobicContact CG-CD1 4.01Å; L390-L422 HydrophobicContact CD1-CB 4.23Å; L390-L422 HydrophobicContact CD1-CD1 3.7Å; L390-L422 HydrophobicContact CD1-CD2 4.3Å; L390-L422 HydrophobicContact CD1-CG 4.29Å
391	P	78.4	Confident	83.7	Confident	80 Å²	80	31.4 Å²	31.4	52%	0.519	17%	0.174	S	C	.	.	H	α-helix	trans	-61.6	-36	178.5	-23.3	35.5	0	0	0	112.5	P389 K395	P389-P391 VanDerWaalsContact C-CD 3.42Å; P389-P391 VanDerWaalsContact C-N 3.35Å; P391-K395 WeakPolarHBondContact O-CG 3.04Å; P391-K395 PolarHBondContact O-N 3.46Å; P391-K395 VanDerWaalsContact O-N 3.11Å
392	L	83.6	Confident	83.5	Confident	43 Å²	43	31.5 Å²	31.5	23%	0.225	18%	0.175	C	C	.	.	H	α-helix	trans	-69.5	-46	175.8	-69	176.8	0	0	0	110.7	I388 P389 L390 K394 K395 M396	I388-L392 HydrophobicContact CG2-CB 3.98Å; P389-L392 HydrophobicContact CB-CB 4.47Å; P389-L392 HydrophobicContact CB-CD1 4.2Å; P389-L392 HydrophobicContact CB-CG 4.33Å; P389-L392 HydrophobicContact CG-CD1 3.99Å; P389-L392 WeakPolarHBondContact O-CB 3.45Å; P389-L392 PolarHBondContact O-N 3.18Å; L390-L392 VanDerWaalsContact C-N 3.26Å; L390-L392 PolarHBondContact O-N 3.08Å; L392-K394 VanDerWaalsContact C-N 3.28Å; L392-K394 PolarHBondContact O-N 3Å; L392-K395 WeakPolarHBondContact O-CB 3.15Å; L392-K395 PolarHBondContact O-N 3.22Å; L392-K395 VanDerWaalsContact O-N 3.08Å; L392-M396 HydrophobicContact CB-CE 4.38Å; L392-M396 VanDerWaalsContact O-CG 3.29Å; L392-M396 WeakPolarHBondContact O-CG 3.48Å; L392-M396 PolarHBondContact O-N 3.29Å
393	V	84.8	Confident	83.5	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58.7	-41.3	176.7	-179.5	0	0	0	0	111.2	I388 P389 L390 K395 M396 I397 M404 L422	I388-V393 HydrophobicContact CB-CG2 3.73Å; I388-V393 HydrophobicContact CG2-CG2 3.63Å; P389-V393 PolarHBondContact O-N 2.87Å; L390-V393 PolarHBondContact O-N 3.38Å; V393-K395 PolarHBondContact O-N 3.46Å; V393-M396 WeakPolarHBondContact O-CB 3.12Å; V393-M396 PolarHBondContact O-N 2.86Å; V393-M396 VanDerWaalsContact O-N 3.14Å; V393-I397 HydrophobicContact CG1-CD1 4.35Å; V393-I397 WeakPolarHBondContact O-CG1 3.48Å; V393-I397 PolarHBondContact O-N 3.26Å; V393-M404 HydrophobicContact CG1-CE 4.22Å; V393-L422 HydrophobicContact CG1-CD2 3.94Å
394	K	82.1	Confident	83.5	Confident	92 Å²	92	31.9 Å²	31.9	40%	0.4	18%	0.176	S	C	.	.	H	α-helix	trans	-63.3	-39.8	175.5	-74.7	-174	176.9	-171.8	0	112.8	L390 L392 M396 I397 Q425	L390-K394 HydrophobicContact CD1-CG 4.26Å; L390-K394 HydrophobicContact CG-CD 4.39Å; L390-K394 HydrophobicContact CG-CG 4.46Å; L390-K394 WeakPolarHBondContact O-CG 3.45Å; L390-K394 PolarHBondContact O-N 3.46Å; L392-K394 VanDerWaalsContact C-N 3.28Å; L392-K394 PolarHBondContact O-N 3Å; K394-M396 PolarHBondContact O-N 3.42Å; K394-I397 PolarHBondContact O-N 3.1Å; K394-Q425 VanDerWaalsContact NZ-CD 3.3Å; K394-Q425 VanDerWaalsContact NZ-NE2 3.13Å
395	K	84.2	Confident	83.8	Confident	146 Å²	146	30.8 Å²	30.8	64%	0.635	17%	0.171	S	C	*	.	H	α-helix	trans	-65.5	-26.5	174.4	-73.3	178.1	-178.9	-176.3	0	112.6	T371 P391 L392 V393	T371-K395 HydrophobicContact CG2-CB 3.99Å; P391-K395 WeakPolarHBondContact O-CG 3.04Å; P391-K395 PolarHBondContact O-N 3.46Å; P391-K395 VanDerWaalsContact O-N 3.11Å; L392-K395 WeakPolarHBondContact O-CB 3.15Å; L392-K395 PolarHBondContact O-N 3.22Å; L392-K395 VanDerWaalsContact O-N 3.08Å; V393-K395 PolarHBondContact O-N 3.46Å
396	M	87.4	Confident	83.9	Confident	1 Å²	1	31 Å²	31	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-82.6	-14.6	177.1	-65.5	173.3	-172.3	0	0	114.5	T307 P368 T371 L374 L380 I382 I388 L392 V393 K394 G398 Y400	T307-M396 HydrophobicContact CG2-CE 4.03Å; T307-M396 HydrophobicContact CG2-SD 4.2Å; P368-M396 HydrophobicContact CB-CE 3.52Å; P368-M396 HydrophobicContact CG-CE 4.45Å; P368-M396 WeakPolarHBondContact O-CE 3.36Å; T371-M396 HydrophobicContact CG2-CG 4.05Å; L374-M396 HydrophobicContact CD1-CB 3.91Å; L374-M396 HydrophobicContact CD1-CG 3.69Å; L380-M396 HydrophobicContact CD2-CB 4.02Å; L380-M396 WeakPolarHBondContact CD2-O 3.34Å; I382-M396 HydrophobicContact CD1-CB 4.22Å; I382-M396 HydrophobicContact CD1-SD 4.06Å; I388-M396 HydrophobicContact CG2-CE 4.33Å; L392-M396 HydrophobicContact CB-CE 4.38Å; L392-M396 VanDerWaalsContact O-CG 3.29Å; L392-M396 WeakPolarHBondContact O-CG 3.48Å; L392-M396 PolarHBondContact O-N 3.29Å; V393-M396 WeakPolarHBondContact O-CB 3.12Å; V393-M396 PolarHBondContact O-N 2.86Å; V393-M396 VanDerWaalsContact O-N 3.14Å; K394-M396 PolarHBondContact O-N 3.42Å; M396-G398 PolarHBondContact O-N 2.89Å; M396-Y400 WeakPolarHBondContact O-CE2 3.41Å; M396-Y400 PolarHBondContact O-OH 2.71Å
397	I	85.8	Confident	84.1	Confident	45 Å²	45	31.3 Å²	31.3	23%	0.231	17%	0.174	C	C	.	.			trans	-84.6	99.6	178.3	-65.3	167.7	0	0	0	107.6	V393 K394 M404 L426	V393-I397 HydrophobicContact CG1-CD1 4.35Å; V393-I397 WeakPolarHBondContact O-CG1 3.48Å; V393-I397 PolarHBondContact O-N 3.26Å; K394-I397 PolarHBondContact O-N 3.1Å; I397-M404 HydrophobicContact CD1-SD 4.43Å; I397-L426 HydrophobicContact CD1-CD1 4.47Å; I397-L426 HydrophobicContact CD1-CD2 4.02Å
398	G	81.7	Confident	83.9	Confident	18 Å²	18	31.4 Å²	31.4	19%	0.186	17%	0.17	C	C	.	.			trans	-113.5	-167	-176.2	0	0	0	0	0	114	M396 Y400	M396-G398 PolarHBondContact O-N 2.89Å; G398-Y400 PolarHBondContact O-N 2.83Å; G398-Y400 VanDerWaalsContact O-N 3.1Å
399	P	83.6	Confident	83.2	Confident	102 Å²	102	33.7 Å²	33.7	66%	0.662	18%	0.182	S	C	*	.	S	Bend	trans	-82.5	43.3	178.1	36.5	-36.2	0	0	0	112.8
400	Y	87.6	Confident	82.5	Confident	12 Å²	12	34 Å²	34	5%	0.047	19%	0.187	C	C	.	.	S	Bend	trans	-136.7	167.5	178.9	42.3	-106	0	0	0	109.9	L374 A377 L380 M396 G398 V402	L374-Y400 HydrophobicContact CB-CE1 4.22Å; L374-Y400 WeakPolarHBondContact CB-OH 3.47Å; L374-Y400 WeakPolarHBondContact O-CE1 2.97Å; A377-Y400 HydrophobicContact CB-CD1 4.36Å; A377-Y400 HydrophobicContact CB-CG 4.4Å; A377-Y400 WeakPolarHBondContact O-CB 3.47Å; L380-Y400 HydrophobicContact CB-CD2 3.92Å; L380-Y400 HydrophobicContact CB-CE2 3.68Å; L380-Y400 HydrophobicContact CD2-CE2 3.67Å; L380-Y400 HydrophobicContact CG-CE2 4.33Å; M396-Y400 WeakPolarHBondContact O-CE2 3.41Å; M396-Y400 PolarHBondContact O-OH 2.71Å; G398-Y400 PolarHBondContact O-N 2.83Å; G398-Y400 VanDerWaalsContact O-N 3.1Å; Y400-V402 HydrophobicContact CD2-CG2 3.65Å; Y400-V402 HydrophobicContact CE2-CG2 3.67Å; Y400-V402 PolarHBondContact O-N 3.47Å
401	L	89.4	Confident	82.1	Confident	7 Å²	7	32.3 Å²	32.3	4%	0.037	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	131.4	179.1	-174.6	61.8	0	0	0	109.7	L266 Q270 D378 L379 L380 F403	L266-L401 HydrophobicContact CD2-CD2 3.69Å; Q270-L401 VanDerWaalsContact O-CD1 3.32Å; Q270-L401 WeakPolarHBondContact O-CD1 3.29Å; D378-L401 PolarHBondContact O-N 2.95Å; L379-L401 WeakPolarHBondContact CA-O 3.16Å; L379-L401 HydrophobicContact CD1-CB 4.01Å; L379-L401 HydrophobicContact CD1-CD2 3.9Å; L379-L401 HydrophobicContact CD1-CG 3.79Å; L380-L401 PolarHBondContact N-O 3.18Å; L401-F403 HydrophobicContact CD1-CE1 4.02Å; L401-F403 HydrophobicContact CD2-CE1 3.99Å; L401-F403 HydrophobicContact CD2-CZ 3.89Å; L401-F403 HydrophobicContact CG-CD1 4.46Å; L401-F403 HydrophobicContact CG-CE1 3.95Å; L401-F403 HydrophobicContact CG-CZ 4.33Å
402	V	90.3	Very high	81.3	Confident	3 Å²	3	30.9 Å²	30.9	2%	0.018	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	123	-178.8	-172.7	0	0	0	0	110.7	P274 M275 L380 I382 Y400 M404	P274-V402 HydrophobicContact CB-CB 4.06Å; M275-V402 PolarHBondContact N-O 3.45Å; M275-V402 VanDerWaalsContact N-O 3.09Å; L380-V402 HydrophobicContact CB-CG2 4.42Å; L380-V402 CarbonylContact O-C 3.56Å; L380-V402 WeakPolarHBondContact O-CA 3.24Å; I382-V402 HydrophobicContact CD1-CG1 4.22Å; Y400-V402 HydrophobicContact CD2-CG2 3.65Å; Y400-V402 HydrophobicContact CE2-CG2 3.67Å; Y400-V402 PolarHBondContact O-N 3.47Å; V402-M404 HydrophobicContact CG1-CG 3.89Å
403	F	91.7	Very high	80	Confident	1 Å²	1	29.1 Å²	29.1	0%	0.004	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	126	168.6	-64.9	-17.4	0	0	0	110	F262 A265 L266 M275 L379 L380 L381 I382 L401	F262-F403 HydrophobicContact CB-CE2 4.23Å; F262-F403 HydrophobicContact CB-CZ 4.4Å; F262-F403 AromaticContact CD1-CD1 3.83Å; F262-F403 HydrophobicContact CD1-CD1 3.83Å; F262-F403 AromaticContact CD1-CD2 3.65Å; F262-F403 HydrophobicContact CD1-CD2 3.65Å; F262-F403 AromaticContact CD1-CE1 3.79Å; F262-F403 HydrophobicContact CD1-CE1 3.79Å; F262-F403 AromaticContact CD1-CE2 3.61Å; F262-F403 HydrophobicContact CD1-CE2 3.61Å; F262-F403 AromaticContact CD1-CG 3.76Å; F262-F403 HydrophobicContact CD1-CG 3.76Å; F262-F403 AromaticContact CD1-CZ 3.68Å; F262-F403 HydrophobicContact CD1-CZ 3.68Å; F262-F403 HydrophobicContact CE1-CB 4.02Å; F262-F403 AromaticContact CE1-CD1 3.84Å; F262-F403 HydrophobicContact CE1-CD1 3.84Å; F262-F403 AromaticContact CE1-CD2 3.96Å; F262-F403 HydrophobicContact CE1-CD2 3.96Å; F262-F403 HydrophobicContact CE1-CE1 4.25Å; F262-F403 HydrophobicContact CE1-CE2 4.36Å; F262-F403 AromaticContact CE1-CG 3.67Å; F262-F403 HydrophobicContact CE1-CG 3.67Å; F262-F403 HydrophobicContact CE1-CZ 4.5Å; F262-F403 HydrophobicContact CG-CD2 4.46Å; F262-F403 HydrophobicContact CG-CE2 4.25Å; F262-F403 HydrophobicContact CG-CZ 4.5Å; A265-F403 HydrophobicContact CB-CE1 4.27Å; A265-F403 HydrophobicContact CB-CZ 4.33Å; L266-F403 HydrophobicContact CD1-CE2 4.37Å; L266-F403 HydrophobicContact CD2-CE2 4.01Å; L266-F403 HydrophobicContact CD2-CZ 3.98Å; L266-F403 HydrophobicContact CG-CE2 4.09Å; L266-F403 HydrophobicContact CG-CZ 3.95Å; M275-F403 HydrophobicContact CB-CD1 3.86Å; M275-F403 HydrophobicContact CB-CE1 4.09Å; M275-F403 WeakPolarHBondContact O-CA 3.46Å; L379-F403 HydrophobicContact CD1-CD2 3.98Å; L379-F403 HydrophobicContact CD1-CE2 4.11Å; L379-F403 HydrophobicContact CD1-CG 4.23Å; L379-F403 HydrophobicContact CD1-CZ 4.47Å; L380-F403 PolarHBondContact O-N 3.3Å; L381-F403 CarbonylContact C-O 3.55Å; L381-F403 WeakPolarHBondContact CA-O 3.39Å; L381-F403 HydrophobicContact CD2-CB 4.21Å; L381-F403 HydrophobicContact CD2-CD2 4.07Å; L381-F403 HydrophobicContact CG-CB 4.2Å; L381-F403 HydrophobicContact CG-CD2 4.43Å; I382-F403 PolarHBondContact N-O 2.91Å; L401-F403 HydrophobicContact CD1-CE1 4.02Å; L401-F403 HydrophobicContact CD2-CE1 3.99Å; L401-F403 HydrophobicContact CD2-CZ 3.89Å; L401-F403 HydrophobicContact CG-CD1 4.46Å; L401-F403 HydrophobicContact CG-CE1 3.95Å; L401-F403 HydrophobicContact CG-CZ 4.33Å
404	M	88.7	Confident	78.5	Confident	9 Å²	9	29.9 Å²	29.9	4%	0.044	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	135.9	-178.9	-65.7	175.1	49	0	0	110.5	M275 S276 L277 I382 A385 V393 I397 V402 L422 L426	M275-M404 PolarHBondContact O-N 2.94Å; S276-M404 CarbonylContact C-O 3.55Å; S276-M404 WeakPolarHBondContact CA-O 3.11Å; L277-M404 PolarHBondContact N-O 3Å; I382-M404 HydrophobicContact CB-CG 4.38Å; I382-M404 HydrophobicContact CD1-CG 4.27Å; A385-M404 HydrophobicContact CB-CE 4.01Å; V393-M404 HydrophobicContact CG1-CE 4.22Å; I397-M404 HydrophobicContact CD1-SD 4.43Å; V402-M404 HydrophobicContact CG1-CG 3.89Å; M404-L422 HydrophobicContact CE-CD2 3.51Å; M404-L422 HydrophobicContact CE-CG 4.34Å; M404-L426 HydrophobicContact SD-CD1 4.33Å
405	A	88.3	Confident	77.2	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	130.7	177.5	0	0	0	0	0	110.5	L277 K285 L289 I382 E384 A385	L277-A405 HydrophobicContact CB-CB 4.46Å; L277-A405 CarbonylContact O-C 3.59Å; L277-A405 WeakPolarHBondContact O-CA 3.1Å; K285-A405 HydrophobicContact CD-CB 3.64Å; K285-A405 HydrophobicContact CG-CB 3.78Å; L289-A405 HydrophobicContact CD1-CB 3.27Å; L289-A405 HydrophobicContact CD2-CB 4.09Å; L289-A405 HydrophobicContact CG-CB 4.07Å; I382-A405 PolarHBondContact O-N 3.1Å; E384-A405 WeakPolarHBondContact CA-O 3.46Å; E384-A405 PolarHBondContact N-O 2.85Å; A385-A405 PolarHBondContact N-O 3.38Å
406	S	84.1	Confident	76	Confident	9 Å²	9	20.2 Å²	20.2	6%	0.063	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	133	-174.2	-178.2	0	0	0	0	110.9	L277 T278 A279 A386	L277-S406 PolarHBondContact O-N 3.42Å; T278-S406 WeakPolarHBondContact CA-O 3.41Å; A279-S406 PolarHBondContact N-O 2.98Å; A279-S406 VanDerWaalsContact N-O 3.16Å; A386-S406 VanDerWaalsContact CB-OG 3.24Å; A386-S406 WeakPolarHBondContact CB-OG 3.44Å
407	T	80.6	Confident	74.4	Confident	8 Å²	8	20.7 Å²	20.7	5%	0.049	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	126.3	170.7	47	0	0	0	0	111.7	A279 E384 T414	A279-T407 CarbonylContact O-C 3.59Å; A279-T407 VanDerWaalsContact O-CA 3.24Å; A279-T407 WeakPolarHBondContact O-CA 3.2Å; E384-T407 WeakPolarHBondContact OE1-CG2 3.46Å; E384-T407 WeakPolarHBondContact OE2-CB 3.37Å; E384-T407 WeakPolarHBondContact OE2-CG2 3.47Å; E384-T407 PolarHBondContact OE2-N 3.34Å; E384-T407 PolarHBondContact OE2-OG1 3.04Å; T407-T414 WeakPolarHBondContact O-CB 3.49Å; T407-T414 PolarHBondContact O-OG1 3.15Å; T407-T414 WeakPolarHBondContact OG1-CG2 3.44Å
408	I	72.5	Confident	73.1	Confident	32 Å²	32	19.1 Å²	19.1	16%	0.164	11%	0.114	C	C	.	.			trans	-101.2	157.1	168.6	58.8	168.6	0	0	0	109.4	T278 A279 A280 G410	T278-I408 HydrophobicContact CG2-CG2 4.47Å; A279-I408 VanDerWaalsContact C-CG1 3.4Å; A279-I408 WeakPolarHBondContact O-CG1 3.25Å; A279-I408 PolarHBondContact O-N 3.33Å; A280-I408 VanDerWaalsContact CA-O 3.31Å; A280-I408 WeakPolarHBondContact CA-O 3.3Å; I408-G410 PolarHBondContact O-N 2.8Å
409	N	66.6	Low	72.1	Confident	51 Å²	51	18.6 Å²	18.6	27%	0.273	11%	0.107	S	C	.	.	S	Bend	trans	55.7	21.8	175.8	-57.1	-10.4	0	0	0	115.8	R416 L460	N409-R416 PolarHBondContact OD1-NH1 3.21Å; N409-L460 PolarHBondContact OD1-O 3.05Å
410	G	63.8	Low	71.1	Confident	14 Å²	14	18.4 Å²	18.4	14%	0.144	10%	0.1	C	C	.	.			trans	-93	147.1	-176.8	0	0	0	0	0	114	I408 E412	I408-G410 PolarHBondContact O-N 2.8Å; G410-E412 VanDerWaalsContact C-N 3.29Å; G410-E412 PolarHBondContact O-N 2.71Å
411	Y	68.8	Low	70.2	Confident	5 Å²	5	22.6 Å²	22.6	2%	0.02	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-7.9	177.5	52	-104.1	0	0	0	114.9	L111 N129 A132 R133 E136 R281 G413 P515	L111-Y411 HydrophobicContact CD2-CE2 4.43Å; L111-Y411 WeakPolarHBondContact CD2-OH 2.81Å; N129-Y411 VanDerWaalsContact OD1-CD2 3.27Å; N129-Y411 WeakPolarHBondContact OD1-CD2 3.46Å; N129-Y411 PolarHBondContact OD1-O 3Å; A132-Y411 HydrophobicContact CB-CD1 3.31Å; A132-Y411 HydrophobicContact CB-CE1 3.92Å; A132-Y411 HydrophobicContact CB-CG 3.63Å; A132-Y411 WeakPolarHBondContact O-CE1 3.38Å; R133-Y411 HydrophobicContact CB-CE2 4.19Å; R133-Y411 HydrophobicContact CG-CD2 3.75Å; R133-Y411 HydrophobicContact CG-CE2 3.12Å; E136-Y411 HydrophobicContact CB-CE1 4.45Å; E136-Y411 WeakPolarHBondContact OE2-CE1 3.07Å; E136-Y411 PolarHBondContact OE2-OH 2.96Å; R281-Y411 VanDerWaalsContact CD-OH 3.26Å; R281-Y411 WeakPolarHBondContact CD-OH 3.27Å; R281-Y411 PolarHBondContact NE-OH 2.92Å; R281-Y411 PolarHBondContact NH1-OH 2.77Å; Y411-G413 PolarHBondContact O-N 3.19Å; Y411-P515 VanDerWaalsContact O-CD 3.28Å; Y411-P515 WeakPolarHBondContact O-CD 3.47Å
412	E	62.6	Low	69.3	Low	50 Å²	50	22.6 Å²	22.6	23%	0.234	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	1.3	177.3	-76.6	-174.5	166.2	0	0	114.1	L111 R281 G410 K512	L111-E412 WeakPolarHBondContact CD1-OE1 3.21Å; R281-E412 IonicContact CZ-OE1 2.64Å; R281-E412 IonicContact CZ-OE2 3.17Å; R281-E412 VanDerWaalsContact NH1-CG 3.32Å; R281-E412 IonicContact NH1-OE1 2.86Å; R281-E412 PolarHBondContact NH1-OE1 2.99Å; R281-E412 IonicContact NH1-OE2 2.97Å; R281-E412 IonicContact NH2-OE1 3.78Å; R281-E412 PolarHBondContact NH2-OE1 3Å; R281-E412 IonicContact NH2-OE2 3.89Å; G410-E412 VanDerWaalsContact C-N 3.29Å; G410-E412 PolarHBondContact O-N 2.71Å; E412-K512 WeakPolarHBondContact O-CE 3.28Å; E412-K512 PolarHBondContact O-NZ 3.41Å
413	G	54.7	Low	68.4	Low	6 Å²	6	23.3 Å²	23.3	6%	0.062	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.2	56.1	178.9	0	0	0	0	0	112.7	Y411 K512 N513	Y411-G413 PolarHBondContact O-N 3.19Å; G413-K512 WeakPolarHBondContact O-CB 3.14Å; G413-K512 VanDerWaalsContact O-CD 3.28Å; G413-K512 WeakPolarHBondContact O-CD 3.41Å; G413-K512 WeakPolarHBondContact O-CG 3.28Å; G413-N513 WeakPolarHBondContact CA-O 3.46Å
414	T	55.1	Low	67.4	Low	17 Å²	17	25.4 Å²	25.4	10%	0.104	14%	0.137	C	C	.	.			trans	-79.8	134.3	170.3	52.7	0	0	0	0	110.9	A386 T407 R416	A386-T414 HydrophobicContact CB-CG2 4.49Å; T407-T414 WeakPolarHBondContact O-CB 3.49Å; T407-T414 PolarHBondContact O-OG1 3.15Å; T407-T414 WeakPolarHBondContact OG1-CG2 3.44Å; T414-R416 VanDerWaalsContact C-N 3.25Å; T414-R416 PolarHBondContact O-N 3.06Å
415	G	54.3	Low	66.7	Low	1 Å²	1	28.2 Å²	28.2	1%	0.01	15%	0.15	C	C	.	.			trans	-69.5	78.7	177.1	0	0	0	0	0	111.7	S417 L418 S419 Y511	G415-S417 PolarHBondContact O-N 3.49Å; G415-L418 CarbonylContact O-C 3.59Å; G415-L418 VanDerWaalsContact O-CA 3.29Å; G415-L418 WeakPolarHBondContact O-CA 3.43Å; G415-L418 WeakPolarHBondContact O-CB 3.48Å; G415-L418 PolarHBondContact O-N 3.48Å; G415-S419 PolarHBondContact O-N 3.5Å; G415-Y511 WeakPolarHBondContact CA-O 3.04Å; G415-Y511 PolarHBondContact N-O 3.48Å; G415-Y511 VanDerWaalsContact N-O 3.16Å
416	R	58.6	Low	66	Low	33 Å²	33	29 Å²	29	13%	0.125	15%	0.154	C	C	.	.	H	α-helix	trans	-51.9	-37.1	171.1	179.3	-170.8	-179.1	112.6	23.8	112.1	N409 T414 L418 S419 L420 S463 V507	N409-R416 PolarHBondContact OD1-NH1 3.21Å; T414-R416 VanDerWaalsContact C-N 3.25Å; T414-R416 PolarHBondContact O-N 3.06Å; R416-L418 PolarHBondContact O-N 2.94Å; R416-S419 PolarHBondContact O-N 3.41Å; R416-S419 PolarHBondContact O-OG 3.03Å; R416-S419 VanDerWaalsContact O-OG 3.05Å; R416-L420 HydrophobicContact CG-CD1 4.13Å; R416-L420 WeakPolarHBondContact O-CB 3.3Å; R416-L420 WeakPolarHBondContact O-CG 2.92Å; R416-L420 PolarHBondContact O-N 3.33Å; R416-S463 VanDerWaalsContact CZ-CB 3.4Å; R416-S463 VanDerWaalsContact NH2-C 3.32Å; R416-S463 PolarHBondContact NH2-O 3.38Å; R416-V507 HydrophobicContact CB-CG1 4.31Å
417	S	54.3	Low	65.5	Low	11 Å²	11	32 Å²	32	8%	0.077	17%	0.167	C	C	.	.	H	α-helix	trans	-57.9	-35.2	173.2	64	0	0	0	0	111.8	G415 K421 S508 H510	G415-S417 PolarHBondContact O-N 3.49Å; S417-K421 WeakPolarHBondContact O-CB 3.47Å; S417-K421 WeakPolarHBondContact O-CD 3.43Å; S417-K421 WeakPolarHBondContact O-CG 2.98Å; S417-K421 PolarHBondContact O-N 3.34Å; S417-S508 WeakPolarHBondContact CB-O 3.38Å; S417-H510 PolarHBondContact OG-O 3.33Å
418	L	57.1	Low	65.2	Low	12 Å²	12	39.8 Å²	39.8	6%	0.063	20%	0.2	C	C	.	.	H	α-helix	trans	-75.8	-45.5	175.9	-165.8	77.6	0	0	0	112.4	L390 G415 R416 L420 K421 L422 Y511	L390-L418 HydrophobicContact CB-CD1 3.65Å; L390-L418 HydrophobicContact CB-CD2 4.33Å; L390-L418 HydrophobicContact CD1-CD1 4Å; L390-L418 HydrophobicContact CD1-CG 4.48Å; L390-L418 HydrophobicContact CD2-CD1 3.87Å; L390-L418 HydrophobicContact CG-CD1 4.01Å; G415-L418 CarbonylContact O-C 3.59Å; G415-L418 VanDerWaalsContact O-CA 3.29Å; G415-L418 WeakPolarHBondContact O-CA 3.43Å; G415-L418 WeakPolarHBondContact O-CB 3.48Å; G415-L418 PolarHBondContact O-N 3.48Å; R416-L418 PolarHBondContact O-N 2.94Å; L418-L420 VanDerWaalsContact C-N 3.26Å; L418-L420 PolarHBondContact O-N 2.84Å; L418-K421 PolarHBondContact O-N 3.33Å; L418-L422 WeakPolarHBondContact O-CA 3.45Å; L418-L422 WeakPolarHBondContact O-CB 3.37Å; L418-L422 PolarHBondContact O-N 3.45Å; L418-Y511 HydrophobicContact CD1-CE2 4.43Å; L418-Y511 HydrophobicContact CD2-CE2 3.85Å
419	S	61.1	Low	65.1	Low	8 Å²	8	43.2 Å²	43.2	6%	0.056	22%	0.219	C	C	.	.	H	α-helix	trans	-59.6	-43.1	176.6	62.9	0	0	0	0	110.3	G415 R416 I423	G415-S419 PolarHBondContact O-N 3.5Å; R416-S419 PolarHBondContact O-N 3.41Å; R416-S419 PolarHBondContact O-OG 3.03Å; R416-S419 VanDerWaalsContact O-OG 3.05Å; S419-I423 WeakPolarHBondContact O-CB 3.11Å; S419-I423 VanDerWaalsContact O-CD1 3.27Å; S419-I423 WeakPolarHBondContact O-CD1 3.27Å; S419-I423 WeakPolarHBondContact O-CG1 3.44Å; S419-I423 PolarHBondContact O-N 3.04Å
420	L	62.4	Low	65	Low	98 Å²	98	44 Å²	44	51%	0.513	22%	0.223	S	C	.	.	H	α-helix	trans	-65.9	-44.5	174.8	-69.1	174	0	0	0	112.9	R416 L418 S424	R416-L420 HydrophobicContact CG-CD1 4.13Å; R416-L420 WeakPolarHBondContact O-CB 3.3Å; R416-L420 WeakPolarHBondContact O-CG 2.92Å; R416-L420 PolarHBondContact O-N 3.33Å; L418-L420 VanDerWaalsContact C-N 3.26Å; L418-L420 PolarHBondContact O-N 2.84Å; L420-S424 WeakPolarHBondContact O-CA 3.26Å; L420-S424 WeakPolarHBondContact O-CB 3.27Å; L420-S424 PolarHBondContact O-N 3.22Å
421	K	69.2	Low	65.3	Low	100 Å²	100	50.5 Å²	50.5	44%	0.435	26%	0.255	S	S	.	.	H	α-helix	trans	-68.3	-41.3	178.6	-78.1	173.8	-179.1	-175.4	0	112.5	S417 L418 Q425	S417-K421 WeakPolarHBondContact O-CB 3.47Å; S417-K421 WeakPolarHBondContact O-CD 3.43Å; S417-K421 WeakPolarHBondContact O-CG 2.98Å; S417-K421 PolarHBondContact O-N 3.34Å; L418-K421 PolarHBondContact O-N 3.33Å; K421-Q425 WeakPolarHBondContact O-CB 3.2Å; K421-Q425 PolarHBondContact O-N 3.29Å
422	L	71.1	Confident	65.4	Low	7 Å²	7	51 Å²	51	4%	0.037	26%	0.259	C	S	.	.	H	α-helix	trans	-68.7	-47.9	178.5	176.3	59.5	0	0	0	110.5	L390 V393 M404 L418 Q425 L426	L390-L422 HydrophobicContact CD1-CB 4.23Å; L390-L422 HydrophobicContact CD1-CD1 3.7Å; L390-L422 HydrophobicContact CD1-CD2 4.3Å; L390-L422 HydrophobicContact CD1-CG 4.29Å; V393-L422 HydrophobicContact CG1-CD2 3.94Å; M404-L422 HydrophobicContact CE-CD2 3.51Å; M404-L422 HydrophobicContact CE-CG 4.34Å; L418-L422 WeakPolarHBondContact O-CA 3.45Å; L418-L422 WeakPolarHBondContact O-CB 3.37Å; L418-L422 PolarHBondContact O-N 3.45Å; L422-Q425 PolarHBondContact O-N 3.43Å; L422-L426 HydrophobicContact CD1-CD1 3.91Å; L422-L426 HydrophobicContact CD1-CG 4.04Å; L422-L426 HydrophobicContact CG-CD1 3.95Å; L422-L426 HydrophobicContact CG-CG 4.47Å; L422-L426 WeakPolarHBondContact O-CB 3.17Å; L422-L426 VanDerWaalsContact O-CG 3.24Å; L422-L426 WeakPolarHBondContact O-CG 3.28Å; L422-L426 PolarHBondContact O-N 2.82Å
423	I	71.6	Confident	65.9	Low	18 Å²	18	54.3 Å²	54.3	9%	0.092	27%	0.27	C	S	.	.	H	α-helix	trans	-63.8	-44.7	176.3	-66.7	165.3	0	0	0	109.6	T278 S419 Q425 L426 Q427 P435	T278-I423 HydrophobicContact CG2-CD1 3.83Å; S419-I423 WeakPolarHBondContact O-CB 3.11Å; S419-I423 VanDerWaalsContact O-CD1 3.27Å; S419-I423 WeakPolarHBondContact O-CD1 3.27Å; S419-I423 WeakPolarHBondContact O-CG1 3.44Å; S419-I423 PolarHBondContact O-N 3.04Å; I423-Q425 VanDerWaalsContact C-N 3.29Å; I423-Q425 PolarHBondContact O-N 3.39Å; I423-L426 PolarHBondContact O-N 2.85Å; I423-Q427 HydrophobicContact CG2-CG 4.26Å; I423-Q427 VanDerWaalsContact O-CB 3.3Å; I423-Q427 WeakPolarHBondContact O-CB 3.34Å; I423-Q427 WeakPolarHBondContact O-CG 3.41Å; I423-Q427 PolarHBondContact O-N 3.16Å; I423-P435 HydrophobicContact CD1-CB 4.04Å; I423-P435 HydrophobicContact CD1-CG 4.1Å; I423-P435 HydrophobicContact CG2-CG 4.13Å
424	S	71	Confident	67.1	Low	45 Å²	45	58.9 Å²	58.9	32%	0.315	30%	0.298	S	S	.	.	H	α-helix	trans	-59.6	-40.4	174.5	172.7	0	0	0	0	112	L420 K428	L420-S424 WeakPolarHBondContact O-CA 3.26Å; L420-S424 WeakPolarHBondContact O-CB 3.27Å; L420-S424 PolarHBondContact O-N 3.22Å; S424-K428 WeakPolarHBondContact O-CB 3.27Å; S424-K428 VanDerWaalsContact O-CG 3.31Å; S424-K428 WeakPolarHBondContact O-CG 3.42Å; S424-K428 PolarHBondContact O-N 3.29Å
425	Q	74	Confident	68.4	Low	67 Å²	67	59.4 Å²	59.4	31%	0.313	30%	0.302	S	S	.	.	H	α-helix	trans	-67.7	-45.5	177.3	-179.6	162.9	12.2	0	0	111.1	K394 K421 L422 I423 Q427 K428 D429	K394-Q425 VanDerWaalsContact NZ-CD 3.3Å; K394-Q425 VanDerWaalsContact NZ-NE2 3.13Å; K421-Q425 WeakPolarHBondContact O-CB 3.2Å; K421-Q425 PolarHBondContact O-N 3.29Å; L422-Q425 PolarHBondContact O-N 3.43Å; I423-Q425 VanDerWaalsContact C-N 3.29Å; I423-Q425 PolarHBondContact O-N 3.39Å; Q425-Q427 VanDerWaalsContact C-N 3.3Å; Q425-Q427 PolarHBondContact O-N 2.86Å; Q425-K428 PolarHBondContact O-N 3.19Å; Q425-D429 WeakPolarHBondContact CG-OD2 3.28Å; Q425-D429 PolarHBondContact NE2-OD2 2.84Å; Q425-D429 VanDerWaalsContact O-CB 3.31Å; Q425-D429 WeakPolarHBondContact O-CB 3.48Å; Q425-D429 VanDerWaalsContact O-CG 3.23Å; Q425-D429 PolarHBondContact O-N 2.73Å
426	L	73	Confident	70	Confident	17 Å²	17	60.5 Å²	60.5	9%	0.089	31%	0.308	C	S	.	.	H	α-helix	trans	-63.6	-35.8	176.4	-71	170.5	0	0	0	112.2	P274 I397 M404 L422 I423 N430 A432	P274-L426 HydrophobicContact CG-CD1 3.97Å; P274-L426 HydrophobicContact CG-CD2 4.05Å; I397-L426 HydrophobicContact CD1-CD1 4.47Å; I397-L426 HydrophobicContact CD1-CD2 4.02Å; M404-L426 HydrophobicContact SD-CD1 4.33Å; L422-L426 HydrophobicContact CD1-CD1 3.91Å; L422-L426 HydrophobicContact CD1-CG 4.04Å; L422-L426 HydrophobicContact CG-CD1 3.95Å; L422-L426 HydrophobicContact CG-CG 4.47Å; L422-L426 WeakPolarHBondContact O-CB 3.17Å; L422-L426 VanDerWaalsContact O-CG 3.24Å; L422-L426 WeakPolarHBondContact O-CG 3.28Å; L422-L426 PolarHBondContact O-N 2.82Å; I423-L426 PolarHBondContact O-N 2.85Å; L426-N430 WeakPolarHBondContact O-CB 3.46Å; L426-N430 PolarHBondContact O-N 3.16Å; L426-A432 HydrophobicContact CB-CB 4.39Å
427	Q	73.8	Confident	71.4	Confident	72 Å²	72	64.8 Å²	64.8	34%	0.336	33%	0.327	S	S	.	.	H	α-helix	trans	-66	-43.9	173.9	-76.7	175	-17.6	0	0	111.6	I423 Q425 N431 A432	I423-Q427 HydrophobicContact CG2-CG 4.26Å; I423-Q427 VanDerWaalsContact O-CB 3.3Å; I423-Q427 WeakPolarHBondContact O-CB 3.34Å; I423-Q427 WeakPolarHBondContact O-CG 3.41Å; I423-Q427 PolarHBondContact O-N 3.16Å; Q425-Q427 VanDerWaalsContact C-N 3.3Å; Q425-Q427 PolarHBondContact O-N 2.86Å; Q427-N431 VanDerWaalsContact O-CA 3.32Å; Q427-N431 WeakPolarHBondContact O-CA 3.46Å; Q427-N431 PolarHBondContact O-N 2.62Å; Q427-N431 VanDerWaalsContact O-N 3.11Å; Q427-A432 HydrophobicContact CG-CB 4.2Å
428	K	73.9	Confident	73	Confident	171 Å²	171	64.4 Å²	64.4	74%	0.743	32%	0.324	S	S	*	.	H	α-helix	trans	-67.8	-43.1	177.3	-75.6	177.3	-179.4	-178.3	0	112.8	S424 Q425	S424-K428 WeakPolarHBondContact O-CB 3.27Å; S424-K428 VanDerWaalsContact O-CG 3.31Å; S424-K428 WeakPolarHBondContact O-CG 3.42Å; S424-K428 PolarHBondContact O-N 3.29Å; Q425-K428 PolarHBondContact O-N 3.19Å
429	D	69.4	Low	74.4	Confident	104 Å²	104	70.3 Å²	70.3	56%	0.556	35%	0.352	S	S	*	.	H	α-helix	trans	-82.8	-31.8	-171.5	-64.6	-11.9	0	0	0	111.9	Q425	Q425-D429 WeakPolarHBondContact CG-OD2 3.28Å; Q425-D429 PolarHBondContact NE2-OD2 2.84Å; Q425-D429 VanDerWaalsContact O-CB 3.31Å; Q425-D429 WeakPolarHBondContact O-CB 3.48Å; Q425-D429 VanDerWaalsContact O-CG 3.23Å; Q425-D429 PolarHBondContact O-N 2.73Å
430	N	65.3	Low	75.6	Confident	67 Å²	67	70.9 Å²	70.9	36%	0.358	35%	0.353	S	S	.	.	H	α-helix	trans	-130.8	12.6	-170.6	-65	-43.1	0	0	0	115.2	P273 L426 A432	P273-N430 HydrophobicContact CB-CB 4.13Å; L426-N430 WeakPolarHBondContact O-CB 3.46Å; L426-N430 PolarHBondContact O-N 3.16Å; N430-A432 PolarHBondContact O-N 3.41Å
431	N	70.3	Confident	76.8	Confident	152 Å²	152	66.8 Å²	66.8	81%	0.813	33%	0.333	S	S	*	.			trans	49.9	40.8	-176	-150.6	25.6	0	0	0	112.9	Q427	Q427-N431 VanDerWaalsContact O-CA 3.32Å; Q427-N431 WeakPolarHBondContact O-CA 3.46Å; Q427-N431 PolarHBondContact O-N 2.62Å; Q427-N431 VanDerWaalsContact O-N 3.11Å
432	A	70.3	Confident	77.7	Confident	14 Å²	14	64.8 Å²	64.8	12%	0.116	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-62.2	142.4	-175.6	0	0	0	0	0	113.1	P273 L426 Q427 N430	P273-A432 HydrophobicContact CB-CB 3.7Å; P273-A432 HydrophobicContact CG-CB 4.17Å; L426-A432 HydrophobicContact CB-CB 4.39Å; Q427-A432 HydrophobicContact CG-CB 4.2Å; N430-A432 PolarHBondContact O-N 3.41Å
433	R	74.4	Confident	78.5	Confident	120 Å²	120	66 Å²	66	45%	0.453	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-57.2	148.9	171.5	-68.1	-175	-172.7	-179.7	4.7	110.1
434	P	78	Confident	79.4	Confident	102 Å²	102	65.6 Å²	65.6	66%	0.662	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-57.5	145.9	172.3	24.4	-32.7	0	0	0	110.7
435	P	82.4	Confident	80.1	Confident	28 Å²	28	67.3 Å²	67.3	18%	0.182	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-63.5	140.4	-179.5	27.3	-35.2	0	0	0	110.8	S276 T278 I423	S276-P435 CarbonylContact O-C 3.57Å; S276-P435 WeakPolarHBondContact O-CA 3.11Å; S276-P435 WeakPolarHBondContact OG-CB 3.45Å; T278-P435 HydrophobicContact CG2-CB 3.94Å; I423-P435 HydrophobicContact CD1-CB 4.04Å; I423-P435 HydrophobicContact CD1-CG 4.1Å; I423-P435 HydrophobicContact CG2-CG 4.13Å
436	L	88.1	Confident	80.7	Confident	24 Å²	24	67.1 Å²	67.1	13%	0.126	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	140.7	169.5	-65.3	169.8	0	0	0	109.7	Q261 M275 S276 L277 T278	Q261-L436 HydrophobicContact CB-CD1 4.15Å; Q261-L436 VanDerWaalsContact CD-CD2 3.47Å; M275-L436 HydrophobicContact CG-CD1 4.34Å; M275-L436 HydrophobicContact SD-CD1 3.96Å; S276-L436 PolarHBondContact O-N 3Å; L277-L436 HydrophobicContact CD1-CB 3.62Å; T278-L436 PolarHBondContact N-O 3.49Å; T278-L436 PolarHBondContact OG1-O 3.12Å; T278-L436 VanDerWaalsContact OG1-O 3.09Å
437	K	88.2	Confident	81.2	Confident	124 Å²	124	71.1 Å²	71.1	54%	0.539	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	134.1	-180	-67.2	-175.9	-176.8	176.8	0	110.5	T278	T278-K437 VanDerWaalsContact O-CA 3.26Å; T278-K437 WeakPolarHBondContact O-CA 3.47Å
438	L	88.6	Confident	82	Confident	3 Å²	3	67.7 Å²	67.7	2%	0.016	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	113.4	166.2	-49.8	175.8	0	0	0	108.6	D254 A258 L277 T278 A279 R283 K285	D254-L438 HydrophobicContact CB-CD2 3.76Å; D254-L438 WeakPolarHBondContact O-CD2 3.3Å; A258-L438 HydrophobicContact CB-CD2 3.92Å; L277-L438 HydrophobicContact CD1-CD1 4.14Å; L277-L438 HydrophobicContact CD1-CD2 4.1Å; L277-L438 HydrophobicContact CD1-CG 3.8Å; L277-L438 HydrophobicContact CD2-CD1 4.11Å; L277-L438 HydrophobicContact CG-CD1 4.41Å; L277-L438 HydrophobicContact CG-CG 4.5Å; T278-L438 PolarHBondContact O-N 3.32Å; A279-L438 HydrophobicContact CB-CB 3.7Å; A279-L438 HydrophobicContact CB-CD1 4Å; A279-L438 HydrophobicContact CB-CG 4.07Å; R283-L438 HydrophobicContact CB-CB 3.96Å; K285-L438 HydrophobicContact CB-CD1 4.43Å
439	E	85.8	Confident	82.7	Confident	136 Å²	136	61.6 Å²	61.6	64%	0.636	31%	0.311	S	S	*	.			trans	-105.6	-32.4	179.4	-62.2	-169.8	173.5	0	0	110.9	D254 R283	D254-E439 PolarHBondContact OD2-N 3.46Å; R283-E439 WeakPolarHBondContact CD-O 3.41Å; R283-E439 PolarHBondContact NE-O 2.81Å; R283-E439 PolarHBondContact NH1-O 2.82Å
440	E	87.6	Confident	83.8	Confident	19 Å²	19	56.6 Å²	56.6	9%	0.089	28%	0.284	C	S	.	.	S	Bend	trans	-70.2	133	179	-73.3	177.6	-149.1	0	0	114.3	N226 T252 Y253 D254 R283 E446	N226-E440 WeakPolarHBondContact CB-OE1 3.43Å; N226-E440 PolarHBondContact ND2-OE1 3.04Å; T252-E440 WeakPolarHBondContact CB-OE2 3.18Å; T252-E440 HydrophobicContact CG2-CB 3.8Å; Y253-E440 PolarHBondContact N-OE2 3.15Å; D254-E440 PolarHBondContact OD2-N 3.25Å; R283-E440 WeakPolarHBondContact CD-O 3.44Å; E440-E446 HydrophobicContact CG-CG 4.47Å; E440-E446 WeakPolarHBondContact CG-OE1 3.5Å
441	S	87.6	Confident	85	Confident	12 Å²	12	54.9 Å²	54.9	8%	0.084	27%	0.274	C	S	.	.			trans	-80.6	140.6	176.4	176.2	0	0	0	0	110.4	R443 Y444	S441-R443 PolarHBondContact OG-N 3.42Å; S441-R443 VanDerWaalsContact OG-N 3.13Å; S441-Y444 VanDerWaalsContact CB-CE2 3.43Å; S441-Y444 WeakPolarHBondContact CB-O 3.23Å; S441-Y444 WeakPolarHBondContact OG-CD2 3.34Å; S441-Y444 VanDerWaalsContact OG-CE2 3.32Å; S441-Y444 WeakPolarHBondContact OG-CE2 3.39Å; S441-Y444 PolarHBondContact OG-N 3.18Å
442	I	87.8	Confident	85.9	Confident	58 Å²	58	52 Å²	52	30%	0.297	25%	0.254	S	S	.	.	S	Bend	trans	-88.3	-10	173.6	60.9	159.3	0	0	0	112.8	T252 G282	T252-I442 HydrophobicContact CG2-CG2 4.09Å; G282-I442 WeakPolarHBondContact O-CG1 3.42Å; G282-I442 PolarHBondContact O-N 3.4Å
443	R	88.3	Confident	86.9	Confident	34 Å²	34	52.1 Å²	52.1	13%	0.128	25%	0.252	C	S	.	.	S	Bend	trans	-99.6	-33.9	-174.4	-68	-172.8	-174.3	128.5	10.5	113.2	T114 E136 E139 G140 S441	T114-R443 HydrophobicContact CG2-CG 4.24Å; T114-R443 PolarHBondContact OG1-NE 2.84Å; E136-R443 WeakPolarHBondContact O-CD 3.43Å; E136-R443 PolarHBondContact O-NH1 3Å; E136-R443 IonicContact OE1-CZ 3.9Å; E136-R443 IonicContact OE1-NH1 2.68Å; E136-R443 PolarHBondContact OE1-NH1 3.39Å; E139-R443 CarbonylContact C-O 3.5Å; E139-R443 WeakPolarHBondContact CA-O 3.35Å; G140-R443 PolarHBondContact N-O 2.65Å; S441-R443 PolarHBondContact OG-N 3.42Å; S441-R443 VanDerWaalsContact OG-N 3.13Å
444	Y	88.8	Confident	87.6	Confident	9 Å²	9	47 Å²	47	4%	0.035	23%	0.233	C	C	.	.	S	Bend	trans	-145.1	160.4	-175	43.6	-100.9	0	0	0	109.6	R23 S441 D448 E451	R23-Y444 VanDerWaalsContact CZ-CE1 3.49Å; S441-Y444 VanDerWaalsContact CB-CE2 3.43Å; S441-Y444 WeakPolarHBondContact CB-O 3.23Å; S441-Y444 WeakPolarHBondContact OG-CD2 3.34Å; S441-Y444 VanDerWaalsContact OG-CE2 3.32Å; S441-Y444 WeakPolarHBondContact OG-CE2 3.39Å; S441-Y444 PolarHBondContact OG-N 3.18Å; Y444-D448 HydrophobicContact CD2-CB 4.14Å; Y444-E451 HydrophobicContact CE2-CB 4.37Å; Y444-E451 HydrophobicContact CE2-CG 4.32Å; Y444-E451 VanDerWaalsContact CE2-OE2 3.26Å; Y444-E451 WeakPolarHBondContact CE2-OE2 3.37Å; Y444-E451 VanDerWaalsContact OH-CD 3.25Å; Y444-E451 PolarHBondContact OH-OE1 2.98Å
445	Q	87.5	Confident	88.1	Confident	80 Å²	80	44.1 Å²	44.1	37%	0.374	21%	0.212	S	C	.	.			trans	-72	161.5	-176.8	-143.6	69.3	14.9	0	0	111.7	G21 E227	G21-Q445 PolarHBondContact O-N 2.96Å; E227-Q445 PolarHBondContact OE1-NE2 3.23Å
446	E	84.7	Confident	88.4	Confident	64 Å²	64	46.6 Å²	46.6	30%	0.299	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	153.9	174.1	-68.8	177.7	-164.7	0	0	112.2	H22 N226 E440 D448	H22-E446 PolarHBondContact NE2-O 3.42Å; N226-E446 PolarHBondContact ND2-OE1 2.79Å; E440-E446 HydrophobicContact CG-CG 4.47Å; E440-E446 WeakPolarHBondContact CG-OE1 3.5Å; E446-D448 VanDerWaalsContact C-N 3.29Å; E446-D448 PolarHBondContact O-N 3.42Å
447	N	85.1	Confident	88.5	Confident	101 Å²	101	45.6 Å²	45.6	54%	0.54	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.8	22.3	176.2	-68.3	-59.2	0	0	0	116.3	D449 K452	N447-D449 PolarHBondContact O-N 3.46Å; N447-K452 WeakPolarHBondContact OD1-CE 3.35Å; N447-K452 PolarHBondContact OD1-NZ 3.4Å
448	D	89.6	Confident	88.5	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.195	C	C	.	.			trans	-56.3	122	173.5	-175	4.8	0	0	0	112.4	R23 Y444 E446 I450 E451 K452	R23-D448 IonicContact CZ-OD2 3.62Å; R23-D448 PolarHBondContact N-OD1 2.72Å; R23-D448 IonicContact NE-OD2 3.48Å; R23-D448 PolarHBondContact NE-OD2 3.07Å; R23-D448 IonicContact NH2-OD2 3.85Å; R23-D448 PolarHBondContact NH2-OD2 3.49Å; Y444-D448 HydrophobicContact CD2-CB 4.14Å; E446-D448 VanDerWaalsContact C-N 3.29Å; E446-D448 PolarHBondContact O-N 3.42Å; D448-I450 VanDerWaalsContact C-N 3.29Å; D448-I450 PolarHBondContact O-N 2.87Å; D448-I450 PolarHBondContact OD1-N 2.88Å; D448-I450 VanDerWaalsContact OD1-N 3.14Å; D448-E451 HydrophobicContact CB-CB 4.07Å; D448-E451 WeakPolarHBondContact O-CB 3.39Å; D448-E451 PolarHBondContact O-N 2.9Å; D448-K452 PolarHBondContact O-N 2.9Å; D448-K452 VanDerWaalsContact O-N 3.09Å
449	D	89.3	Confident	88.3	Confident	42 Å²	42	40 Å²	40	23%	0.225	19%	0.194	C	C	.	.	H	α-helix	trans	-63.8	-34.8	-177.9	-62.1	-66.4	0	0	0	112.1	H22 R193 N447 E451 K452 W453	H22-D449 IonicContact ND1-OD2 3.18Å; R193-D449 HydrophobicContact CB-CB 4.23Å; R193-D449 WeakPolarHBondContact CD-OD2 3.26Å; R193-D449 HydrophobicContact CG-CB 3.95Å; R193-D449 IonicContact NE-OD2 2.65Å; R193-D449 PolarHBondContact NE-OD2 3.19Å; N447-D449 PolarHBondContact O-N 3.46Å; D449-E451 VanDerWaalsContact C-N 3.33Å; D449-K452 PolarHBondContact O-N 3.02Å; D449-W453 WeakPolarHBondContact O-CB 3.49Å; D449-W453 PolarHBondContact O-N 3.4Å
450	I	91.7	Very high	87.9	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-70.2	-35.7	178.3	-63.5	-169.3	0	0	0	110.5	R23 M25 V135 I144 R193 D448 W453 L454	R23-I450 HydrophobicContact CB-CB 4.32Å; R23-I450 HydrophobicContact CB-CD1 3.73Å; R23-I450 HydrophobicContact CB-CG1 4.37Å; R23-I450 WeakPolarHBondContact O-CD1 3.46Å; M25-I450 HydrophobicContact CB-CD1 3.82Å; M25-I450 HydrophobicContact CE-CG2 4.37Å; V135-I450 HydrophobicContact CG1-CG2 3.85Å; I144-I450 HydrophobicContact CD1-CD1 4.22Å; I144-I450 HydrophobicContact CD1-CG2 4.02Å; R193-I450 HydrophobicContact CB-CD1 4.42Å; R193-I450 HydrophobicContact CB-CG1 4.03Å; D448-I450 VanDerWaalsContact C-N 3.29Å; D448-I450 PolarHBondContact O-N 2.87Å; D448-I450 PolarHBondContact OD1-N 2.88Å; D448-I450 VanDerWaalsContact OD1-N 3.14Å; I450-W453 HydrophobicContact CG2-CE3 4.31Å; I450-L454 VanDerWaalsContact O-CB 3.31Å; I450-L454 WeakPolarHBondContact O-CB 3.33Å; I450-L454 PolarHBondContact O-N 3.21Å
451	E	90.1	Very high	87.1	Confident	30 Å²	30	38.1 Å²	38.1	14%	0.14	19%	0.189	C	C	.	.	H	α-helix	trans	-63.1	-50.9	174.3	-163	-179.8	-165.5	0	0	110.9	R23 R283 Y444 D448 D449 W453 L454 I455	R23-E451 VanDerWaalsContact NH2-CB 3.29Å; R283-E451 IonicContact CZ-OE1 2.72Å; R283-E451 IonicContact CZ-OE2 2.9Å; R283-E451 IonicContact NH1-OE2 3.22Å; R283-E451 IonicContact NH2-OE1 3.73Å; R283-E451 PolarHBondContact NH2-OE1 3Å; R283-E451 IonicContact NH2-OE2 3.27Å; R283-E451 PolarHBondContact NH2-OE2 2.86Å; Y444-E451 HydrophobicContact CE2-CB 4.37Å; Y444-E451 HydrophobicContact CE2-CG 4.32Å; Y444-E451 VanDerWaalsContact CE2-OE2 3.26Å; Y444-E451 WeakPolarHBondContact CE2-OE2 3.37Å; Y444-E451 VanDerWaalsContact OH-CD 3.25Å; Y444-E451 PolarHBondContact OH-OE1 2.98Å; D448-E451 HydrophobicContact CB-CB 4.07Å; D448-E451 WeakPolarHBondContact O-CB 3.39Å; D448-E451 PolarHBondContact O-N 2.9Å; D449-E451 VanDerWaalsContact C-N 3.33Å; E451-W453 VanDerWaalsContact C-N 3.3Å; E451-W453 PolarHBondContact O-N 2.84Å; E451-L454 PolarHBondContact O-N 3.36Å; E451-L454 VanDerWaalsContact O-N 3.13Å; E451-I455 HydrophobicContact CG-CD1 3.74Å; E451-I455 HydrophobicContact CG-CG1 4.25Å; E451-I455 WeakPolarHBondContact O-CB 3.38Å; E451-I455 WeakPolarHBondContact O-CG1 3.42Å; E451-I455 PolarHBondContact O-N 3.47Å
452	K	89.3	Confident	85.7	Confident	92 Å²	92	37.8 Å²	37.8	40%	0.4	19%	0.187	S	C	.	.	H	α-helix	trans	-58	-44.8	179.5	-71.5	173.5	177.3	169.9	0	111.4	N447 D448 D449 I455 N456	N447-K452 WeakPolarHBondContact OD1-CE 3.35Å; N447-K452 PolarHBondContact OD1-NZ 3.4Å; D448-K452 PolarHBondContact O-N 2.9Å; D448-K452 VanDerWaalsContact O-N 3.09Å; D449-K452 PolarHBondContact O-N 3.02Å; K452-I455 PolarHBondContact O-N 3.45Å; K452-N456 WeakPolarHBondContact O-CB 3.35Å; K452-N456 PolarHBondContact O-N 3.28Å; K452-N456 PolarHBondContact O-ND2 3.36Å
453	W	91.5	Very high	84.1	Confident	16 Å²	16	36.7 Å²	36.7	6%	0.061	19%	0.185	C	C	.	.	H	α-helix	trans	-58.2	-49.3	174.5	165.2	78.3	0	0	0	111.7	M25 L131 L184 S187 L188 C191 D449 I450 E451 I455 N456 L457	M25-W453 HydrophobicContact CE-CE3 4.27Å; M25-W453 HydrophobicContact CE-CH2 3.87Å; M25-W453 HydrophobicContact CE-CZ3 3.54Å; M25-W453 HydrophobicContact SD-CH2 4.32Å; M25-W453 HydrophobicContact SD-CZ3 4.44Å; L131-W453 HydrophobicContact CD1-CH2 4.4Å; L131-W453 HydrophobicContact CD2-CH2 4.05Å; L131-W453 HydrophobicContact CD2-CZ3 4.16Å; L184-W453 HydrophobicContact CD1-CH2 4.38Å; L184-W453 HydrophobicContact CD1-CZ2 3.84Å; S187-W453 VanDerWaalsContact O-CD1 3.3Å; S187-W453 PolarHBondContact O-NE1 3.29Å; S187-W453 PolarHBondContact OG-NE1 2.99Å; L188-W453 HydrophobicContact CD2-CH2 3.96Å; L188-W453 HydrophobicContact CD2-CZ2 3.37Å; L188-W453 HydrophobicContact CG-CZ2 3.9Å; C191-W453 HydrophobicContact CB-CB 4.43Å; C191-W453 HydrophobicContact CB-CG 4.1Å; D449-W453 WeakPolarHBondContact O-CB 3.49Å; D449-W453 PolarHBondContact O-N 3.4Å; I450-W453 HydrophobicContact CG2-CE3 4.31Å; E451-W453 VanDerWaalsContact C-N 3.3Å; E451-W453 PolarHBondContact O-N 2.84Å; W453-I455 PolarHBondContact O-N 3.17Å; W453-N456 PolarHBondContact O-N 2.94Å; W453-L457 HydrophobicContact CH2-CD2 4Å; W453-L457 HydrophobicContact CZ2-CD2 3.56Å; W453-L457 VanDerWaalsContact O-CB 3.29Å; W453-L457 WeakPolarHBondContact O-CB 3.35Å; W453-L457 PolarHBondContact O-N 2.96Å
454	L	90.4	Very high	82.6	Confident	12 Å²	12	40.4 Å²	40.4	6%	0.063	21%	0.211	C	C	.	.	H	α-helix	trans	-62.4	-44	-178.9	-179.4	64.4	0	0	0	111.9	L131 V135 I450 E451 N456 L458	L131-L454 HydrophobicContact CD2-CD1 3.18Å; V135-L454 HydrophobicContact CB-CD2 4.16Å; V135-L454 HydrophobicContact CG1-CD2 3.85Å; I450-L454 VanDerWaalsContact O-CB 3.31Å; I450-L454 WeakPolarHBondContact O-CB 3.33Å; I450-L454 PolarHBondContact O-N 3.21Å; E451-L454 PolarHBondContact O-N 3.36Å; E451-L454 VanDerWaalsContact O-N 3.13Å; L454-N456 VanDerWaalsContact C-N 3.35Å; L454-L458 HydrophobicContact CD1-CD1 3.59Å; L454-L458 HydrophobicContact CD1-CG 4.04Å; L454-L458 HydrophobicContact CG-CD1 4.18Å; L454-L458 WeakPolarHBondContact O-CB 3.48Å; L454-L458 WeakPolarHBondContact O-CG 3.25Å; L454-L458 PolarHBondContact O-N 2.92Å
455	I	87.4	Confident	81.2	Confident	43 Å²	43	41.9 Å²	41.9	22%	0.221	22%	0.221	C	C	.	.	H	α-helix	trans	-62.3	-43.1	178.2	-73.1	175.1	0	0	0	110.8	E451 K452 W453 C459 L460 D461	E451-I455 HydrophobicContact CG-CD1 3.74Å; E451-I455 HydrophobicContact CG-CG1 4.25Å; E451-I455 WeakPolarHBondContact O-CB 3.38Å; E451-I455 WeakPolarHBondContact O-CG1 3.42Å; E451-I455 PolarHBondContact O-N 3.47Å; K452-I455 PolarHBondContact O-N 3.45Å; W453-I455 PolarHBondContact O-N 3.17Å; I455-C459 CarbonylContact O-C 3.35Å; I455-C459 WeakPolarHBondContact O-CA 3.13Å; I455-C459 PolarHBondContact O-N 3.26Å; I455-L460 HydrophobicContact CG2-CB 4.31Å; I455-L460 PolarHBondContact O-N 3.48Å; I455-D461 HydrophobicContact CG2-CB 3.57Å
456	N	88.8	Confident	79.9	Confident	80 Å²	80	41.4 Å²	41.4	43%	0.428	23%	0.225	S	C	.	.	H	α-helix	trans	-69.1	-47.8	178.8	-70.3	-15	0	0	0	111.6	R183 K452 W453 L454 L458 C459 H500	R183-N456 PolarHBondContact NH2-O 3.23Å; K452-N456 WeakPolarHBondContact O-CB 3.35Å; K452-N456 PolarHBondContact O-N 3.28Å; K452-N456 PolarHBondContact O-ND2 3.36Å; W453-N456 PolarHBondContact O-N 2.94Å; L454-N456 VanDerWaalsContact C-N 3.35Å; N456-L458 VanDerWaalsContact C-N 3.33Å; N456-L458 PolarHBondContact O-N 3.36Å; N456-C459 PolarHBondContact O-N 3.42Å; N456-C459 VanDerWaalsContact O-N 3.13Å; N456-H500 PolarHBondContact O-CE1 3.32Å; N456-H500 PolarHBondContact O-NE2 3.25Å
457	L	89.9	Confident	78.6	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-57.3	-45.7	177.8	173.3	66	0	0	0	111.8	R183 L184 W453 C459	R183-L457 HydrophobicContact CG-CD1 4.42Å; R183-L457 VanDerWaalsContact CZ-O 3.29Å; R183-L457 PolarHBondContact NH1-O 2.92Å; R183-L457 PolarHBondContact NH2-O 3.39Å; L184-L457 HydrophobicContact CD1-CD1 4.42Å; L184-L457 HydrophobicContact CD1-CD2 3.47Å; L184-L457 VanDerWaalsContact CD1-CD2 3.47Å; W453-L457 HydrophobicContact CH2-CD2 4Å; W453-L457 HydrophobicContact CZ2-CD2 3.56Å; W453-L457 VanDerWaalsContact O-CB 3.29Å; W453-L457 WeakPolarHBondContact O-CB 3.35Å; W453-L457 PolarHBondContact O-N 2.96Å; L457-C459 VanDerWaalsContact C-N 3.3Å
458	L	88.3	Confident	77.5	Confident	8 Å²	8	39.6 Å²	39.6	4%	0.042	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	2	-178.4	-61.1	-174.9	0	0	0	113.5	P128 A132 L454 N456 L460 P515	P128-L458 HydrophobicContact CB-CD2 3.66Å; A132-L458 HydrophobicContact CB-CD1 3.71Å; L454-L458 HydrophobicContact CD1-CD1 3.59Å; L454-L458 HydrophobicContact CD1-CG 4.04Å; L454-L458 HydrophobicContact CG-CD1 4.18Å; L454-L458 WeakPolarHBondContact O-CB 3.48Å; L454-L458 WeakPolarHBondContact O-CG 3.25Å; L454-L458 PolarHBondContact O-N 2.92Å; N456-L458 VanDerWaalsContact C-N 3.33Å; N456-L458 PolarHBondContact O-N 3.36Å; L458-L460 HydrophobicContact CB-CD1 4.1Å; L458-L460 HydrophobicContact CB-CD2 4.29Å; L458-L460 HydrophobicContact CB-CG 3.78Å; L458-L460 HydrophobicContact CD1-CD1 4.33Å; L458-L460 PolarHBondContact O-N 2.69Å; L458-P515 HydrophobicContact CD1-CB 4.33Å; L458-P515 HydrophobicContact CD2-CB 4.33Å
459	C	85.3	Confident	75.9	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.007	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	38.8	-177.4	-55.7	0	0	0	0	113.2	R183 I455 N456 L457 D461 A462 V503	R183-C459 PolarHBondContact NH2-SG 3.35Å; R183-C459 VanDerWaalsContact NH2-SG 3.41Å; I455-C459 CarbonylContact O-C 3.35Å; I455-C459 WeakPolarHBondContact O-CA 3.13Å; I455-C459 PolarHBondContact O-N 3.26Å; N456-C459 PolarHBondContact O-N 3.42Å; N456-C459 VanDerWaalsContact O-N 3.13Å; L457-C459 VanDerWaalsContact C-N 3.3Å; C459-D461 VanDerWaalsContact C-N 3.34Å; C459-A462 WeakPolarHBondContact O-CB 3.18Å; C459-V503 HydrophobicContact CB-CB 3.94Å; C459-V503 HydrophobicContact CB-CG1 3.77Å; C459-V503 HydrophobicContact CB-CG2 4.2Å
460	L	77.4	Confident	74.6	Confident	31 Å²	31	44.8 Å²	44.8	16%	0.162	27%	0.265	C	S	.	.			trans	-74.4	-24.3	-176.3	-63.6	173.1	0	0	0	112.7	N409 I455 L458 A462 P515	N409-L460 PolarHBondContact OD1-O 3.05Å; I455-L460 HydrophobicContact CG2-CB 4.31Å; I455-L460 PolarHBondContact O-N 3.48Å; L458-L460 HydrophobicContact CB-CD1 4.1Å; L458-L460 HydrophobicContact CB-CD2 4.29Å; L458-L460 HydrophobicContact CB-CG 3.78Å; L458-L460 HydrophobicContact CD1-CD1 4.33Å; L458-L460 PolarHBondContact O-N 2.69Å; L460-A462 PolarHBondContact O-N 3.04Å; L460-P515 HydrophobicContact CD2-CG 4.38Å
461	D	71	Confident	73.2	Confident	85 Å²	85	47.8 Å²	47.8	46%	0.455	30%	0.296	S	S	.	.			trans	-80.6	36	176.9	-163.7	14	0	0	0	113.2	I455 C459 S463	I455-D461 HydrophobicContact CG2-CB 3.57Å; C459-D461 VanDerWaalsContact C-N 3.34Å; D461-S463 PolarHBondContact O-N 3.13Å; D461-S463 WeakPolarHBondContact OD1-CB 3.44Å; D461-S463 PolarHBondContact OD1-OG 3.06Å
462	A	58.4	Low	72.3	Confident	6 Å²	6	49.6 Å²	49.6	5%	0.05	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	32.7	-179.8	0	0	0	0	0	112	C459 L460 S504 V507	C459-A462 WeakPolarHBondContact O-CB 3.18Å; L460-A462 PolarHBondContact O-N 3.04Å; A462-S504 PolarHBondContact O-OG 2.82Å; A462-V507 HydrophobicContact CB-CB 4.32Å; A462-V507 HydrophobicContact CB-CG2 4.36Å
463	S	53.9	Low	71.9	Confident	34 Å²	34	46.4 Å²	46.4	24%	0.238	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-34	-146.3	69.2	0	0	0	0	115.2	R416 D461	R416-S463 VanDerWaalsContact CZ-CB 3.4Å; R416-S463 VanDerWaalsContact NH2-C 3.32Å; R416-S463 PolarHBondContact NH2-O 3.38Å; D461-S463 PolarHBondContact O-N 3.13Å; D461-S463 WeakPolarHBondContact OD1-CB 3.44Å; D461-S463 PolarHBondContact OD1-OG 3.06Å
464	T	55.6	Low	71.7	Confident	113 Å²	113	50 Å²	50	69%	0.693	32%	0.323	S	S	*	.			trans	-107.2	108.1	170.8	45.1	0	0	0	0	106.2	P466	T464-P466 WeakPolarHBondContact O-CD 3.31Å
465	V	60.2	Low	71.5	Confident	39 Å²	39	51.2 Å²	51.2	24%	0.236	33%	0.332	C	S	.	.			trans	-71.8	111.3	162.3	-165.7	0	0	0	0	104.4	S467 H604 P605	V465-S467 PolarHBondContact O-N 2.9Å; V465-H604 VanDerWaalsContact CG1-CD2 3.48Å; V465-H604 WeakPolarHBondContact CG1-CD2 3.31Å; V465-H604 WeakPolarHBondContact CG1-NE2 3.07Å; V465-P605 HydrophobicContact CG2-CG 4.48Å
466	P	60	Low	71.5	Confident	70 Å²	70	55 Å²	55	46%	0.455	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-57.4	130.6	-175	21.4	-30.4	0	0	0	108.7	T464 I468	T464-P466 WeakPolarHBondContact O-CD 3.31Å; P466-I468 PolarHBondContact O-N 2.94Å; P466-I468 VanDerWaalsContact O-N 3.07Å
467	S	57.1	Low	71.4	Confident	100 Å²	100	53.6 Å²	53.6	70%	0.699	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-60.6	116.8	174.1	52.8	0	0	0	0	107.9	V465 S469	V465-S467 PolarHBondContact O-N 2.9Å; S467-S469 PolarHBondContact O-N 2.7Å
468	I	61.8	Low	71.4	Confident	28 Å²	28	53.5 Å²	53.5	14%	0.144	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-56.3	124.2	174.8	-72.9	-175.8	0	0	0	108.4	P466 S470 E544 L546 Y607	P466-I468 PolarHBondContact O-N 2.94Å; P466-I468 VanDerWaalsContact O-N 3.07Å; I468-S470 WeakPolarHBondContact CG2-O 3.33Å; I468-E544 HydrophobicContact CD1-CB 4.18Å; I468-E544 HydrophobicContact CG1-CB 4.42Å; I468-E544 HydrophobicContact CG1-CG 4.32Å; I468-E544 WeakPolarHBondContact CG2-OE2 3.33Å; I468-L546 HydrophobicContact CD1-CD2 3.73Å; I468-Y607 HydrophobicContact CB-CE2 4.31Å; I468-Y607 WeakPolarHBondContact CB-OH 3.34Å; I468-Y607 HydrophobicContact CD1-CD2 4.16Å; I468-Y607 HydrophobicContact CD1-CE2 3.3Å; I468-Y607 HydrophobicContact CG1-CE2 4.01Å; I468-Y607 WeakPolarHBondContact CG2-OH 3.35Å
469	S	57.2	Low	71.5	Confident	120 Å²	120	58 Å²	58	84%	0.839	37%	0.372	S	S	*	.	S	Bend	trans	-89.2	-19.6	-176.6	61.3	0	0	0	0	112.4	S467	S467-S469 PolarHBondContact O-N 2.7Å
470	S	60.7	Low	71.9	Confident	31 Å²	31	58.4 Å²	58.4	22%	0.217	37%	0.374	C	S	.	.	S	Bend	trans	-88.2	129.6	174.1	82.1	0	0	0	0	108.7	I468 E544	I468-S470 WeakPolarHBondContact CG2-O 3.33Å; S470-E544 PolarHBondContact OG-OE2 3.2Å
471	G	63.5	Low	72.6	Confident	63 Å²	63	58.3 Å²	58.3	65%	0.649	37%	0.372	S	S	*	.			trans	-51.9	162.3	-176.9	0	0	0	0	0	114.1	P473	G471-P473 WeakPolarHBondContact O-CD 3.13Å; G471-P473 VanDerWaalsContact O-N 3.15Å
472	C	69.6	Low	73.7	Confident	68 Å²	68	55.1 Å²	55.1	46%	0.459	35%	0.354	S	S	.	.			trans	-61.7	111.1	-179	-170.1	0	0	0	0	111.5	Y607 M610 Y612	C472-Y607 HydrophobicContact CB-CE1 4.19Å; C472-M610 PolarHBondContact SG-SD 3.11Å; C472-Y612 PolarHBondContact SG-OH 3.16Å
473	P	82.6	Confident	75.3	Confident	25 Å²	25	54.8 Å²	54.8	16%	0.162	35%	0.351	C	S	.	.			trans	-70.6	153.3	177.8	29.4	-34.3	0	0	0	111.3	G471 P535 L546 Y612	G471-P473 WeakPolarHBondContact O-CD 3.13Å; G471-P473 VanDerWaalsContact O-N 3.15Å; P473-P535 HydrophobicContact CB-CG 4.23Å; P473-L546 HydrophobicContact CG-CD1 4.06Å; P473-Y612 WeakPolarHBondContact CD-OH 3.41Å; P473-Y612 PolarHBondContact O-OH 3.3Å
474	T	86.5	Confident	77	Confident	92 Å²	92	53.7 Å²	53.7	56%	0.564	34%	0.342	S	S	*	.			trans	-65.6	137.8	171.5	50	0	0	0	0	110.1	D476 A477	T474-D476 PolarHBondContact O-N 3.31Å; T474-A477 WeakPolarHBondContact O-CB 3.33Å; T474-A477 PolarHBondContact O-N 2.81Å
475	P	86.6	Confident	78.7	Confident	36 Å²	36	49.1 Å²	49.1	23%	0.234	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-53.2	-30.1	-177.8	-28.7	34.9	0	0	0	114.8	A477 C478 M610 Y612 R615	P475-A477 VanDerWaalsContact C-N 3.32Å; P475-A477 PolarHBondContact O-N 3.08Å; P475-C478 WeakPolarHBondContact O-CB 3.45Å; P475-C478 PolarHBondContact O-N 3.18Å; P475-M610 WeakPolarHBondContact CG-O 3.35Å; P475-Y612 HydrophobicContact CB-CD1 4.19Å; P475-Y612 HydrophobicContact CB-CE1 4.37Å; P475-Y612 HydrophobicContact CG-CD1 4.19Å; P475-Y612 HydrophobicContact CG-CE1 4.11Å; P475-R615 HydrophobicContact CB-CB 4.34Å; P475-R615 WeakPolarHBondContact O-CG 3.28Å; P475-R615 PolarHBondContact O-NE 3.25Å
476	D	87.4	Confident	79.9	Confident	124 Å²	124	49.4 Å²	49.4	66%	0.663	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-69.7	-28.7	-179.3	-61.3	-37.5	0	0	0	113.3	T474 C478 R615	T474-D476 PolarHBondContact O-N 3.31Å; D476-C478 PolarHBondContact O-N 2.95Å; D476-R615 PolarHBondContact O-NH2 3.09Å
477	A	87.1	Confident	81.2	Confident	50 Å²	50	46.2 Å²	46.2	41%	0.413	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-78.7	-8.7	176.6	0	0	0	0	0	112.9	T474 P475	T474-A477 WeakPolarHBondContact O-CB 3.33Å; T474-A477 PolarHBondContact O-N 2.81Å; P475-A477 VanDerWaalsContact C-N 3.32Å; P475-A477 PolarHBondContact O-N 3.08Å
478	C	89.4	Confident	82.8	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	26%	0.259	C	S	.	.			trans	-88.1	137.7	179.2	-58.6	0	0	0	0	110.8	P475 D476 L532 L533	P475-C478 WeakPolarHBondContact O-CB 3.45Å; P475-C478 PolarHBondContact O-N 3.18Å; D476-C478 PolarHBondContact O-N 2.95Å; C478-L532 HydrophobicContact CB-CD1 4.04Å; C478-L532 HydrophobicContact CB-CD2 3.99Å; C478-L532 HydrophobicContact CB-CG 3.91Å; C478-L533 WeakPolarHBondContact CB-O 3.18Å
479	E	90.7	Very high	84.2	Confident	103 Å²	103	40.2 Å²	40.2	48%	0.481	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	149.8	179.5	-68.9	-178.4	164.8	0	0	110.8	Y481 L532 L533	E479-Y481 HydrophobicContact CB-CD2 4.43Å; E479-Y481 HydrophobicContact CB-CE2 3.74Å; E479-Y481 PolarHBondContact OE2-OH 2.58Å; E479-L532 WeakPolarHBondContact O-CA 3.46Å; E479-L532 WeakPolarHBondContact O-CD1 3.43Å; E479-L533 PolarHBondContact N-O 2.86Å; E479-L533 PolarHBondContact O-N 2.9Å
480	L	92.9	Very high	85.5	Confident	8 Å²	8	34.9 Å²	34.9	4%	0.042	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	130.9	177.9	-172.4	70.8	0	0	0	108.7	F530 L532 A616 L619 L620 L673	L480-F530 HydrophobicContact CD1-CB 3.9Å; L480-F530 HydrophobicContact CD2-CB 4.31Å; L480-F530 HydrophobicContact CD2-CD1 4.39Å; L480-F530 HydrophobicContact CG-CB 4.13Å; L480-F530 HydrophobicContact CG-CD1 4.47Å; L480-L532 HydrophobicContact CB-CD1 4.24Å; L480-L532 HydrophobicContact CD1-CB 4.2Å; L480-L532 HydrophobicContact CD1-CD1 4.4Å; L480-A616 HydrophobicContact CD1-CB 4.47Å; L480-L619 HydrophobicContact CB-CB 4.04Å; L480-L619 HydrophobicContact CB-CD1 3.8Å; L480-L619 HydrophobicContact CD2-CB 4.03Å; L480-L620 HydrophobicContact CD2-CB 4.18Å; L480-L620 HydrophobicContact CD2-CD1 4.28Å; L480-L673 HydrophobicContact CB-CD1 3.76Å; L480-L673 HydrophobicContact CD2-CD1 4.05Å; L480-L673 HydrophobicContact CG-CD1 4.11Å; L480-L673 WeakPolarHBondContact O-CD1 3.37Å; L480-L673 VanDerWaalsContact O-CG 3.28Å; L480-L673 WeakPolarHBondContact O-CG 3.46Å
481	Y	92.8	Very high	86.7	Confident	29 Å²	29	36.1 Å²	36.1	11%	0.114	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	144.3	-180	-72.8	-99.5	0	0	0	110.3	E479 F530 C531 L533 L670 R672	E479-Y481 HydrophobicContact CB-CD2 4.43Å; E479-Y481 HydrophobicContact CB-CE2 3.74Å; E479-Y481 PolarHBondContact OE2-OH 2.58Å; Y481-F530 CarbonylContact O-C 3.56Å; Y481-F530 VanDerWaalsContact O-CA 3.24Å; Y481-F530 WeakPolarHBondContact O-CA 3.05Å; Y481-C531 PolarHBondContact N-O 3.49Å; Y481-C531 PolarHBondContact O-N 3.42Å; Y481-L533 HydrophobicContact CD2-CB 4.09Å; Y481-L533 HydrophobicContact CD2-CD1 3.66Å; Y481-L533 HydrophobicContact CD2-CG 3.92Å; Y481-L533 HydrophobicContact CE2-CB 4.24Å; Y481-L533 HydrophobicContact CE2-CD1 4.16Å; Y481-L533 HydrophobicContact CE2-CG 4.5Å; Y481-L533 HydrophobicContact CG-CD1 3.98Å; Y481-L670 HydrophobicContact CD1-CB 4.15Å; Y481-R672 HydrophobicContact CD1-CG 4.22Å; Y481-R672 HydrophobicContact CE1-CG 3.68Å
482	Y	93.3	Very high	87.8	Confident	18 Å²	18	38.3 Å²	38.3	7%	0.071	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	133.5	168.1	-179.4	-95.7	0	0	0	109.4	H528 F530 Q671	Y482-H528 HydrophobicContact CE2-CB 3.94Å; Y482-H528 AromaticContact CE2-CG 3.96Å; Y482-H528 AromaticContact CE2-ND1 3.84Å; Y482-H528 AromaticContact CZ-ND1 3.9Å; Y482-H528 PolarHBondContact OH-ND1 3.34Å; Y482-F530 HydrophobicContact CD2-CD1 4.18Å; Y482-F530 AromaticContact CD2-CE1 3.65Å; Y482-F530 HydrophobicContact CD2-CE1 3.65Å; Y482-F530 AromaticContact CD2-CZ 3.9Å; Y482-F530 HydrophobicContact CD2-CZ 3.9Å; Y482-F530 HydrophobicContact CE2-CZ 4.41Å; Y482-F530 HydrophobicContact CG-CE1 4.46Å; Y482-Q671 HydrophobicContact CD1-CB 4.38Å; Y482-Q671 PolarHBondContact N-O 2.79Å; Y482-Q671 PolarHBondContact O-N 2.79Å
483	V	92.6	Very high	88.6	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	120.2	179.4	-176	0	0	0	0	109.5	R485 L488 F498 L529 C531 L669 L670	V483-R485 PolarHBondContact O-N 2.88Å; V483-L488 HydrophobicContact CG1-CB 4.28Å; V483-L488 HydrophobicContact CG1-CD1 4.47Å; V483-L488 HydrophobicContact CG1-CD2 4.04Å; V483-F498 HydrophobicContact CG1-CE1 4.36Å; V483-F498 HydrophobicContact CG2-CE1 4.42Å; V483-L529 HydrophobicContact CB-CB 4.06Å; V483-L529 PolarHBondContact N-O 3.3Å; V483-C531 HydrophobicContact CG2-CB 4.12Å; V483-C531 VanDerWaalsContact CG2-SG 3.56Å; V483-L669 HydrophobicContact CG1-CD1 4.3Å; V483-L670 HydrophobicContact CG2-CD2 4.13Å
484	D	90.1	Very high	88.7	Confident	10 Å²	10	44.7 Å²	44.7	5%	0.053	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-74.1	120.2	171.9	-165.8	-15.6	0	0	0	110	D486 A487 L488 P667 L669	D484-D486 PolarHBondContact OD1-N 3.01Å; D484-A487 HydrophobicContact CB-CB 4.24Å; D484-L488 WeakPolarHBondContact O-CB 3.33Å; D484-L488 PolarHBondContact O-N 3.43Å; D484-P667 VanDerWaalsContact OD2-CB 3.3Å; D484-P667 WeakPolarHBondContact OD2-CB 3.3Å; D484-P667 WeakPolarHBondContact OD2-CG 3.3Å; D484-L669 PolarHBondContact N-O 2.85Å
485	R	89.7	Confident	88.8	Confident	17 Å²	17	40.6 Å²	40.6	6%	0.064	21%	0.209	C	C	.	.	H	α-helix	trans	-72.1	-32.8	-177.1	-63	-179.7	-68.2	174.2	-9.7	111.9	V483 A487 L488 F489 M521 A524 P525 H527 L529	V483-R485 PolarHBondContact O-N 2.88Å; R485-A487 VanDerWaalsContact C-N 3.34Å; R485-L488 PolarHBondContact O-N 3.08Å; R485-F489 HydrophobicContact CB-CD2 4.4Å; R485-F489 VanDerWaalsContact O-CD2 3.31Å; R485-F489 WeakPolarHBondContact O-CD2 3.41Å; R485-F489 PolarHBondContact O-N 3.34Å; R485-M521 WeakPolarHBondContact CD-O 3.48Å; R485-A524 PolarHBondContact NH1-O 2.98Å; R485-P525 PolarHBondContact NH2-O 3.07Å; R485-H527 PolarHBondContact NE-O 3.09Å; R485-H527 PolarHBondContact NH1-O 2.93Å; R485-H527 PolarHBondContact NH2-O 3.37Å; R485-H527 VanDerWaalsContact NH2-O 3.13Å; R485-L529 HydrophobicContact CG-CD1 4.37Å
486	D	86.5	Confident	88.9	Confident	45 Å²	45	39.9 Å²	39.9	24%	0.241	20%	0.203	C	C	.	.	H	α-helix	trans	-65.6	-41.2	178	-73.7	-51.8	0	0	0	110.7	R179 D484 S490 P667	R179-D486 IonicContact CZ-OD1 3.05Å; R179-D486 VanDerWaalsContact CZ-OD1 3.23Å; R179-D486 IonicContact CZ-OD2 2.79Å; R179-D486 VanDerWaalsContact NE-CG 3.29Å; R179-D486 IonicContact NE-OD1 3.93Å; R179-D486 PolarHBondContact NE-OD1 3.34Å; R179-D486 IonicContact NE-OD2 3.98Å; R179-D486 VanDerWaalsContact NH2-CG 3.3Å; R179-D486 IonicContact NH2-OD1 3.71Å; R179-D486 PolarHBondContact NH2-OD1 3.18Å; R179-D486 IonicContact NH2-OD2 2.78Å; R179-D486 PolarHBondContact NH2-OD2 2.79Å; D484-D486 PolarHBondContact OD1-N 3.01Å; D486-S490 PolarHBondContact O-N 3Å; D486-P667 HydrophobicContact CB-CG 4.39Å
487	A	87.6	Confident	89	Confident	3 Å²	3	35.8 Å²	35.8	3%	0.025	19%	0.186	C	C	.	.	H	α-helix	trans	-68.8	-41.4	172.8	0	0	0	0	0	112.4	D484 R485 F489 S490 I666 P667 L669	D484-A487 HydrophobicContact CB-CB 4.24Å; R485-A487 VanDerWaalsContact C-N 3.34Å; A487-F489 PolarHBondContact O-N 2.71Å; A487-S490 WeakPolarHBondContact O-CB 3.39Å; A487-S490 PolarHBondContact O-N 3.43Å; A487-S490 PolarHBondContact O-OG 3.44Å; A487-I666 HydrophobicContact CB-CG2 3.87Å; A487-P667 HydrophobicContact CB-CG 4.23Å; A487-P667 WeakPolarHBondContact CB-O 3.5Å; A487-L669 HydrophobicContact CB-CB 4.31Å; A487-L669 HydrophobicContact CB-CD1 4.05Å
488	L	90.4	Very high	89.1	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.3	-41.3	-177.7	-177.3	65.6	0	0	0	113	V483 D484 R485 F498 L499 L502 L529 L669	V483-L488 HydrophobicContact CG1-CB 4.28Å; V483-L488 HydrophobicContact CG1-CD1 4.47Å; V483-L488 HydrophobicContact CG1-CD2 4.04Å; D484-L488 WeakPolarHBondContact O-CB 3.33Å; D484-L488 PolarHBondContact O-N 3.43Å; R485-L488 PolarHBondContact O-N 3.08Å; L488-F498 HydrophobicContact CD1-CD1 3.68Å; L488-F498 HydrophobicContact CD1-CE1 4.31Å; L488-L499 HydrophobicContact CD1-CB 3.97Å; L488-L499 HydrophobicContact CD1-CD1 4.24Å; L488-L499 HydrophobicContact CD2-CD1 4.03Å; L488-L499 HydrophobicContact CG-CD1 4.09Å; L488-L502 HydrophobicContact CD2-CD1 4.36Å; L488-L529 HydrophobicContact CD2-CD1 3.94Å; L488-L669 HydrophobicContact CB-CD1 3.88Å; L488-L669 HydrophobicContact CD1-CD1 4.06Å
489	F	90	Very high	89.1	Confident	3 Å²	3	33.5 Å²	33.5	1%	0.013	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	13.1	-176.9	-68.2	-71.8	0	0	0	113.9	R179 R485 A487 Y491 L499 L518 S522	R179-F489 HydrophobicContact CB-CB 3.99Å; R179-F489 HydrophobicContact CB-CD2 4.47Å; R179-F489 HydrophobicContact CB-CG 4.41Å; R485-F489 HydrophobicContact CB-CD2 4.4Å; R485-F489 VanDerWaalsContact O-CD2 3.31Å; R485-F489 WeakPolarHBondContact O-CD2 3.41Å; R485-F489 PolarHBondContact O-N 3.34Å; A487-F489 PolarHBondContact O-N 2.71Å; F489-Y491 PolarHBondContact O-N 2.96Å; F489-L499 HydrophobicContact CD1-CD2 4.05Å; F489-L499 HydrophobicContact CE1-CD1 3.89Å; F489-L499 HydrophobicContact CE1-CD2 3.84Å; F489-L499 HydrophobicContact CZ-CD1 4.11Å; F489-L518 HydrophobicContact CE1-CD1 3.76Å; F489-L518 HydrophobicContact CE1-CG 4.39Å; F489-L518 HydrophobicContact CZ-CD1 4.15Å; F489-S522 VanDerWaalsContact CE2-CA 3.42Å
490	S	84.8	Confident	89	Confident	8 Å²	8	30.7 Å²	30.7	6%	0.056	15%	0.153	C	C	.	.	S	Bend	trans	-71.1	-2.5	179.6	64.5	0	0	0	0	115.4	D486 A487 H492	D486-S490 PolarHBondContact O-N 3Å; A487-S490 WeakPolarHBondContact O-CB 3.39Å; A487-S490 PolarHBondContact O-N 3.43Å; A487-S490 PolarHBondContact O-OG 3.44Å; S490-H492 PolarHBondContact O-N 2.93Å
491	Y	86.6	Confident	88.7	Confident	57 Å²	57	34.2 Å²	34.2	22%	0.224	17%	0.166	C	C	.	.			trans	59.7	27.5	-176.1	-159.8	-109.8	0	0	0	114.7	R183 L186 D190 F489 E496	R183-Y491 HydrophobicContact CG-CD2 3.96Å; L186-Y491 HydrophobicContact CB-CD1 3.61Å; L186-Y491 HydrophobicContact CB-CE1 4.36Å; L186-Y491 HydrophobicContact CB-CG 3.84Å; D190-Y491 HydrophobicContact CB-CE1 4.15Å; D190-Y491 WeakPolarHBondContact CB-OH 3.14Å; F489-Y491 PolarHBondContact O-N 2.96Å; Y491-E496 HydrophobicContact CD2-CG 3.96Å; Y491-E496 VanDerWaalsContact CD2-OE1 3.32Å; Y491-E496 WeakPolarHBondContact CD2-OE1 3.36Å; Y491-E496 HydrophobicContact CE2-CG 4.27Å
492	H	86.1	Confident	88.5	Confident	108 Å²	108	32.9 Å²	32.9	50%	0.5	16%	0.161	S	C	.	.			trans	-78.3	144.2	170.5	-177.9	-104.9	0	0	0	111.5	S490 A494 A495 E496	S490-H492 PolarHBondContact O-N 2.93Å; H492-A494 VanDerWaalsContact C-N 3.31Å; H492-A494 PolarHBondContact ND1-N 3.19Å; H492-A494 PolarHBondContact O-N 3.45Å; H492-A494 VanDerWaalsContact O-N 3.16Å; H492-A495 HydrophobicContact CB-CB 4.1Å; H492-A495 CarbonylContact O-C 2.89Å; H492-A495 WeakPolarHBondContact O-CA 3.44Å; H492-A495 WeakPolarHBondContact O-CB 3.38Å; H492-A495 PolarHBondContact O-N 3.37Å; H492-E496 PolarHBondContact O-N 2.77Å
493	K	85.9	Confident	88.2	Confident	187 Å²	187	32.7 Å²	32.7	81%	0.813	16%	0.162	S	C	*	.	H	α-helix	trans	-53.4	-42.3	-175.3	-172.7	178.4	-179.9	-177.9	0	113.8	A497	K493-A497 PolarHBondContact O-N 2.98Å; K493-A497 VanDerWaalsContact O-N 3.13Å
494	A	86.8	Confident	87.8	Confident	41 Å²	41	32.9 Å²	32.9	34%	0.339	16%	0.163	S	C	.	.	H	α-helix	trans	-72.1	-36.7	177.3	0	0	0	0	0	112.5	H492 A497 F498 L542	H492-A494 VanDerWaalsContact C-N 3.31Å; H492-A494 PolarHBondContact ND1-N 3.19Å; H492-A494 PolarHBondContact O-N 3.45Å; H492-A494 VanDerWaalsContact O-N 3.16Å; A494-A497 PolarHBondContact O-N 2.88Å; A494-F498 WeakPolarHBondContact O-CB 3.38Å; A494-F498 PolarHBondContact O-N 2.89Å; A494-L542 HydrophobicContact CB-CD2 4.47Å
495	A	87.9	Confident	87.5	Confident	6 Å²	6	32.7 Å²	32.7	5%	0.05	16%	0.162	C	C	.	.	H	α-helix	trans	-68.4	-40.5	177.6	0	0	0	0	0	111.1	H492 F498 L499	H492-A495 HydrophobicContact CB-CB 4.1Å; H492-A495 CarbonylContact O-C 2.89Å; H492-A495 WeakPolarHBondContact O-CA 3.44Å; H492-A495 WeakPolarHBondContact O-CB 3.38Å; H492-A495 PolarHBondContact O-N 3.37Å; A495-F498 PolarHBondContact O-N 3.12Å; A495-L499 VanDerWaalsContact O-CB 3.29Å; A495-L499 WeakPolarHBondContact O-CB 3.46Å; A495-L499 PolarHBondContact O-N 3.26Å
496	E	88.9	Confident	87.2	Confident	21 Å²	21	32 Å²	32	10%	0.098	16%	0.159	C	C	.	.	H	α-helix	trans	-61.9	-46.8	173	-74.4	-62	136.6	0	0	111.4	R183 Y491 H492 F498 L499 H500	R183-E496 IonicContact CZ-OE1 2.81Å; R183-E496 IonicContact CZ-OE2 2.69Å; R183-E496 IonicContact NE-OE1 3.72Å; R183-E496 PolarHBondContact NE-OE1 3.33Å; R183-E496 IonicContact NE-OE2 3.73Å; R183-E496 PolarHBondContact NE-OE2 3.48Å; R183-E496 IonicContact NH2-OE1 3.78Å; R183-E496 IonicContact NH2-OE2 3.06Å; R183-E496 PolarHBondContact NH2-OE2 2.91Å; Y491-E496 HydrophobicContact CD2-CG 3.96Å; Y491-E496 VanDerWaalsContact CD2-OE1 3.32Å; Y491-E496 WeakPolarHBondContact CD2-OE1 3.36Å; Y491-E496 HydrophobicContact CE2-CG 4.27Å; H492-E496 PolarHBondContact O-N 2.77Å; E496-F498 VanDerWaalsContact C-N 3.28Å; E496-F498 PolarHBondContact O-N 3.45Å; E496-L499 PolarHBondContact O-N 3.3Å; E496-H500 WeakPolarHBondContact O-CB 3.38Å; E496-H500 PolarHBondContact O-CD2 3.06Å; E496-H500 PolarHBondContact O-N 3.44Å
497	A	88.5	Confident	86.9	Confident	37 Å²	37	31.4 Å²	31.4	31%	0.306	16%	0.158	S	C	.	.	H	α-helix	trans	-59.8	-39.6	175.9	0	0	0	0	0	112.3	K493 A494 R501 L542	K493-A497 PolarHBondContact O-N 2.98Å; K493-A497 VanDerWaalsContact O-N 3.13Å; A494-A497 PolarHBondContact O-N 2.88Å; A497-R501 WeakPolarHBondContact O-CG 3.49Å; A497-R501 PolarHBondContact O-N 2.99Å; A497-L542 HydrophobicContact CB-CD1 3.65Å
498	F	89.3	Confident	86.4	Confident	1 Å²	1	32 Å²	32	0%	0.004	16%	0.161	C	C	.	.	H	α-helix	trans	-67.3	-43.7	174.6	-172	-92.8	0	0	0	112.1	V483 L488 A494 A495 E496 H500 R501 L502 I545 L669 L670	V483-F498 HydrophobicContact CG1-CE1 4.36Å; V483-F498 HydrophobicContact CG2-CE1 4.42Å; L488-F498 HydrophobicContact CD1-CD1 3.68Å; L488-F498 HydrophobicContact CD1-CE1 4.31Å; A494-F498 WeakPolarHBondContact O-CB 3.38Å; A494-F498 PolarHBondContact O-N 2.89Å; A495-F498 PolarHBondContact O-N 3.12Å; E496-F498 VanDerWaalsContact C-N 3.28Å; E496-F498 PolarHBondContact O-N 3.45Å; F498-H500 PolarHBondContact O-N 3.34Å; F498-R501 PolarHBondContact O-N 3.29Å; F498-L502 HydrophobicContact CE1-CD1 4.01Å; F498-L502 WeakPolarHBondContact O-CB 3.43Å; F498-L502 PolarHBondContact O-N 2.88Å; F498-I545 HydrophobicContact CD1-CD1 4.42Å; F498-I545 HydrophobicContact CD2-CD1 3.89Å; F498-I545 HydrophobicContact CD2-CG1 4.36Å; F498-I545 HydrophobicContact CE1-CD1 4.11Å; F498-I545 HydrophobicContact CE2-CD1 3.52Å; F498-I545 HydrophobicContact CE2-CG1 3.66Å; F498-I545 HydrophobicContact CG-CD1 4.33Å; F498-I545 HydrophobicContact CZ-CD1 3.64Å; F498-I545 HydrophobicContact CZ-CG1 3.96Å; F498-L669 HydrophobicContact CB-CD2 4.25Å; F498-L669 HydrophobicContact CD1-CD2 4.09Å; F498-L669 HydrophobicContact CD2-CD2 4.47Å; F498-L669 HydrophobicContact CG-CD2 4.02Å; F498-L670 HydrophobicContact CE2-CD2 4.49Å; F498-L670 HydrophobicContact CZ-CD2 3.96Å
499	L	90.7	Very high	85.7	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-61.5	-42.8	176.5	179.8	63.4	0	0	0	111.5	L488 F489 A495 E496 R501 L502 V503 L518	L488-L499 HydrophobicContact CD1-CB 3.97Å; L488-L499 HydrophobicContact CD1-CD1 4.24Å; L488-L499 HydrophobicContact CD2-CD1 4.03Å; L488-L499 HydrophobicContact CG-CD1 4.09Å; F489-L499 HydrophobicContact CD1-CD2 4.05Å; F489-L499 HydrophobicContact CE1-CD1 3.89Å; F489-L499 HydrophobicContact CE1-CD2 3.84Å; F489-L499 HydrophobicContact CZ-CD1 4.11Å; A495-L499 VanDerWaalsContact O-CB 3.29Å; A495-L499 WeakPolarHBondContact O-CB 3.46Å; A495-L499 PolarHBondContact O-N 3.26Å; E496-L499 PolarHBondContact O-N 3.3Å; L499-R501 PolarHBondContact O-N 3.45Å; L499-L502 PolarHBondContact O-N 3.38Å; L499-V503 HydrophobicContact CD1-CG2 3.99Å; L499-V503 HydrophobicContact CG-CG2 4.36Å; L499-V503 WeakPolarHBondContact O-CB 3.45Å; L499-V503 VanDerWaalsContact O-CG2 3.32Å; L499-V503 WeakPolarHBondContact O-CG2 3.29Å; L499-V503 PolarHBondContact O-N 2.82Å; L499-L518 HydrophobicContact CD1-CD1 4.21Å
500	H	87.9	Confident	84.9	Confident	44 Å²	44	35.1 Å²	35.1	20%	0.204	18%	0.179	C	C	.	.	H	α-helix	trans	-59.8	-44.2	174.9	-88.8	-80.7	0	0	0	111.9	N456 E496 F498 S504	N456-H500 PolarHBondContact O-CE1 3.32Å; N456-H500 PolarHBondContact O-NE2 3.25Å; E496-H500 WeakPolarHBondContact O-CB 3.38Å; E496-H500 PolarHBondContact O-CD2 3.06Å; E496-H500 PolarHBondContact O-N 3.44Å; F498-H500 PolarHBondContact O-N 3.34Å; H500-S504 VanDerWaalsContact O-CB 3.22Å; H500-S504 WeakPolarHBondContact O-CB 3.43Å; H500-S504 PolarHBondContact O-N 3.38Å
501	R	86.6	Confident	83.9	Confident	82 Å²	82	37.4 Å²	37.4	31%	0.309	19%	0.186	S	C	.	.	H	α-helix	trans	-63.2	-44.8	175	-70.7	175.6	-179.6	-169.6	-0.3	111.6	A497 F498 L499 S504 I505 L542 P543 I545	A497-R501 WeakPolarHBondContact O-CG 3.49Å; A497-R501 PolarHBondContact O-N 2.99Å; F498-R501 PolarHBondContact O-N 3.29Å; L499-R501 PolarHBondContact O-N 3.45Å; R501-S504 WeakPolarHBondContact O-CB 3.45Å; R501-S504 PolarHBondContact O-N 3.16Å; R501-I505 WeakPolarHBondContact O-CG1 3.43Å; R501-I505 PolarHBondContact O-N 3.45Å; R501-L542 PolarHBondContact NH1-O 3.1Å; R501-L542 VanDerWaalsContact NH1-O 3.07Å; R501-P543 PolarHBondContact NH1-O 2.88Å; R501-I545 HydrophobicContact CB-CD1 3.95Å
502	L	88.8	Confident	83.1	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-61.9	-48.5	179.6	-174.7	160.3	0	0	0	111.3	L488 F498 L499 S504 I505 Y506 I545 V548	L488-L502 HydrophobicContact CD2-CD1 4.36Å; F498-L502 HydrophobicContact CE1-CD1 4.01Å; F498-L502 WeakPolarHBondContact O-CB 3.43Å; F498-L502 PolarHBondContact O-N 2.88Å; L499-L502 PolarHBondContact O-N 3.38Å; L502-S504 VanDerWaalsContact C-N 3.35Å; L502-I505 PolarHBondContact O-N 3.43Å; L502-Y506 HydrophobicContact CD2-CD2 3.53Å; L502-Y506 HydrophobicContact CD2-CE2 3.31Å; L502-Y506 HydrophobicContact CG-CE2 4.36Å; L502-Y506 PolarHBondContact O-N 3.26Å; L502-Y506 VanDerWaalsContact O-N 3.11Å; L502-I545 HydrophobicContact CB-CD1 4.06Å; L502-V548 HydrophobicContact CD1-CG1 4.25Å; L502-V548 HydrophobicContact CD2-CG1 4.27Å; L502-V548 HydrophobicContact CG-CG1 3.94Å; L502-V548 HydrophobicContact CG-CG2 4.16Å
503	V	87.6	Confident	82.6	Confident	14 Å²	14	34.4 Å²	34.4	9%	0.085	17%	0.174	C	C	.	.	H	α-helix	trans	-67	-36.3	177.1	176.5	0	0	0	0	111.1	C459 L499 I505 Y506 V507 L518	C459-V503 HydrophobicContact CB-CB 3.94Å; C459-V503 HydrophobicContact CB-CG1 3.77Å; C459-V503 HydrophobicContact CB-CG2 4.2Å; L499-V503 HydrophobicContact CD1-CG2 3.99Å; L499-V503 HydrophobicContact CG-CG2 4.36Å; L499-V503 WeakPolarHBondContact O-CB 3.45Å; L499-V503 VanDerWaalsContact O-CG2 3.32Å; L499-V503 WeakPolarHBondContact O-CG2 3.29Å; L499-V503 PolarHBondContact O-N 2.82Å; V503-I505 VanDerWaalsContact C-N 3.32Å; V503-I505 PolarHBondContact O-N 2.86Å; V503-Y506 PolarHBondContact O-N 3.12Å; V503-V507 HydrophobicContact CG1-CG2 3.99Å; V503-V507 WeakPolarHBondContact O-CB 3.36Å; V503-V507 VanDerWaalsContact O-CG2 3.29Å; V503-V507 WeakPolarHBondContact O-CG2 3.31Å; V503-V507 PolarHBondContact O-N 3.25Å; V503-L518 HydrophobicContact CG2-CD1 4.13Å
504	S	83.3	Confident	82.4	Confident	5 Å²	5	27.3 Å²	27.3	4%	0.035	15%	0.147	C	C	.	.	H	α-helix	trans	-58.4	-44	174.1	179.6	0	0	0	0	112.5	A462 H500 R501 L502 V507 S508	A462-S504 PolarHBondContact O-OG 2.82Å; H500-S504 VanDerWaalsContact O-CB 3.22Å; H500-S504 WeakPolarHBondContact O-CB 3.43Å; H500-S504 PolarHBondContact O-N 3.38Å; R501-S504 WeakPolarHBondContact O-CB 3.45Å; R501-S504 PolarHBondContact O-N 3.16Å; L502-S504 VanDerWaalsContact C-N 3.35Å; S504-V507 PolarHBondContact O-N 2.84Å; S504-S508 VanDerWaalsContact O-CB 3.3Å; S504-S508 WeakPolarHBondContact O-CB 3.4Å; S504-S508 PolarHBondContact O-N 2.82Å; S504-S508 PolarHBondContact O-OG 3.02Å
505	I	84.4	Confident	82.3	Confident	5 Å²	5	25.9 Å²	25.9	3%	0.026	13%	0.134	C	C	.	.	H	α-helix	trans	-64.2	-44.1	175.9	-65.8	165.6	0	0	0	110.6	R501 L502 V503 V507 S508 S509 I545 V548 A602	R501-I505 WeakPolarHBondContact O-CG1 3.43Å; R501-I505 PolarHBondContact O-N 3.45Å; L502-I505 PolarHBondContact O-N 3.43Å; V503-I505 VanDerWaalsContact C-N 3.32Å; V503-I505 PolarHBondContact O-N 2.86Å; I505-V507 PolarHBondContact O-N 3.47Å; I505-S508 WeakPolarHBondContact CA-OG 3.48Å; I505-S508 PolarHBondContact O-N 3Å; I505-S508 PolarHBondContact O-OG 2.9Å; I505-S509 PolarHBondContact O-N 2.99Å; I505-S509 PolarHBondContact O-OG 2.82Å; I505-I545 HydrophobicContact CD1-CB 3.63Å; I505-I545 HydrophobicContact CD1-CG2 3.55Å; I505-I545 WeakPolarHBondContact CD1-O 3.43Å; I505-V548 HydrophobicContact CB-CG2 4.41Å; I505-V548 HydrophobicContact CG2-CG2 4.19Å; I505-A602 HydrophobicContact CG2-CB 3.79Å
506	Y	83.8	Confident	82.3	Confident	3 Å²	3	27.8 Å²	27.8	1%	0.012	14%	0.143	C	C	.	.	H	α-helix	trans	-59.9	-43.9	174.4	-82.6	-47.9	0	0	0	113.6	L502 V503 S508 S509 H510 N513 M521 V548 Q550 R600 A602	L502-Y506 HydrophobicContact CD2-CD2 3.53Å; L502-Y506 HydrophobicContact CD2-CE2 3.31Å; L502-Y506 HydrophobicContact CG-CE2 4.36Å; L502-Y506 PolarHBondContact O-N 3.26Å; L502-Y506 VanDerWaalsContact O-N 3.11Å; V503-Y506 PolarHBondContact O-N 3.12Å; Y506-S508 PolarHBondContact O-N 3.39Å; Y506-S509 PolarHBondContact O-N 2.91Å; Y506-S509 PolarHBondContact O-OG 2.95Å; Y506-H510 PolarHBondContact O-CD2 3.3Å; Y506-H510 PolarHBondContact O-N 3.2Å; Y506-N513 PolarHBondContact O-ND2 2.94Å; Y506-N513 VanDerWaalsContact O-ND2 3.15Å; Y506-M521 HydrophobicContact CD2-CE 4.32Å; Y506-M521 HydrophobicContact CD2-SD 3.87Å; Y506-M521 HydrophobicContact CE2-CE 4.43Å; Y506-M521 HydrophobicContact CE2-SD 3.45Å; Y506-M521 WeakPolarHBondContact CE2-SD 3.38Å; Y506-V548 HydrophobicContact CE1-CB 4.21Å; Y506-V548 HydrophobicContact CE1-CG1 4.16Å; Y506-V548 HydrophobicContact CE2-CG1 3.83Å; Y506-V548 VanDerWaalsContact CZ-CG1 3.44Å; Y506-V548 WeakPolarHBondContact OH-CG1 3.4Å; Y506-Q550 WeakPolarHBondContact OH-CB 3.28Å; Y506-Q550 PolarHBondContact OH-N 3.33Å; Y506-R600 HydrophobicContact CD1-CB 4.33Å; Y506-R600 HydrophobicContact CE1-CB 3.78Å; Y506-A602 HydrophobicContact CD1-CB 3.51Å; Y506-A602 HydrophobicContact CE1-CB 3.81Å; Y506-A602 HydrophobicContact CG-CB 4.38Å
507	V	79.4	Confident	82.2	Confident	33 Å²	33	27.9 Å²	27.9	20%	0.2	14%	0.144	C	C	.	.	H	α-helix	trans	-63.8	-35.7	178.9	174.7	0	0	0	0	110.9	R416 A462 V503 S504 I505 N513	R416-V507 HydrophobicContact CB-CG1 4.31Å; A462-V507 HydrophobicContact CB-CB 4.32Å; A462-V507 HydrophobicContact CB-CG2 4.36Å; V503-V507 HydrophobicContact CG1-CG2 3.99Å; V503-V507 WeakPolarHBondContact O-CB 3.36Å; V503-V507 VanDerWaalsContact O-CG2 3.29Å; V503-V507 WeakPolarHBondContact O-CG2 3.31Å; V503-V507 PolarHBondContact O-N 3.25Å; S504-V507 PolarHBondContact O-N 2.84Å; I505-V507 PolarHBondContact O-N 3.47Å; V507-N513 VanDerWaalsContact CA-ND2 3.3Å; V507-N513 WeakPolarHBondContact CA-ND2 3.36Å; V507-N513 HydrophobicContact CG2-CB 4.46Å
508	S	76.4	Confident	82.2	Confident	15 Å²	15	26.5 Å²	26.5	11%	0.105	13%	0.132	C	C	.	.	H	α-helix	trans	-78.6	-25.1	-178.9	78.5	0	0	0	0	115	S417 S504 I505 Y506 P605	S417-S508 WeakPolarHBondContact CB-O 3.38Å; S504-S508 VanDerWaalsContact O-CB 3.3Å; S504-S508 WeakPolarHBondContact O-CB 3.4Å; S504-S508 PolarHBondContact O-N 2.82Å; S504-S508 PolarHBondContact O-OG 3.02Å; I505-S508 WeakPolarHBondContact CA-OG 3.48Å; I505-S508 PolarHBondContact O-N 3Å; I505-S508 PolarHBondContact O-OG 2.9Å; Y506-S508 PolarHBondContact O-N 3.39Å; S508-P605 VanDerWaalsContact CB-CG 3.47Å; S508-P605 VanDerWaalsContact OG-CD 3.31Å; S508-P605 WeakPolarHBondContact OG-CD 3.15Å; S508-P605 WeakPolarHBondContact OG-CG 3.42Å
509	S	75.8	Confident	82.2	Confident	26 Å²	26	26.5 Å²	26.5	18%	0.182	13%	0.132	C	C	.	.	H	α-helix	trans	-92.4	-32.3	-176.6	65.7	0	0	0	0	113.4	I505 Y506 A602	I505-S509 PolarHBondContact O-N 2.99Å; I505-S509 PolarHBondContact O-OG 2.82Å; Y506-S509 PolarHBondContact O-N 2.91Å; Y506-S509 PolarHBondContact O-OG 2.95Å; S509-A602 WeakPolarHBondContact OG-CA 3.18Å; S509-A602 WeakPolarHBondContact OG-CB 3.09Å
510	H	73.1	Confident	82.1	Confident	43 Å²	43	28.3 Å²	28.3	20%	0.199	14%	0.141	C	C	.	.	S	Bend	trans	-95.9	153.2	-173.5	-69.9	-77.7	0	0	0	113.4	S417 Y506 R600	S417-H510 PolarHBondContact OG-O 3.33Å; Y506-H510 PolarHBondContact O-CD2 3.3Å; Y506-H510 PolarHBondContact O-N 3.2Å; H510-R600 WeakPolarHBondContact NE2-CB 3.42Å
511	Y	63.8	Low	82.1	Confident	55 Å²	55	26.6 Å²	26.6	22%	0.216	13%	0.133	C	C	.	.	S	Bend	trans	-72.4	-32.1	178.4	-179.8	-94.1	0	0	0	112.8	I388 P389 G415 L418 L715 T716	I388-Y511 PolarHBondContact O-OH 3.39Å; P389-Y511 WeakPolarHBondContact CA-OH 3.5Å; G415-Y511 WeakPolarHBondContact CA-O 3.04Å; G415-Y511 PolarHBondContact N-O 3.48Å; G415-Y511 VanDerWaalsContact N-O 3.16Å; L418-Y511 HydrophobicContact CD1-CE2 4.43Å; L418-Y511 HydrophobicContact CD2-CE2 3.85Å; Y511-L715 WeakPolarHBondContact CE1-O 3.49Å; Y511-L715 PolarHBondContact OH-O 3.34Å; Y511-L715 VanDerWaalsContact OH-O 3.04Å; Y511-T716 HydrophobicContact CD1-CG2 3.46Å; Y511-T716 VanDerWaalsContact CD1-CG2 3.46Å; Y511-T716 HydrophobicContact CE1-CG2 3.62Å; Y511-T716 HydrophobicContact CG-CG2 4.06Å
512	K	70.4	Confident	82.2	Confident	81 Å²	81	22.7 Å²	22.7	35%	0.352	12%	0.118	S	C	.	.			trans	-148.3	126.9	-179.7	171.7	153.1	-166.1	172.9	0	109.2	E412 G413 L715	E412-K512 WeakPolarHBondContact O-CE 3.28Å; E412-K512 PolarHBondContact O-NZ 3.41Å; G413-K512 WeakPolarHBondContact O-CB 3.14Å; G413-K512 VanDerWaalsContact O-CD 3.28Å; G413-K512 WeakPolarHBondContact O-CD 3.41Å; G413-K512 WeakPolarHBondContact O-CG 3.28Å; K512-L715 HydrophobicContact CD-CD1 4.06Å
513	N	75.3	Confident	82.1	Confident	21 Å²	21	22.6 Å²	22.6	11%	0.112	12%	0.118	C	C	.	.			trans	-127.6	133	175.4	-66.1	-64.6	0	0	0	109	G413 Y506 V507 D517 R600	G413-N513 WeakPolarHBondContact CA-O 3.46Å; Y506-N513 PolarHBondContact O-ND2 2.94Å; Y506-N513 VanDerWaalsContact O-ND2 3.15Å; V507-N513 VanDerWaalsContact CA-ND2 3.3Å; V507-N513 WeakPolarHBondContact CA-ND2 3.36Å; V507-N513 HydrophobicContact CG2-CB 4.46Å; N513-D517 WeakPolarHBondContact CA-OD2 3.29Å; N513-R600 PolarHBondContact OD1-NH1 3.39Å
514	T	81.6	Confident	82.1	Confident	39 Å²	39	22 Å²	22	24%	0.239	11%	0.114	C	C	.	.			trans	-107.2	148.4	175	71.3	0	0	0	0	109.4	N516 D517	T514-N516 PolarHBondContact O-N 3.12Å; T514-N516 VanDerWaalsContact O-N 3.07Å; T514-D517 PolarHBondContact N-OD2 3.37Å; T514-D517 WeakPolarHBondContact O-CB 3.42Å; T514-D517 PolarHBondContact O-N 3.4Å; T514-D517 PolarHBondContact OG1-OD1 2.94Å
515	P	84.5	Confident	82.2	Confident	11 Å²	11	22.6 Å²	22.6	7%	0.071	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-21.7	174.3	-26.7	36.1	0	0	0	113.3	P128 Y411 L458 L460 D517 L518	P128-P515 HydrophobicContact CB-CB 3.91Å; Y411-P515 VanDerWaalsContact O-CD 3.28Å; Y411-P515 WeakPolarHBondContact O-CD 3.47Å; L458-P515 HydrophobicContact CD1-CB 4.33Å; L458-P515 HydrophobicContact CD2-CB 4.33Å; L460-P515 HydrophobicContact CD2-CG 4.38Å; P515-D517 PolarHBondContact O-N 3.25Å; P515-L518 VanDerWaalsContact O-CB 3.28Å; P515-L518 WeakPolarHBondContact O-CB 3.49Å; P515-L518 PolarHBondContact O-N 2.99Å; P515-L518 VanDerWaalsContact O-N 3.17Å
516	N	87.8	Confident	82.4	Confident	46 Å²	46	22.6 Å²	22.6	25%	0.246	12%	0.119	C	C	.	.	H	α-helix	trans	-64.8	-22.1	173.5	-66.5	-6.8	0	0	0	112.5	P128 N129 T514 L518 Q519 M520	P128-N516 WeakPolarHBondContact CD-OD1 3.3Å; N129-N516 WeakPolarHBondContact CB-OD1 3.25Å; N129-N516 PolarHBondContact N-OD1 3.04Å; T514-N516 PolarHBondContact O-N 3.12Å; T514-N516 VanDerWaalsContact O-N 3.07Å; N516-L518 PolarHBondContact O-N 2.92Å; N516-Q519 PolarHBondContact O-N 3.24Å; N516-M520 PolarHBondContact O-N 3.11Å
517	D	87.2	Confident	82.8	Confident	22 Å²	22	23 Å²	23	12%	0.118	12%	0.121	C	C	.	.	H	α-helix	trans	-63.2	-32.5	175.5	-56.8	-18.4	0	0	0	110.9	N513 T514 P515 M520 M521 R600	N513-D517 WeakPolarHBondContact CA-OD2 3.29Å; T514-D517 PolarHBondContact N-OD2 3.37Å; T514-D517 WeakPolarHBondContact O-CB 3.42Å; T514-D517 PolarHBondContact O-N 3.4Å; T514-D517 PolarHBondContact OG1-OD1 2.94Å; P515-D517 PolarHBondContact O-N 3.25Å; D517-M520 PolarHBondContact O-N 3.25Å; D517-M521 WeakPolarHBondContact O-CB 3.35Å; D517-M521 VanDerWaalsContact O-CG 3.28Å; D517-M521 WeakPolarHBondContact O-CG 3.44Å; D517-M521 PolarHBondContact O-N 3.4Å; D517-R600 IonicContact OD1-NH2 3.71Å; D517-R600 IonicContact OD2-CZ 2.64Å; D517-R600 VanDerWaalsContact OD2-CZ 3.27Å; D517-R600 IonicContact OD2-NH1 3.21Å; D517-R600 PolarHBondContact OD2-NH1 3.26Å; D517-R600 IonicContact OD2-NH2 3.85Å; D517-R600 PolarHBondContact OD2-NH2 3.43Å
518	L	88.9	Confident	83.4	Confident	8 Å²	8	22 Å²	22	4%	0.042	11%	0.114	C	C	.	.	H	α-helix	trans	-63	-43.9	175.8	-175.6	65.5	0	0	0	111.3	F180 R183 F489 L499 V503 P515 N516 M520 M521 S522	F180-L518 HydrophobicContact CE2-CD2 4.19Å; R183-L518 VanDerWaalsContact NH1-CD2 3.34Å; F489-L518 HydrophobicContact CE1-CD1 3.76Å; F489-L518 HydrophobicContact CE1-CG 4.39Å; F489-L518 HydrophobicContact CZ-CD1 4.15Å; L499-L518 HydrophobicContact CD1-CD1 4.21Å; V503-L518 HydrophobicContact CG2-CD1 4.13Å; P515-L518 VanDerWaalsContact O-CB 3.28Å; P515-L518 WeakPolarHBondContact O-CB 3.49Å; P515-L518 PolarHBondContact O-N 2.99Å; P515-L518 VanDerWaalsContact O-N 3.17Å; N516-L518 PolarHBondContact O-N 2.92Å; L518-M520 VanDerWaalsContact C-N 3.34Å; L518-M521 HydrophobicContact CD1-CE 4.11Å; L518-M521 PolarHBondContact O-N 3.12Å; L518-S522 WeakPolarHBondContact O-CB 3.46Å; L518-S522 PolarHBondContact O-N 2.98Å; L518-S522 PolarHBondContact O-OG 2.89Å
519	Q	88.9	Confident	84.2	Confident	1 Å²	1	21.3 Å²	21.3	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-66.6	-37.3	175.5	-173.5	-177.2	11.9	0	0	111.8	P128 M162 F168 F180 N516 S522 D523	P128-Q519 HydrophobicContact CG-CB 3.83Å; M162-Q519 PolarHBondContact SD-NE2 3.4Å; F168-Q519 HydrophobicContact CE2-CG 4.34Å; F180-Q519 HydrophobicContact CB-CG 4.24Å; F180-Q519 HydrophobicContact CG-CB 4.44Å; F180-Q519 HydrophobicContact CG-CG 4.3Å; N516-Q519 PolarHBondContact O-N 3.24Å; Q519-S522 WeakPolarHBondContact CA-OG 3.44Å; Q519-S522 PolarHBondContact O-N 3.46Å; Q519-S522 PolarHBondContact O-OG 3.11Å; Q519-D523 WeakPolarHBondContact O-CB 3.4Å; Q519-D523 PolarHBondContact O-N 3.32Å
520	M	87.7	Confident	85.1	Confident	40 Å²	40	20.1 Å²	20.1	20%	0.197	10%	0.1	C	C	.	.	H	α-helix	trans	-64.6	-42	173.6	-175.3	178.9	68.2	0	0	111.4	F168 N516 D517 L518 S522 A524	F168-M520 HydrophobicContact CD1-CG 4.38Å; F168-M520 HydrophobicContact CE1-CB 3.87Å; F168-M520 HydrophobicContact CE1-CG 3.75Å; F168-M520 HydrophobicContact CZ-CB 3.73Å; F168-M520 HydrophobicContact CZ-CG 4.11Å; N516-M520 PolarHBondContact O-N 3.11Å; D517-M520 PolarHBondContact O-N 3.25Å; L518-M520 VanDerWaalsContact C-N 3.34Å; M520-S522 VanDerWaalsContact C-N 3.3Å; M520-S522 PolarHBondContact O-N 2.92Å; M520-A524 HydrophobicContact CG-CB 4.35Å; M520-A524 WeakPolarHBondContact O-CB 3.32Å; M520-A524 PolarHBondContact O-N 3.2Å
521	M	89.1	Confident	86.2	Confident	7 Å²	7	18 Å²	18	3%	0.034	9%	0.091	C	C	.	.	H	α-helix	trans	-65.1	-33.3	176.7	-74.4	-174.4	-60.5	0	0	112.8	R485 Y506 D517 L518 L529 Q550	R485-M521 WeakPolarHBondContact CD-O 3.48Å; Y506-M521 HydrophobicContact CD2-CE 4.32Å; Y506-M521 HydrophobicContact CD2-SD 3.87Å; Y506-M521 HydrophobicContact CE2-CE 4.43Å; Y506-M521 HydrophobicContact CE2-SD 3.45Å; Y506-M521 WeakPolarHBondContact CE2-SD 3.38Å; D517-M521 WeakPolarHBondContact O-CB 3.35Å; D517-M521 VanDerWaalsContact O-CG 3.28Å; D517-M521 WeakPolarHBondContact O-CG 3.44Å; D517-M521 PolarHBondContact O-N 3.4Å; L518-M521 HydrophobicContact CD1-CE 4.11Å; L518-M521 PolarHBondContact O-N 3.12Å; M521-L529 HydrophobicContact SD-CD2 4.42Å; M521-Q550 VanDerWaalsContact CG-NE2 3.34Å
522	S	88.3	Confident	87.6	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-81.5	-49.5	-178.3	68.4	0	0	0	0	113	R179 F180 F489 L518 Q519 M520	R179-S522 WeakPolarHBondContact CD-O 3.49Å; R179-S522 PolarHBondContact NH1-O 3.36Å; F180-S522 WeakPolarHBondContact CB-OG 3.22Å; F489-S522 VanDerWaalsContact CE2-CA 3.42Å; L518-S522 WeakPolarHBondContact O-CB 3.46Å; L518-S522 PolarHBondContact O-N 2.98Å; L518-S522 PolarHBondContact O-OG 2.89Å; Q519-S522 WeakPolarHBondContact CA-OG 3.44Å; Q519-S522 PolarHBondContact O-N 3.46Å; Q519-S522 PolarHBondContact O-OG 3.11Å; M520-S522 VanDerWaalsContact C-N 3.3Å; M520-S522 PolarHBondContact O-N 2.92Å
523	D	87.4	Confident	88.5	Confident	0 Å²	0	11.7 Å²	11.7	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-97.9	-31.5	-162.7	-62.6	-3.5	0	0	0	112.6	H165 F168 V176 T177 R179 F180 Q519 P525	H165-D523 IonicContact CD2-OD2 2.71Å; H165-D523 IonicContact CE1-OD2 3.07Å; H165-D523 IonicContact NE2-OD2 2.73Å; H165-D523 PolarHBondContact NE2-OD2 2.87Å; F168-D523 HydrophobicContact CD2-CB 4.27Å; F168-D523 HydrophobicContact CE2-CB 4.31Å; V176-D523 HydrophobicContact CG1-CB 4.23Å; T177-D523 WeakPolarHBondContact O-CA 3.36Å; R179-D523 PolarHBondContact N-OD1 3.41Å; R179-D523 VanDerWaalsContact N-OD1 3.11Å; F180-D523 PolarHBondContact N-OD1 2.93Å; Q519-D523 WeakPolarHBondContact O-CB 3.4Å; Q519-D523 PolarHBondContact O-N 3.32Å; D523-P525 WeakPolarHBondContact O-CD 3.47Å
524	A	86.9	Confident	89	Confident	1 Å²	1	11.4 Å²	11.4	1%	0.008	7%	0.066	C	C	.	.			trans	-71.3	116.5	-170.4	0	0	0	0	0	111.4	F168 R485 M520 A526 H527	F168-A524 HydrophobicContact CB-CB 3.77Å; F168-A524 HydrophobicContact CD1-CB 4.05Å; F168-A524 HydrophobicContact CD2-CB 4Å; F168-A524 HydrophobicContact CG-CB 3.7Å; R485-A524 PolarHBondContact NH1-O 2.98Å; M520-A524 HydrophobicContact CG-CB 4.35Å; M520-A524 WeakPolarHBondContact O-CB 3.32Å; M520-A524 PolarHBondContact O-N 3.2Å; A524-A526 PolarHBondContact O-N 3.27Å; A524-H527 WeakPolarHBondContact CB-CD2 3.46Å; A524-H527 PolarHBondContact O-N 3.34Å; A524-H527 VanDerWaalsContact O-N 3.16Å
525	P	85.4	Confident	88.9	Confident	17 Å²	17	12.5 Å²	12.5	11%	0.11	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-39.1	-166.3	22.5	-33.5	0	0	0	113.1	H173 T175 V176 R485 D523 H527	H173-P525 HydrophobicContact CB-CB 4.07Å; H173-P525 HydrophobicContact CB-CG 3.72Å; T175-P525 WeakPolarHBondContact O-CB 3.47Å; T175-P525 WeakPolarHBondContact O-CG 3.45Å; V176-P525 HydrophobicContact CG2-CG 4.43Å; R485-P525 PolarHBondContact NH2-O 3.07Å; D523-P525 WeakPolarHBondContact O-CD 3.47Å; P525-H527 PolarHBondContact O-N 3.03Å; P525-H527 VanDerWaalsContact O-N 3.15Å
526	A	88.9	Confident	88.4	Confident	5 Å²	5	16.2 Å²	16.2	4%	0.041	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-11.9	-179.1	0	0	0	0	0	114.5	A524 A552 L553	A524-A526 PolarHBondContact O-N 3.27Å; A526-A552 CarbonylContact O-C 3.59Å; A526-A552 VanDerWaalsContact O-CA 3.3Å; A526-A552 WeakPolarHBondContact O-CA 3.35Å; A526-L553 HydrophobicContact CB-CB 4.32Å; A526-L553 WeakPolarHBondContact CB-O 3.24Å; A526-L553 PolarHBondContact O-N 3.17Å
527	H	91.2	Very high	87.3	Confident	13 Å²	13	20.8 Å²	20.8	6%	0.06	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	138.6	-177.8	-74.1	-100.2	0	0	0	112.7	R485 A524 P525 Q550 V551	R485-H527 PolarHBondContact NE-O 3.09Å; R485-H527 PolarHBondContact NH1-O 2.93Å; R485-H527 PolarHBondContact NH2-O 3.37Å; R485-H527 VanDerWaalsContact NH2-O 3.13Å; A524-H527 WeakPolarHBondContact CB-CD2 3.46Å; A524-H527 PolarHBondContact O-N 3.34Å; A524-H527 VanDerWaalsContact O-N 3.16Å; P525-H527 PolarHBondContact O-N 3.03Å; P525-H527 VanDerWaalsContact O-N 3.15Å; H527-Q550 PolarHBondContact ND1-NE2 2.68Å; H527-V551 CarbonylContact C-O 3.54Å; H527-V551 VanDerWaalsContact CA-O 3.25Å; H527-V551 WeakPolarHBondContact CA-O 3.39Å
528	H	92.3	Very high	86.3	Confident	11 Å²	11	29 Å²	29	5%	0.051	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	150.2	170.2	-62.7	-52	0	0	0	111	Y482 F530 V551 E679	Y482-H528 HydrophobicContact CE2-CB 3.94Å; Y482-H528 AromaticContact CE2-CG 3.96Å; Y482-H528 AromaticContact CE2-ND1 3.84Å; Y482-H528 AromaticContact CZ-ND1 3.9Å; Y482-H528 PolarHBondContact OH-ND1 3.34Å; H528-F530 HydrophobicContact CB-CE2 4.04Å; H528-V551 HydrophobicContact CB-CG2 3.66Å; H528-V551 PolarHBondContact N-O 3.02Å; H528-V551 PolarHBondContact O-N 3.44Å; H528-E679 IonicContact NE2-OE1 2.73Å
529	L	94.4	Very high	85.1	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	131	-178.7	-66.3	177	0	0	0	109.5	V483 R485 L488 M521 Q550	V483-L529 HydrophobicContact CB-CB 4.06Å; V483-L529 PolarHBondContact N-O 3.3Å; R485-L529 HydrophobicContact CG-CD1 4.37Å; L488-L529 HydrophobicContact CD2-CD1 3.94Å; M521-L529 HydrophobicContact SD-CD2 4.42Å; L529-Q550 HydrophobicContact CD2-CB 4.09Å; L529-Q550 HydrophobicContact CD2-CG 3.98Å
530	F	94.9	Very high	83.9	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	141.2	173.6	-60.6	-91.2	0	0	0	109.8	L480 Y481 Y482 H528 V548 I549 V551 L620 Y623 L673	L480-F530 HydrophobicContact CD1-CB 3.9Å; L480-F530 HydrophobicContact CD2-CB 4.31Å; L480-F530 HydrophobicContact CD2-CD1 4.39Å; L480-F530 HydrophobicContact CG-CB 4.13Å; L480-F530 HydrophobicContact CG-CD1 4.47Å; Y481-F530 CarbonylContact O-C 3.56Å; Y481-F530 VanDerWaalsContact O-CA 3.24Å; Y481-F530 WeakPolarHBondContact O-CA 3.05Å; Y482-F530 HydrophobicContact CD2-CD1 4.18Å; Y482-F530 AromaticContact CD2-CE1 3.65Å; Y482-F530 HydrophobicContact CD2-CE1 3.65Å; Y482-F530 AromaticContact CD2-CZ 3.9Å; Y482-F530 HydrophobicContact CD2-CZ 3.9Å; Y482-F530 HydrophobicContact CE2-CZ 4.41Å; Y482-F530 HydrophobicContact CG-CE1 4.46Å; H528-F530 HydrophobicContact CB-CE2 4.04Å; F530-V548 CarbonylContact O-C 3.6Å; F530-V548 WeakPolarHBondContact O-CA 3.46Å; F530-I549 HydrophobicContact CB-CB 4.3Å; F530-I549 PolarHBondContact N-O 3.15Å; F530-I549 PolarHBondContact O-N 3.22Å; F530-V551 HydrophobicContact CD2-CG1 4.41Å; F530-V551 HydrophobicContact CD2-CG2 4.27Å; F530-V551 HydrophobicContact CE2-CG1 4.38Å; F530-V551 HydrophobicContact CE2-CG2 3.69Å; F530-L620 HydrophobicContact CD2-CD1 3.7Å; F530-L620 HydrophobicContact CE2-CD1 3.83Å; F530-L620 HydrophobicContact CG-CD1 4.06Å; F530-L620 HydrophobicContact CZ-CD1 4.28Å; F530-Y623 HydrophobicContact CE1-CD1 4.32Å; F530-Y623 HydrophobicContact CE1-CE1 4.11Å; F530-Y623 HydrophobicContact CZ-CD1 4.3Å; F530-Y623 HydrophobicContact CZ-CE1 4Å; F530-L673 HydrophobicContact CD1-CD2 3.88Å; F530-L673 HydrophobicContact CE1-CD2 3.64Å
531	C	94.2	Very high	83.1	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	128.1	176.9	-69.7	0	0	0	0	110.3	Y481 V483 L533 I545 V547	Y481-C531 PolarHBondContact N-O 3.49Å; Y481-C531 PolarHBondContact O-N 3.42Å; V483-C531 HydrophobicContact CG2-CB 4.12Å; V483-C531 VanDerWaalsContact CG2-SG 3.56Å; C531-L533 HydrophobicContact CB-CD2 4.15Å; C531-I545 HydrophobicContact CB-CG2 4.44Å; C531-V547 CarbonylContact C-O 3.46Å; C531-V547 WeakPolarHBondContact CA-O 3.4Å
532	L	93.2	Very high	82.4	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	118.6	168.2	-168.7	81.1	0	0	0	108	C478 E479 L480 L546 V547 Y612 R615 A616 L619	C478-L532 HydrophobicContact CB-CD1 4.04Å; C478-L532 HydrophobicContact CB-CD2 3.99Å; C478-L532 HydrophobicContact CB-CG 3.91Å; E479-L532 WeakPolarHBondContact O-CA 3.46Å; E479-L532 WeakPolarHBondContact O-CD1 3.43Å; L480-L532 HydrophobicContact CB-CD1 4.24Å; L480-L532 HydrophobicContact CD1-CB 4.2Å; L480-L532 HydrophobicContact CD1-CD1 4.4Å; L532-L546 PolarHBondContact O-N 3.47Å; L532-V547 HydrophobicContact CB-CB 3.77Å; L532-V547 HydrophobicContact CB-CG2 4.24Å; L532-V547 HydrophobicContact CD2-CB 4.35Å; L532-V547 HydrophobicContact CD2-CG2 3.9Å; L532-V547 PolarHBondContact N-O 3.15Å; L532-V547 PolarHBondContact O-N 3.19Å; L532-Y612 HydrophobicContact CD2-CD1 4.11Å; L532-R615 HydrophobicContact CD1-CG 4.44Å; L532-A616 HydrophobicContact CB-CB 4.32Å; L532-A616 HydrophobicContact CD1-CB 4.36Å; L532-A616 HydrophobicContact CD2-CB 4.34Å; L532-L619 HydrophobicContact CD1-CD1 4Å
533	L	90.6	Very high	81.9	Confident	3 Å²	3	50 Å²	50	2%	0.016	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	146.5	-178.9	-56.9	179.6	0	0	0	109.7	C478 E479 Y481 C531 P543 I545 L670	C478-L533 WeakPolarHBondContact CB-O 3.18Å; E479-L533 PolarHBondContact N-O 2.86Å; E479-L533 PolarHBondContact O-N 2.9Å; Y481-L533 HydrophobicContact CD2-CB 4.09Å; Y481-L533 HydrophobicContact CD2-CD1 3.66Å; Y481-L533 HydrophobicContact CD2-CG 3.92Å; Y481-L533 HydrophobicContact CE2-CB 4.24Å; Y481-L533 HydrophobicContact CE2-CD1 4.16Å; Y481-L533 HydrophobicContact CE2-CG 4.5Å; Y481-L533 HydrophobicContact CG-CD1 3.98Å; C531-L533 HydrophobicContact CB-CD2 4.15Å; L533-P543 HydrophobicContact CD1-CB 4.02Å; L533-P543 HydrophobicContact CD1-CG 3.95Å; L533-P543 HydrophobicContact CD2-CB 4.32Å; L533-I545 HydrophobicContact CD2-CB 4.37Å; L533-I545 HydrophobicContact CD2-CG1 3.93Å; L533-L670 HydrophobicContact CD1-CD1 3.62Å; L533-L670 HydrophobicContact CD1-CD2 4.36Å
534	G	85.1	Confident	81.6	Confident	14 Å²	14	52.4 Å²	52.4	14%	0.144	28%	0.275	C	S	.	.			trans	-67.9	164.5	165.5	0	0	0	0	0	111.2	V536	G534-V536 PolarHBondContact O-N 3.41Å
535	P	80.9	Confident	81.6	Confident	63 Å²	63	52.7 Å²	52.7	41%	0.409	28%	0.277	S	S	.	.			trans	-58.1	131.9	176	24.9	-33.3	0	0	0	110.3	P473 Q537	P473-P535 HydrophobicContact CB-CG 4.23Å; P535-Q537 PolarHBondContact O-N 2.92Å
536	V	72.6	Confident	81.8	Confident	89 Å²	89	52 Å²	52	54%	0.539	27%	0.272	S	S	.	.			trans	-72.3	100.4	-176.8	-176.8	0	0	0	0	109.3	G534	G534-V536 PolarHBondContact O-N 3.41Å
537	Q	65.9	Low	81.9	Confident	142 Å²	142	51.8 Å²	51.8	66%	0.664	27%	0.27	S	S	*	.			trans	-82.1	-28.9	-179.7	-65.5	179.7	6.2	0	0	113.2	P535	P535-Q537 PolarHBondContact O-N 2.92Å
538	R	64.9	Low	82.1	Confident	195 Å²	195	51.2 Å²	51.2	74%	0.736	27%	0.267	S	S	*	.			trans	-134.4	128.8	179.2	-66.4	-175.6	-176.9	171.8	1.5	110.1	D540 A541	R538-D540 VanDerWaalsContact C-N 3.3Å; R538-D540 PolarHBondContact O-N 3.24Å; R538-A541 HydrophobicContact CB-CB 4.21Å
539	M	64.4	Low	82.2	Confident	189 Å²	189	50.7 Å²	50.7	93%	0.931	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-26.3	178.3	-74.4	-177.8	158.8	0	0	113.2
540	D	64.3	Low	82.2	Confident	170 Å²	170	50.6 Å²	50.6	91%	0.909	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-8	-177.6	-61.1	-32.5	0	0	0	114.2	R538	R538-D540 VanDerWaalsContact C-N 3.3Å; R538-D540 PolarHBondContact O-N 3.24Å
541	A	70.6	Confident	82.2	Confident	55 Å²	55	50.6 Å²	50.6	46%	0.455	27%	0.265	S	S	.	.	S	Bend	trans	-105.6	139.1	-177.6	0	0	0	0	0	111.4	R538	R538-A541 HydrophobicContact CB-CB 4.21Å
542	L	74.5	Confident	82.1	Confident	54 Å²	54	50.7 Å²	50.7	28%	0.283	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-59.5	127	171.2	-79.1	165.8	0	0	0	109.9	A494 A497 R501	A494-L542 HydrophobicContact CB-CD2 4.47Å; A497-L542 HydrophobicContact CB-CD1 3.65Å; R501-L542 PolarHBondContact NH1-O 3.1Å; R501-L542 VanDerWaalsContact NH1-O 3.07Å
543	P	78.1	Confident	82.1	Confident	29 Å²	29	51.3 Å²	51.3	19%	0.188	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-61.2	147.5	-178	25.3	-33.4	0	0	0	110.9	R501 L533 L670	R501-P543 PolarHBondContact NH1-O 2.88Å; L533-P543 HydrophobicContact CD1-CB 4.02Å; L533-P543 HydrophobicContact CD1-CG 3.95Å; L533-P543 HydrophobicContact CD2-CB 4.32Å; P543-L670 HydrophobicContact CG-CD1 3.98Å
544	E	79.4	Confident	82	Confident	49 Å²	49	51.4 Å²	51.4	23%	0.229	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-80.8	126	179.3	-67.1	177.2	159.8	0	0	109.7	I468 S470	I468-E544 HydrophobicContact CD1-CB 4.18Å; I468-E544 HydrophobicContact CG1-CB 4.42Å; I468-E544 HydrophobicContact CG1-CG 4.32Å; I468-E544 WeakPolarHBondContact CG2-OE2 3.33Å; S470-E544 PolarHBondContact OG-OE2 3.2Å
545	I	87.9	Confident	82.1	Confident	7 Å²	7	50.8 Å²	50.8	4%	0.036	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	116.2	-179.4	-56.5	167.7	0	0	0	108.2	F498 R501 L502 I505 C531 L533 V548	F498-I545 HydrophobicContact CD1-CD1 4.42Å; F498-I545 HydrophobicContact CD2-CD1 3.89Å; F498-I545 HydrophobicContact CD2-CG1 4.36Å; F498-I545 HydrophobicContact CE1-CD1 4.11Å; F498-I545 HydrophobicContact CE2-CD1 3.52Å; F498-I545 HydrophobicContact CE2-CG1 3.66Å; F498-I545 HydrophobicContact CG-CD1 4.33Å; F498-I545 HydrophobicContact CZ-CD1 3.64Å; F498-I545 HydrophobicContact CZ-CG1 3.96Å; R501-I545 HydrophobicContact CB-CD1 3.95Å; L502-I545 HydrophobicContact CB-CD1 4.06Å; I505-I545 HydrophobicContact CD1-CB 3.63Å; I505-I545 HydrophobicContact CD1-CG2 3.55Å; I505-I545 WeakPolarHBondContact CD1-O 3.43Å; C531-I545 HydrophobicContact CB-CG2 4.44Å; L533-I545 HydrophobicContact CD2-CB 4.37Å; L533-I545 HydrophobicContact CD2-CG1 3.93Å; I545-V548 HydrophobicContact CG2-CG2 3.44Å; I545-V548 VanDerWaalsContact CG2-CG2 3.44Å
546	L	89.4	Confident	82.4	Confident	3 Å²	3	53.2 Å²	53.2	2%	0.016	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-44	179.8	-62.4	174	0	0	0	111.8	I468 P473 L532 H604 Y607 Y612	I468-L546 HydrophobicContact CD1-CD2 3.73Å; P473-L546 HydrophobicContact CG-CD1 4.06Å; L532-L546 PolarHBondContact O-N 3.47Å; L546-H604 WeakPolarHBondContact O-CB 3.3Å; L546-H604 PolarHBondContact O-N 3.13Å; L546-Y607 HydrophobicContact CD2-CD2 4.38Å; L546-Y612 HydrophobicContact CD1-CD1 4.08Å; L546-Y612 HydrophobicContact CD1-CE1 3.8Å
547	V	92.2	Very high	82.8	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.006	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	138.5	-180	-172.8	0	0	0	0	109.7	C531 L532 I549 V601 A602 T603 A616	C531-V547 CarbonylContact C-O 3.46Å; C531-V547 WeakPolarHBondContact CA-O 3.4Å; L532-V547 HydrophobicContact CB-CB 3.77Å; L532-V547 HydrophobicContact CB-CG2 4.24Å; L532-V547 HydrophobicContact CD2-CB 4.35Å; L532-V547 HydrophobicContact CD2-CG2 3.9Å; L532-V547 PolarHBondContact N-O 3.15Å; L532-V547 PolarHBondContact O-N 3.19Å; V547-I549 HydrophobicContact CG1-CG1 4.29Å; V547-V601 HydrophobicContact CG1-CG1 4.15Å; V547-A602 CarbonylContact C-O 3.59Å; V547-A602 VanDerWaalsContact CA-O 3.25Å; V547-A602 WeakPolarHBondContact CA-O 3.18Å; V547-A602 WeakPolarHBondContact CG1-O 3.42Å; V547-T603 HydrophobicContact CG1-CG2 4.09Å; V547-T603 HydrophobicContact CG2-CG2 3.98Å; V547-A616 HydrophobicContact CB-CB 4.26Å; V547-A616 HydrophobicContact CG1-CB 4Å
548	V	93.6	Very high	83.6	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	133.3	170.9	-164.9	0	0	0	0	108.9	L502 I505 Y506 F530 I545 A602	L502-V548 HydrophobicContact CD1-CG1 4.25Å; L502-V548 HydrophobicContact CD2-CG1 4.27Å; L502-V548 HydrophobicContact CG-CG1 3.94Å; L502-V548 HydrophobicContact CG-CG2 4.16Å; I505-V548 HydrophobicContact CB-CG2 4.41Å; I505-V548 HydrophobicContact CG2-CG2 4.19Å; Y506-V548 HydrophobicContact CE1-CB 4.21Å; Y506-V548 HydrophobicContact CE1-CG1 4.16Å; Y506-V548 HydrophobicContact CE2-CG1 3.83Å; Y506-V548 VanDerWaalsContact CZ-CG1 3.44Å; Y506-V548 WeakPolarHBondContact OH-CG1 3.4Å; F530-V548 CarbonylContact O-C 3.6Å; F530-V548 WeakPolarHBondContact O-CA 3.46Å; I545-V548 HydrophobicContact CG2-CG2 3.44Å; I545-V548 VanDerWaalsContact CG2-CG2 3.44Å; V548-A602 HydrophobicContact CB-CB 4.39Å; V548-A602 PolarHBondContact N-O 3.23Å; V548-A602 PolarHBondContact O-N 3.07Å
549	I	95.3	Very high	84.3	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	125.7	175	-56.6	175.6	0	0	0	108.5	F530 V547 V551 I598 R600 V601 A616 I617 L620	F530-I549 HydrophobicContact CB-CB 4.3Å; F530-I549 PolarHBondContact N-O 3.15Å; F530-I549 PolarHBondContact O-N 3.22Å; V547-I549 HydrophobicContact CG1-CG1 4.29Å; I549-V551 HydrophobicContact CG2-CG1 3.78Å; I549-I598 HydrophobicContact CG2-CG2 4.09Å; I549-R600 WeakPolarHBondContact CA-O 3.45Å; I549-V601 HydrophobicContact CG1-CG1 4.45Å; I549-A616 HydrophobicContact CD1-CB 3.66Å; I549-A616 HydrophobicContact CG1-CB 4.49Å; I549-I617 HydrophobicContact CD1-CD1 4.09Å; I549-L620 HydrophobicContact CG2-CD1 4.45Å
550	Q	94.6	Very high	85.1	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	124.2	167.4	-171.3	-178.7	11.3	0	0	108.8	Y506 M521 H527 L529 V599 R600	Y506-Q550 WeakPolarHBondContact OH-CB 3.28Å; Y506-Q550 PolarHBondContact OH-N 3.33Å; M521-Q550 VanDerWaalsContact CG-NE2 3.34Å; H527-Q550 PolarHBondContact ND1-NE2 2.68Å; L529-Q550 HydrophobicContact CD2-CB 4.09Å; L529-Q550 HydrophobicContact CD2-CG 3.98Å; Q550-V599 HydrophobicContact CB-CB 4.41Å; Q550-V599 HydrophobicContact CG-CB 4.24Å; Q550-V599 PolarHBondContact O-N 3.33Å; Q550-R600 HydrophobicContact CB-CB 4.01Å; Q550-R600 PolarHBondContact N-O 3.1Å; Q550-R600 PolarHBondContact O-N 2.86Å
551	V	94.3	Very high	85.8	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	156.9	172.2	-52.5	0	0	0	0	110.6	H527 H528 F530 I549 V596 R597 I598 L620	H527-V551 CarbonylContact C-O 3.54Å; H527-V551 VanDerWaalsContact CA-O 3.25Å; H527-V551 WeakPolarHBondContact CA-O 3.39Å; H528-V551 HydrophobicContact CB-CG2 3.66Å; H528-V551 PolarHBondContact N-O 3.02Å; H528-V551 PolarHBondContact O-N 3.44Å; F530-V551 HydrophobicContact CD2-CG1 4.41Å; F530-V551 HydrophobicContact CD2-CG2 4.27Å; F530-V551 HydrophobicContact CE2-CG1 4.38Å; F530-V551 HydrophobicContact CE2-CG2 3.69Å; I549-V551 HydrophobicContact CG2-CG1 3.78Å; V551-V596 HydrophobicContact CB-CG1 3.6Å; V551-V596 HydrophobicContact CG1-CG1 4.05Å; V551-V596 HydrophobicContact CG2-CG1 4.04Å; V551-R597 CarbonylContact C-O 3.37Å; V551-R597 VanDerWaalsContact CA-O 3.3Å; V551-R597 WeakPolarHBondContact CA-O 3.43Å; V551-I598 HydrophobicContact CG1-CG1 4.26Å; V551-L620 HydrophobicContact CG1-CD1 4.25Å; V551-L620 HydrophobicContact CG1-CD2 4.23Å
552	A	93.1	Very high	86.2	Confident	2 Å²	2	27.9 Å²	27.9	2%	0.017	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	130.4	172.3	0	0	0	0	0	109.1	A526 V596 R597 V599	A526-A552 CarbonylContact O-C 3.59Å; A526-A552 VanDerWaalsContact O-CA 3.3Å; A526-A552 WeakPolarHBondContact O-CA 3.35Å; A552-V596 CarbonylContact O-C 3.6Å; A552-R597 PolarHBondContact N-O 3.36Å; A552-R597 PolarHBondContact O-N 3.35Å; A552-V599 HydrophobicContact CB-CG2 3.66Å
553	L	91.7	Very high	86.4	Confident	12 Å²	12	28.2 Å²	28.2	6%	0.063	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	127.7	170.2	-55.3	-177.5	0	0	0	108.9	A526 V596 E679	A526-L553 HydrophobicContact CB-CB 4.32Å; A526-L553 WeakPolarHBondContact CB-O 3.24Å; A526-L553 PolarHBondContact O-N 3.17Å; L553-V596 HydrophobicContact CD2-CG2 3.64Å; L553-E679 HydrophobicContact CD1-CG 4.04Å
554	E	90.3	Very high	86.4	Confident	5 Å²	5	31.1 Å²	31.1	2%	0.023	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	153.6	179.1	-64.5	-165.5	153.8	0	0	110.4	D575 L576 I577 P578 G595 R597	E554-D575 WeakPolarHBondContact CA-OD1 3.4Å; E554-L576 PolarHBondContact OE1-N 3.27Å; E554-L576 PolarHBondContact OE2-N 3.02Å; E554-I577 WeakPolarHBondContact OE2-CB 3.48Å; E554-I577 WeakPolarHBondContact OE2-CG1 3.23Å; E554-I577 PolarHBondContact OE2-N 2.97Å; E554-P578 HydrophobicContact CB-CG 4.21Å; E554-P578 WeakPolarHBondContact OE2-CD 3.5Å; E554-G595 PolarHBondContact N-O 2.79Å; E554-G595 WeakPolarHBondContact O-CA 3.46Å; E554-G595 PolarHBondContact O-N 3.04Å; E554-G595 VanDerWaalsContact O-O 3.08Å; E554-R597 HydrophobicContact CG-CB 4.12Å; E554-R597 WeakPolarHBondContact OE1-CD 3.46Å; E554-R597 IonicContact OE1-CZ 3.44Å; E554-R597 IonicContact OE1-NE 3.66Å; E554-R597 PolarHBondContact OE1-NE 3.43Å; E554-R597 IonicContact OE1-NH1 2.77Å; E554-R597 PolarHBondContact OE1-NH1 2.98Å; E554-R597 VanDerWaalsContact OE1-NH1 3.13Å; E554-R597 IonicContact OE1-NH2 3.84Å; E554-R597 PolarHBondContact OE1-NH2 2.85Å
555	G	86	Confident	86	Confident	2 Å²	2	29.7 Å²	29.7	2%	0.021	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	101.5	-156.2	174.3	0	0	0	0	0	114.4	I557 D575 L593	G555-I557 PolarHBondContact O-N 3.21Å; G555-D575 PolarHBondContact N-OD1 2.78Å; G555-D575 VanDerWaalsContact N-OD1 3.17Å; G555-L593 WeakPolarHBondContact CA-O 3.49Å
556	Q	86.9	Confident	85.3	Confident	114 Å²	114	33.8 Å²	33.8	53%	0.533	19%	0.192	S	C	.	.			trans	55.3	38.5	-166.6	-60.3	-178.3	-15.6	0	0	113.1	A172 P591 L593 C594	A172-Q556 HydrophobicContact CB-CB 4.43Å; Q556-P591 PolarHBondContact N-O 2.82Å; Q556-L593 PolarHBondContact N-O 3.37Å; Q556-C594 HydrophobicContact CG-CB 3.99Å
557	I	82.4	Confident	84.3	Confident	7 Å²	7	36.9 Å²	36.9	4%	0.036	23%	0.226	C	C	.	.			trans	-79.6	137.2	-178.1	-59.1	171.2	0	0	0	109.4	E171 G555 I562 D575 P578 W579 P591	E171-I557 WeakPolarHBondContact OE2-CA 3.15Å; E171-I557 WeakPolarHBondContact OE2-CG2 3.39Å; G555-I557 PolarHBondContact O-N 3.21Å; I557-I562 HydrophobicContact CB-CD1 4.49Å; I557-I562 HydrophobicContact CB-CG1 4.34Å; I557-I562 HydrophobicContact CG2-CD1 4.37Å; I557-I562 HydrophobicContact CG2-CG1 3.74Å; I557-D575 HydrophobicContact CD1-CB 4.08Å; I557-P578 HydrophobicContact CD1-CB 3.78Å; I557-P578 HydrophobicContact CD1-CG 4.37Å; I557-W579 HydrophobicContact CD1-CZ2 4.26Å; I557-W579 HydrophobicContact CG2-CH2 4.44Å; I557-W579 HydrophobicContact CG2-CZ2 4.46Å; I557-P591 HydrophobicContact CB-CB 4.32Å; I557-P591 HydrophobicContact CD1-CB 4.14Å; I557-P591 PolarHBondContact N-O 3.24Å; I557-P591 VanDerWaalsContact N-O 3.15Å
558	S	82.3	Confident	83.1	Confident	42 Å²	42	45.7 Å²	45.7	29%	0.294	26%	0.259	S	S	.	.			trans	-70.7	149.4	-179.9	73	0	0	0	0	112.3	E171 Q560 S561 I562	E171-S558 WeakPolarHBondContact OE1-CB 3.28Å; E171-S558 PolarHBondContact OE1-OG 2.88Å; E171-S558 PolarHBondContact OE2-N 2.83Å; S558-Q560 PolarHBondContact O-N 3.09Å; S558-S561 PolarHBondContact O-N 3.08Å; S558-S561 PolarHBondContact OG-N 3.1Å; S558-S561 PolarHBondContact OG-OG 3.23Å; S558-I562 WeakPolarHBondContact O-CG1 3.29Å; S558-I562 PolarHBondContact O-N 2.57Å; S558-I562 VanDerWaalsContact O-N 3.12Å
559	A	79.9	Confident	81.8	Confident	59 Å²	59	48.7 Å²	48.7	49%	0.488	29%	0.289	S	S	.	.	H	α-helix	trans	-61.2	-26.9	-179.8	0	0	0	0	0	113.5	S563	A559-S563 PolarHBondContact O-N 2.98Å; A559-S563 VanDerWaalsContact O-N 3.17Å; A559-S563 PolarHBondContact O-OG 3.01Å
560	Q	81.3	Confident	80.1	Confident	155 Å²	155	56.1 Å²	56.1	72%	0.724	32%	0.322	S	S	*	.	H	α-helix	trans	-69.4	-50.1	176.3	-67.6	178.6	-2.6	0	0	110.5	S558 I562 S563 D564	S558-Q560 PolarHBondContact O-N 3.09Å; Q560-I562 VanDerWaalsContact C-N 3.3Å; Q560-I562 PolarHBondContact O-N 3.14Å; Q560-S563 PolarHBondContact O-N 2.88Å; Q560-S563 VanDerWaalsContact O-N 3.14Å; Q560-D564 PolarHBondContact O-N 3.02Å
561	S	79.3	Confident	78.7	Confident	38 Å²	38	61.7 Å²	61.7	27%	0.266	35%	0.346	S	S	.	.	H	α-helix	trans	-56.6	-43.5	175.9	-65.4	0	0	0	0	111.9	E171 S558 S563 D564 S565	E171-S561 PolarHBondContact OE1-OG 2.87Å; E171-S561 PolarHBondContact OE2-OG 3.04Å; S558-S561 PolarHBondContact O-N 3.08Å; S558-S561 PolarHBondContact OG-N 3.1Å; S558-S561 PolarHBondContact OG-OG 3.23Å; S561-S563 PolarHBondContact O-N 3.32Å; S561-D564 PolarHBondContact O-N 3.4Å; S561-S565 VanDerWaalsContact O-CB 3.24Å; S561-S565 WeakPolarHBondContact O-CB 3.43Å; S561-S565 PolarHBondContact O-N 3.24Å; S561-S565 PolarHBondContact O-OG 2.81Å; S561-S565 VanDerWaalsContact O-OG 3.14Å
562	I	78.8	Confident	77.2	Confident	7 Å²	7	64.4 Å²	64.4	4%	0.036	37%	0.369	C	S	.	.	H	α-helix	trans	-61	-45.1	177.7	-62.9	166	0	0	0	111.1	I557 S558 Q560 L566 R588 P591 K592	I557-I562 HydrophobicContact CB-CD1 4.49Å; I557-I562 HydrophobicContact CB-CG1 4.34Å; I557-I562 HydrophobicContact CG2-CD1 4.37Å; I557-I562 HydrophobicContact CG2-CG1 3.74Å; S558-I562 WeakPolarHBondContact O-CG1 3.29Å; S558-I562 PolarHBondContact O-N 2.57Å; S558-I562 VanDerWaalsContact O-N 3.12Å; Q560-I562 VanDerWaalsContact C-N 3.3Å; Q560-I562 PolarHBondContact O-N 3.14Å; I562-L566 VanDerWaalsContact O-CB 3.31Å; I562-L566 WeakPolarHBondContact O-CB 3.01Å; I562-L566 PolarHBondContact O-N 3.01Å; I562-R588 HydrophobicContact CG2-CG 4.47Å; I562-P591 HydrophobicContact CD1-CB 3.77Å; I562-P591 HydrophobicContact CD1-CG 4.26Å; I562-P591 HydrophobicContact CG1-CB 4.12Å; I562-K592 HydrophobicContact CD1-CG 4.22Å
563	S	78.3	Confident	75.7	Confident	61 Å²	61	66.8 Å²	66.8	43%	0.427	39%	0.388	S	S	.	.	H	α-helix	trans	-68	-42.1	-178.2	-58.6	0	0	0	0	111.8	A559 Q560 S561 G567	A559-S563 PolarHBondContact O-N 2.98Å; A559-S563 VanDerWaalsContact O-N 3.17Å; A559-S563 PolarHBondContact O-OG 3.01Å; Q560-S563 PolarHBondContact O-N 2.88Å; Q560-S563 VanDerWaalsContact O-N 3.14Å; S561-S563 PolarHBondContact O-N 3.32Å; S563-G567 PolarHBondContact O-N 2.86Å
564	D	77.5	Confident	74.6	Confident	90 Å²	90	67.8 Å²	67.8	48%	0.481	40%	0.402	S	S	.	.	H	α-helix	trans	-66.3	-41.1	177.1	-83.2	-10.7	0	0	0	112.1	Q560 S561 R568	Q560-D564 PolarHBondContact O-N 3.02Å; S561-D564 PolarHBondContact O-N 3.4Å; D564-R568 VanDerWaalsContact O-CB 3.24Å; D564-R568 WeakPolarHBondContact O-CB 3.44Å; D564-R568 PolarHBondContact O-N 3.07Å
565	S	71.8	Confident	74.2	Confident	18 Å²	18	67.9 Å²	67.9	13%	0.126	40%	0.402	C	S	.	.	H	α-helix	trans	-70.1	-42.5	179.5	-74.6	0	0	0	0	112.7	S561 G567 G569 K570 W579	S561-S565 VanDerWaalsContact O-CB 3.24Å; S561-S565 WeakPolarHBondContact O-CB 3.43Å; S561-S565 PolarHBondContact O-N 3.24Å; S561-S565 PolarHBondContact O-OG 2.81Å; S561-S565 VanDerWaalsContact O-OG 3.14Å; S565-G567 VanDerWaalsContact C-N 3.33Å; S565-G569 VanDerWaalsContact O-CA 3.24Å; S565-G569 WeakPolarHBondContact O-CA 3.37Å; S565-G569 PolarHBondContact O-N 2.94Å; S565-K570 WeakPolarHBondContact CB-O 3.47Å; S565-K570 PolarHBondContact OG-O 3.41Å; S565-W579 WeakPolarHBondContact OG-CH2 3.42Å
566	L	71.6	Confident	74.3	Confident	93 Å²	93	70.8 Å²	70.8	49%	0.487	42%	0.417	S	S	.	.	H	α-helix	trans	-68.9	-34	177.8	-163.5	69.6	0	0	0	111.5	I562	I562-L566 VanDerWaalsContact O-CB 3.31Å; I562-L566 WeakPolarHBondContact O-CB 3.01Å; I562-L566 PolarHBondContact O-N 3.01Å
567	G	70	Confident	74.5	Confident	69 Å²	69	65.3 Å²	65.3	71%	0.711	39%	0.391	S	S	*	.	H	α-helix	trans	-80.1	-36.8	177.7	0	0	0	0	0	115	S563 S565	S563-G567 PolarHBondContact O-N 2.86Å; S565-G567 VanDerWaalsContact C-N 3.33Å
568	R	66.3	Low	75	Confident	185 Å²	185	65 Å²	65	70%	0.698	39%	0.39	S	S	*	.	H	α-helix	trans	-105.9	-2.7	-175.5	-60.2	179.5	174.1	174	-2	114.3	D564 K570	D564-R568 VanDerWaalsContact O-CB 3.24Å; D564-R568 WeakPolarHBondContact O-CB 3.44Å; D564-R568 PolarHBondContact O-N 3.07Å; R568-K570 PolarHBondContact O-N 2.8Å
569	G	65.6	Low	75.2	Confident	63 Å²	63	64.1 Å²	64.1	65%	0.649	38%	0.38	S	S	*	.			trans	66.1	13.5	-179.2	0	0	0	0	0	115	S565 K571	S565-G569 VanDerWaalsContact O-CA 3.24Å; S565-G569 WeakPolarHBondContact O-CA 3.37Å; S565-G569 PolarHBondContact O-N 2.94Å; G569-K571 PolarHBondContact O-N 2.99Å
570	K	60.9	Low	75.7	Confident	156 Å²	156	62.6 Å²	62.6	68%	0.678	36%	0.363	S	S	*	.			trans	-86.3	110	178.7	-76.4	-172.9	178	-179.6	0	110.2	S565 R568	S565-K570 WeakPolarHBondContact CB-O 3.47Å; S565-K570 PolarHBondContact OG-O 3.41Å; R568-K570 PolarHBondContact O-N 2.8Å
571	K	65.1	Low	76.1	Confident	118 Å²	118	55.2 Å²	55.2	51%	0.513	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-84.2	124.2	172.8	-61.7	-176.9	178.9	-173.4	0	109.8	G569 E583	G569-K571 PolarHBondContact O-N 2.99Å; K571-E583 WeakPolarHBondContact CE-OE2 3.3Å; K571-E583 IonicContact NZ-OE1 2.91Å; K571-E583 IonicContact NZ-OE2 2.69Å; K571-E583 PolarHBondContact NZ-OE2 2.9Å
572	A	62.8	Low	76.5	Confident	57 Å²	57	53.7 Å²	53.7	47%	0.471	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-66.9	143.2	166.5	0	0	0	0	0	109.4	W579	A572-W579 HydrophobicContact CB-CZ2 4.19Å; A572-W579 PolarHBondContact O-NE1 3.32Å
573	A	61.2	Low	76.9	Confident	52 Å²	52	59 Å²	59	43%	0.43	34%	0.344	S	S	.	.	S	Bend	trans	-78.1	136.3	178.7	0	0	0	0	0	110.3	R167	R167-A573 HydrophobicContact CB-CB 4.24Å
574	G	68.8	Low	77.4	Confident	33 Å²	33	58.9 Å²	58.9	34%	0.34	34%	0.336	S	S	.	.	S	Bend	trans	129.5	-56.2	174.5	0	0	0	0	0	113.7	L576 R597	G574-L576 PolarHBondContact O-N 3.36Å; G574-R597 PolarHBondContact O-NH2 2.79Å
575	D	82.2	Confident	78	Confident	6 Å²	6	56.6 Å²	56.6	3%	0.032	32%	0.321	C	S	.	.			trans	-89.8	91.1	-170.5	-63.3	-62.2	0	0	0	113.5	E554 G555 I557 P578	E554-D575 WeakPolarHBondContact CA-OD1 3.4Å; G555-D575 PolarHBondContact N-OD1 2.78Å; G555-D575 VanDerWaalsContact N-OD1 3.17Å; I557-D575 HydrophobicContact CD1-CB 4.08Å; D575-P578 HydrophobicContact CB-CB 4.4Å; D575-P578 HydrophobicContact CB-CG 4.11Å
576	L	87.9	Confident	78.6	Confident	63 Å²	63	58 Å²	58	33%	0.33	34%	0.339	S	S	.	.	H	α-helix	trans	-77.6	-46.7	-175.4	-177.9	70.2	0	0	0	113.2	E554 G574 N580	E554-L576 PolarHBondContact OE1-N 3.27Å; E554-L576 PolarHBondContact OE2-N 3.02Å; G574-L576 PolarHBondContact O-N 3.36Å; L576-N580 VanDerWaalsContact CD1-ND2 3.33Å; L576-N580 WeakPolarHBondContact CD1-ND2 3.39Å; L576-N580 WeakPolarHBondContact O-CB 3.32Å; L576-N580 VanDerWaalsContact O-CG 3.32Å; L576-N580 PolarHBondContact O-N 2.84Å; L576-N580 PolarHBondContact O-ND2 3Å
577	I	91.8	Very high	79.4	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-69.6	-48.9	-173.2	-60.9	179.6	0	0	0	110.9	E554 W579 N580 V581 F590 R597 Y683 I722 L724	E554-I577 WeakPolarHBondContact OE2-CB 3.48Å; E554-I577 WeakPolarHBondContact OE2-CG1 3.23Å; E554-I577 PolarHBondContact OE2-N 2.97Å; I577-W579 VanDerWaalsContact C-N 3.34Å; I577-W579 PolarHBondContact O-N 2.9Å; I577-N580 PolarHBondContact O-N 2.9Å; I577-V581 HydrophobicContact CG2-CG2 4.05Å; I577-V581 WeakPolarHBondContact O-CG2 3.42Å; I577-V581 PolarHBondContact O-N 2.96Å; I577-F590 HydrophobicContact CG2-CE1 4.02Å; I577-F590 HydrophobicContact CG2-CZ 4.15Å; I577-R597 HydrophobicContact CD1-CB 3.93Å; I577-R597 HydrophobicContact CD1-CG 3.81Å; I577-R597 HydrophobicContact CG1-CG 4.39Å; I577-Y683 HydrophobicContact CB-CE2 4.45Å; I577-Y683 HydrophobicContact CD1-CE2 4.44Å; I577-Y683 HydrophobicContact CG2-CE2 3.88Å; I577-I722 HydrophobicContact CD1-CG2 4.24Å; I577-I722 HydrophobicContact CG1-CG2 4.12Å; I577-I722 HydrophobicContact CG2-CG2 4.21Å; I577-L724 HydrophobicContact CD1-CD2 4.28Å; I577-L724 HydrophobicContact CG2-CD2 3.8Å
578	P	91	Very high	80.2	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-52.7	-48	177.1	-30.7	38.4	0	0	0	113.5	E554 I557 D575 A582 P591	E554-P578 HydrophobicContact CB-CG 4.21Å; E554-P578 WeakPolarHBondContact OE2-CD 3.5Å; I557-P578 HydrophobicContact CD1-CB 3.78Å; I557-P578 HydrophobicContact CD1-CG 4.37Å; D575-P578 HydrophobicContact CB-CB 4.4Å; D575-P578 HydrophobicContact CB-CG 4.11Å; P578-A582 VanDerWaalsContact O-CB 3.23Å; P578-A582 WeakPolarHBondContact O-CB 3.29Å; P578-A582 PolarHBondContact O-N 3.36Å; P578-P591 HydrophobicContact CB-CB 4.05Å
579	W	87.9	Confident	81.3	Confident	23 Å²	23	55.5 Å²	55.5	9%	0.087	31%	0.312	C	S	.	.	H	α-helix	trans	-66.8	-43.6	-178.6	-70.8	131.3	0	0	0	112.8	I557 S565 A572 I577 E583	I557-W579 HydrophobicContact CD1-CZ2 4.26Å; I557-W579 HydrophobicContact CG2-CH2 4.44Å; I557-W579 HydrophobicContact CG2-CZ2 4.46Å; S565-W579 WeakPolarHBondContact OG-CH2 3.42Å; A572-W579 HydrophobicContact CB-CZ2 4.19Å; A572-W579 PolarHBondContact O-NE1 3.32Å; I577-W579 VanDerWaalsContact C-N 3.34Å; I577-W579 PolarHBondContact O-N 2.9Å; W579-E583 VanDerWaalsContact O-CB 3.26Å; W579-E583 WeakPolarHBondContact O-CB 3.32Å; W579-E583 PolarHBondContact O-N 3.18Å
580	N	89.8	Confident	82.5	Confident	27 Å²	27	52.6 Å²	52.6	14%	0.144	28%	0.282	C	S	.	.	H	α-helix	trans	-69	-37.4	-178.8	-72.8	-25.5	0	0	0	112.3	L576 I577 Q584 I722	L576-N580 VanDerWaalsContact CD1-ND2 3.33Å; L576-N580 WeakPolarHBondContact CD1-ND2 3.39Å; L576-N580 WeakPolarHBondContact O-CB 3.32Å; L576-N580 VanDerWaalsContact O-CG 3.32Å; L576-N580 PolarHBondContact O-N 2.84Å; L576-N580 PolarHBondContact O-ND2 3Å; I577-N580 PolarHBondContact O-N 2.9Å; N580-Q584 WeakPolarHBondContact O-CB 3.41Å; N580-Q584 PolarHBondContact O-N 3.39Å; N580-I722 HydrophobicContact CB-CD1 3.82Å
581	V	89.4	Confident	83.8	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-70.7	-45.2	177	176.4	0	0	0	0	110.2	I577 E583 Q584 Y585 F590 V706 Y736	I577-V581 HydrophobicContact CG2-CG2 4.05Å; I577-V581 WeakPolarHBondContact O-CG2 3.42Å; I577-V581 PolarHBondContact O-N 2.96Å; V581-E583 PolarHBondContact O-N 3.4Å; V581-Q584 PolarHBondContact O-N 3.39Å; V581-Y585 HydrophobicContact CG1-CD2 3.8Å; V581-Y585 HydrophobicContact CG1-CE2 4.38Å; V581-Y585 WeakPolarHBondContact O-CB 3.12Å; V581-Y585 WeakPolarHBondContact O-CD2 3.27Å; V581-Y585 PolarHBondContact O-N 2.83Å; V581-F590 HydrophobicContact CB-CD1 3.69Å; V581-F590 HydrophobicContact CB-CE1 3.77Å; V581-F590 HydrophobicContact CB-CG 4.26Å; V581-F590 HydrophobicContact CB-CZ 4.37Å; V581-F590 HydrophobicContact CG1-CB 4.22Å; V581-F590 HydrophobicContact CG1-CD1 3.61Å; V581-F590 HydrophobicContact CG1-CD2 3.95Å; V581-F590 HydrophobicContact CG1-CE1 3.93Å; V581-F590 HydrophobicContact CG1-CE2 4.23Å; V581-F590 HydrophobicContact CG1-CG 3.63Å; V581-F590 HydrophobicContact CG1-CZ 4.23Å; V581-F590 HydrophobicContact CG2-CD1 4.31Å; V581-F590 HydrophobicContact CG2-CE1 3.86Å; V581-F590 HydrophobicContact CG2-CZ 4.13Å; V581-V706 HydrophobicContact CG2-CG1 4.38Å; V581-Y736 HydrophobicContact CG1-CE2 4.47Å
582	A	88.3	Confident	85	Confident	7 Å²	7	44.2 Å²	44.2	6%	0.058	25%	0.246	C	C	.	.	H	α-helix	trans	-61.1	-41.7	177.3	0	0	0	0	0	112.9	P578 G586 D587 P591	P578-A582 VanDerWaalsContact O-CB 3.23Å; P578-A582 WeakPolarHBondContact O-CB 3.29Å; P578-A582 PolarHBondContact O-N 3.36Å; A582-G586 WeakPolarHBondContact O-CA 3.42Å; A582-G586 PolarHBondContact O-N 3.03Å; A582-D587 WeakPolarHBondContact CB-O 3.4Å; A582-P591 HydrophobicContact CB-CG 3.65Å
583	E	87	Confident	86.3	Confident	118 Å²	118	43.8 Å²	43.8	55%	0.551	24%	0.235	S	C	*	.	H	α-helix	trans	-68.3	-42.2	177.7	-175.7	176.2	-165.2	0	0	111.9	K571 W579 V581	K571-E583 WeakPolarHBondContact CE-OE2 3.3Å; K571-E583 IonicContact NZ-OE1 2.91Å; K571-E583 IonicContact NZ-OE2 2.69Å; K571-E583 PolarHBondContact NZ-OE2 2.9Å; W579-E583 VanDerWaalsContact O-CB 3.26Å; W579-E583 WeakPolarHBondContact O-CB 3.32Å; W579-E583 PolarHBondContact O-N 3.18Å; V581-E583 PolarHBondContact O-N 3.4Å
584	Q	88.1	Confident	87.7	Confident	58 Å²	58	41.9 Å²	41.9	27%	0.271	22%	0.219	S	C	.	.	H	α-helix	trans	-71.9	-40.6	-176.9	-175.4	72.9	9.1	0	0	112.5	N580 V581 Y707 R743	N580-Q584 WeakPolarHBondContact O-CB 3.41Å; N580-Q584 PolarHBondContact O-N 3.39Å; V581-Q584 PolarHBondContact O-N 3.39Å; Q584-Y707 HydrophobicContact CB-CD2 4.19Å; Q584-Y707 HydrophobicContact CG-CD2 3.92Å; Q584-Y707 HydrophobicContact CG-CE2 4.41Å; Q584-R743 VanDerWaalsContact CD-NH1 3.26Å; Q584-R743 PolarHBondContact O-NH1 3.26Å; Q584-R743 PolarHBondContact O-NH2 3.4Å; Q584-R743 VanDerWaalsContact O-NH2 3.11Å
585	Y	89.6	Confident	88.8	Confident	42 Å²	42	40.3 Å²	40.3	17%	0.165	20%	0.202	C	C	.	.	H	α-helix	trans	-103.3	-11.9	-173.8	-65.5	-82.1	0	0	0	113.5	V581 D587 V706 Y736 D739	V581-Y585 HydrophobicContact CG1-CD2 3.8Å; V581-Y585 HydrophobicContact CG1-CE2 4.38Å; V581-Y585 WeakPolarHBondContact O-CB 3.12Å; V581-Y585 WeakPolarHBondContact O-CD2 3.27Å; V581-Y585 PolarHBondContact O-N 2.83Å; Y585-D587 PolarHBondContact O-N 3.41Å; Y585-V706 HydrophobicContact CE2-CG1 3.64Å; Y585-V706 PolarHBondContact OH-O 2.87Å; Y585-Y736 AromaticContact CD1-CD1 3.69Å; Y585-Y736 HydrophobicContact CD1-CD1 3.69Å; Y585-Y736 HydrophobicContact CD1-CE1 4.03Å; Y585-Y736 HydrophobicContact CD2-CD1 4.15Å; Y585-Y736 HydrophobicContact CD2-CE1 4.21Å; Y585-Y736 AromaticContact CE1-CD1 3.75Å; Y585-Y736 HydrophobicContact CE1-CD1 3.75Å; Y585-Y736 HydrophobicContact CE2-CD1 4.22Å; Y585-Y736 AromaticContact CG-CD1 3.9Å; Y585-Y736 HydrophobicContact CG-CD1 3.9Å; Y585-Y736 AromaticContact CG-CE1 3.86Å; Y585-Y736 HydrophobicContact CG-CE1 3.86Å; Y585-Y736 PolarHBondContact OH-O 3.33Å; Y585-D739 WeakPolarHBondContact CD1-OD2 3.14Å; Y585-D739 HydrophobicContact CE1-CB 4.05Å; Y585-D739 WeakPolarHBondContact CE1-OD2 3.48Å
586	G	86.1	Confident	89.4	Confident	49 Å²	49	40 Å²	40	51%	0.505	20%	0.201	S	C	.	.			trans	69.4	15.2	-172.7	0	0	0	0	0	113.4	A582	A582-G586 WeakPolarHBondContact O-CA 3.42Å; A582-G586 PolarHBondContact O-N 3.03Å
587	D	87.6	Confident	89.7	Confident	46 Å²	46	38.9 Å²	38.9	25%	0.246	19%	0.192	C	C	.	.			trans	-83.1	122.4	-173.7	-165.4	-30.6	0	0	0	111.2	A582 Y585 D589 F590 Y736	A582-D587 WeakPolarHBondContact CB-O 3.4Å; Y585-D587 PolarHBondContact O-N 3.41Å; D587-D589 PolarHBondContact OD1-N 3.28Å; D587-F590 HydrophobicContact CB-CB 4.35Å; D587-F590 PolarHBondContact OD1-N 2.94Å; D587-Y736 PolarHBondContact OD2-OH 3.08Å
588	R	86.6	Confident	89.9	Confident	148 Å²	148	38.9 Å²	38.9	56%	0.558	19%	0.192	S	C	*	.	S	Bend	trans	-92.6	-14	-179.6	-62.1	-176.2	179.6	-172.4	-0.3	113.4	I562	I562-R588 HydrophobicContact CG2-CG 4.47Å
589	D	89.1	Confident	89.9	Confident	99 Å²	99	40.7 Å²	40.7	53%	0.529	20%	0.203	S	C	.	.	S	Bend	trans	-91.5	-33.2	-177.5	-67.1	-37.7	0	0	0	111.3	D587 K592	D587-D589 PolarHBondContact OD1-N 3.28Å; D589-K592 WeakPolarHBondContact O-CB 3.38Å; D589-K592 PolarHBondContact O-N 2.8Å; D589-K592 IonicContact OD1-NZ 3.73Å; D589-K592 PolarHBondContact OD1-NZ 3.29Å
590	F	90.7	Very high	90	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.009	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-53.7	-44.4	177.7	-172.2	-86.2	0	0	0	114.1	I577 V581 D587 K592 L593 Y683 L724 W732 Y736	I577-F590 HydrophobicContact CG2-CE1 4.02Å; I577-F590 HydrophobicContact CG2-CZ 4.15Å; V581-F590 HydrophobicContact CB-CD1 3.69Å; V581-F590 HydrophobicContact CB-CE1 3.77Å; V581-F590 HydrophobicContact CB-CG 4.26Å; V581-F590 HydrophobicContact CB-CZ 4.37Å; V581-F590 HydrophobicContact CG1-CB 4.22Å; V581-F590 HydrophobicContact CG1-CD1 3.61Å; V581-F590 HydrophobicContact CG1-CD2 3.95Å; V581-F590 HydrophobicContact CG1-CE1 3.93Å; V581-F590 HydrophobicContact CG1-CE2 4.23Å; V581-F590 HydrophobicContact CG1-CG 3.63Å; V581-F590 HydrophobicContact CG1-CZ 4.23Å; V581-F590 HydrophobicContact CG2-CD1 4.31Å; V581-F590 HydrophobicContact CG2-CE1 3.86Å; V581-F590 HydrophobicContact CG2-CZ 4.13Å; D587-F590 HydrophobicContact CB-CB 4.35Å; D587-F590 PolarHBondContact OD1-N 2.94Å; F590-K592 PolarHBondContact O-N 3.07Å; F590-L593 HydrophobicContact CD2-CD1 4.11Å; F590-L593 HydrophobicContact CE2-CD1 4.49Å; F590-L593 WeakPolarHBondContact O-CB 3.44Å; F590-L593 PolarHBondContact O-N 3.19Å; F590-L593 VanDerWaalsContact O-N 3.13Å; F590-Y683 HydrophobicContact CE1-CE1 4.12Å; F590-Y683 AromaticContact CE1-CZ 3.96Å; F590-Y683 HydrophobicContact CE2-CD1 4.45Å; F590-Y683 HydrophobicContact CE2-CE1 4.45Å; F590-Y683 HydrophobicContact CZ-CD1 4.15Å; F590-Y683 HydrophobicContact CZ-CD2 4.43Å; F590-Y683 AromaticContact CZ-CE1 3.81Å; F590-Y683 HydrophobicContact CZ-CE1 3.81Å; F590-Y683 HydrophobicContact CZ-CE2 4.12Å; F590-Y683 HydrophobicContact CZ-CG 4.44Å; F590-Y683 AromaticContact CZ-CZ 3.79Å; F590-L724 HydrophobicContact CE2-CD1 3.89Å; F590-L724 HydrophobicContact CZ-CD1 3.76Å; F590-W732 HydrophobicContact CD2-CZ3 4.35Å; F590-W732 AromaticContact CE2-CH2 3.87Å; F590-W732 HydrophobicContact CE2-CH2 3.87Å; F590-W732 AromaticContact CE2-CZ3 3.83Å; F590-W732 HydrophobicContact CE2-CZ3 3.83Å; F590-Y736 AromaticContact CD2-CE2 3.81Å; F590-Y736 HydrophobicContact CD2-CE2 3.81Å; F590-Y736 HydrophobicContact CE2-CE2 4.14Å
591	P	89.3	Confident	90.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-66.6	-16.2	179	-23.3	36.4	0	0	0	115.5	Q556 I557 I562 P578 A582 L593	Q556-P591 PolarHBondContact N-O 2.82Å; I557-P591 HydrophobicContact CB-CB 4.32Å; I557-P591 HydrophobicContact CD1-CB 4.14Å; I557-P591 PolarHBondContact N-O 3.24Å; I557-P591 VanDerWaalsContact N-O 3.15Å; I562-P591 HydrophobicContact CD1-CB 3.77Å; I562-P591 HydrophobicContact CD1-CG 4.26Å; I562-P591 HydrophobicContact CG1-CB 4.12Å; P578-P591 HydrophobicContact CB-CB 4.05Å; A582-P591 HydrophobicContact CB-CG 3.65Å; P591-L593 VanDerWaalsContact C-N 3.34Å
592	K	89.9	Confident	90.2	Very high	99 Å²	99	41.2 Å²	41.2	43%	0.43	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-76.7	-25.2	175.6	-57.4	174.6	-173.8	162.1	0	111.8	I562 D589 F590	I562-K592 HydrophobicContact CD1-CG 4.22Å; D589-K592 WeakPolarHBondContact O-CB 3.38Å; D589-K592 PolarHBondContact O-N 2.8Å; D589-K592 IonicContact OD1-NZ 3.73Å; D589-K592 PolarHBondContact OD1-NZ 3.29Å; F590-K592 PolarHBondContact O-N 3.07Å
593	L	90.8	Very high	90.2	Very high	47 Å²	47	42.5 Å²	42.5	25%	0.246	21%	0.213	C	C	.	.	S	Bend	trans	-64.4	148.9	178.4	-59.7	177.8	0	0	0	110.8	G555 Q556 F590 P591 D682 Y683 W732	G555-L593 WeakPolarHBondContact CA-O 3.49Å; Q556-L593 PolarHBondContact N-O 3.37Å; F590-L593 HydrophobicContact CD2-CD1 4.11Å; F590-L593 HydrophobicContact CE2-CD1 4.49Å; F590-L593 WeakPolarHBondContact O-CB 3.44Å; F590-L593 PolarHBondContact O-N 3.19Å; F590-L593 VanDerWaalsContact O-N 3.13Å; P591-L593 VanDerWaalsContact C-N 3.34Å; L593-D682 HydrophobicContact CB-CB 4.13Å; L593-D682 HydrophobicContact CD2-CB 4.35Å; L593-Y683 HydrophobicContact CB-CD1 4.24Å; L593-Y683 HydrophobicContact CB-CE1 4.13Å; L593-W732 HydrophobicContact CD1-CZ2 4.25Å
594	C	90.6	Very high	90.1	Very high	13 Å²	13	37.1 Å²	37.1	9%	0.088	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	120.4	173.3	-169.6	0	0	0	0	109.6	Q556 H680 D682	Q556-C594 HydrophobicContact CG-CB 3.99Å; C594-H680 PolarHBondContact SG-O 2.58Å; C594-D682 PolarHBondContact N-OD2 3.21Å; C594-D682 WeakPolarHBondContact O-CB 3.35Å; C594-D682 PolarHBondContact O-N 3.25Å
595	G	91.6	Very high	89.6	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	155.5	-177.1	0	0	0	0	0	113.2	E554 Y683	E554-G595 PolarHBondContact N-O 2.79Å; E554-G595 WeakPolarHBondContact O-CA 3.46Å; E554-G595 PolarHBondContact O-N 3.04Å; E554-G595 VanDerWaalsContact O-O 3.08Å; G595-Y683 CarbonylContact C-O 3.45Å; G595-Y683 VanDerWaalsContact CA-CE1 3.42Å; G595-Y683 VanDerWaalsContact CA-CZ 3.45Å; G595-Y683 VanDerWaalsContact CA-O 3.31Å; G595-Y683 WeakPolarHBondContact CA-O 3.34Å
596	V	93.9	Very high	89.1	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	116.9	166.9	-179.5	0	0	0	0	108.9	V551 A552 L553 Y624 V681 Y683 I684 G685	V551-V596 HydrophobicContact CB-CG1 3.6Å; V551-V596 HydrophobicContact CG1-CG1 4.05Å; V551-V596 HydrophobicContact CG2-CG1 4.04Å; A552-V596 CarbonylContact O-C 3.6Å; L553-V596 HydrophobicContact CD2-CG2 3.64Å; V596-Y624 HydrophobicContact CG1-CE2 4.09Å; V596-Y624 HydrophobicContact CG2-CD1 4.4Å; V596-Y624 HydrophobicContact CG2-CE1 4Å; V596-Y624 HydrophobicContact CG2-CE2 4.31Å; V596-V681 HydrophobicContact CB-CG1 4.22Å; V596-V681 HydrophobicContact CG2-CB 4.18Å; V596-V681 HydrophobicContact CG2-CG1 3.62Å; V596-V681 HydrophobicContact CG2-CG2 3.4Å; V596-V681 VanDerWaalsContact CG2-CG2 3.4Å; V596-Y683 PolarHBondContact N-O 3.16Å; V596-I684 CarbonylContact O-C 3.58Å; V596-I684 VanDerWaalsContact O-CA 3.31Å; V596-I684 WeakPolarHBondContact O-CA 3.39Å; V596-G685 PolarHBondContact O-N 3.16Å
597	R	94.8	Very high	88.9	Confident	38 Å²	38	38.5 Å²	38.5	14%	0.143	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	116.8	170.4	179.8	-180	65	-178.2	-17.2	110	V551 A552 E554 G574 I577 V599 G685	V551-R597 CarbonylContact C-O 3.37Å; V551-R597 VanDerWaalsContact CA-O 3.3Å; V551-R597 WeakPolarHBondContact CA-O 3.43Å; A552-R597 PolarHBondContact N-O 3.36Å; A552-R597 PolarHBondContact O-N 3.35Å; E554-R597 HydrophobicContact CG-CB 4.12Å; E554-R597 WeakPolarHBondContact OE1-CD 3.46Å; E554-R597 IonicContact OE1-CZ 3.44Å; E554-R597 IonicContact OE1-NE 3.66Å; E554-R597 PolarHBondContact OE1-NE 3.43Å; E554-R597 IonicContact OE1-NH1 2.77Å; E554-R597 PolarHBondContact OE1-NH1 2.98Å; E554-R597 VanDerWaalsContact OE1-NH1 3.13Å; E554-R597 IonicContact OE1-NH2 3.84Å; E554-R597 PolarHBondContact OE1-NH2 2.85Å; G574-R597 PolarHBondContact O-NH2 2.79Å; I577-R597 HydrophobicContact CD1-CB 3.93Å; I577-R597 HydrophobicContact CD1-CG 3.81Å; I577-R597 HydrophobicContact CG1-CG 4.39Å; R597-V599 HydrophobicContact CG-CG2 4.46Å; R597-V599 PolarHBondContact O-N 3.23Å; R597-V599 VanDerWaalsContact O-N 3.11Å; R597-G685 CarbonylContact C-O 3.51Å; R597-G685 WeakPolarHBondContact CA-O 3.48Å
598	I	95.4	Very high	88.6	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	104.3	164.3	-54.6	173.2	0	0	0	107.8	I549 V551 V601 I617 L620 I684 G685 T686 W698 F703	I549-I598 HydrophobicContact CG2-CG2 4.09Å; V551-I598 HydrophobicContact CG1-CG1 4.26Å; I598-V601 HydrophobicContact CG2-CG2 3.53Å; I598-I617 HydrophobicContact CD1-CD1 3.81Å; I598-L620 HydrophobicContact CD1-CD2 3.88Å; I598-L620 HydrophobicContact CG1-CD2 4.11Å; I598-I684 HydrophobicContact CD1-CG2 3.71Å; I598-I684 HydrophobicContact CG1-CG2 3.89Å; I598-G685 PolarHBondContact N-O 3.16Å; I598-T686 PolarHBondContact O-OG1 2.94Å; I598-W698 HydrophobicContact CB-CH2 4.49Å; I598-W698 HydrophobicContact CD1-CH2 4.1Å; I598-W698 HydrophobicContact CD1-CZ3 4.02Å; I598-W698 HydrophobicContact CG2-CH2 4.11Å; I598-F703 HydrophobicContact CD1-CE1 4.45Å; I598-F703 HydrophobicContact CD1-CZ 3.88Å
599	V	91.9	Very high	88.5	Confident	37 Å²	37	43 Å²	43	22%	0.224	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	-44.7	-178.6	-172	0	0	0	0	110	Q550 A552 R597	Q550-V599 HydrophobicContact CB-CB 4.41Å; Q550-V599 HydrophobicContact CG-CB 4.24Å; Q550-V599 PolarHBondContact O-N 3.33Å; A552-V599 HydrophobicContact CB-CG2 3.66Å; R597-V599 HydrophobicContact CG-CG2 4.46Å; R597-V599 PolarHBondContact O-N 3.23Å; R597-V599 VanDerWaalsContact O-N 3.11Å
600	R	90.4	Very high	88.4	Confident	34 Å²	34	43 Å²	43	13%	0.128	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	141.5	-177.1	-67.4	-172.3	177.8	175.6	0.5	111.9	Y506 H510 N513 D517 I549 Q550	Y506-R600 HydrophobicContact CD1-CB 4.33Å; Y506-R600 HydrophobicContact CE1-CB 3.78Å; H510-R600 WeakPolarHBondContact NE2-CB 3.42Å; N513-R600 PolarHBondContact OD1-NH1 3.39Å; D517-R600 IonicContact OD1-NH2 3.71Å; D517-R600 IonicContact OD2-CZ 2.64Å; D517-R600 VanDerWaalsContact OD2-CZ 3.27Å; D517-R600 IonicContact OD2-NH1 3.21Å; D517-R600 PolarHBondContact OD2-NH1 3.26Å; D517-R600 IonicContact OD2-NH2 3.85Å; D517-R600 PolarHBondContact OD2-NH2 3.43Å; I549-R600 WeakPolarHBondContact CA-O 3.45Å; Q550-R600 HydrophobicContact CB-CB 4.01Å; Q550-R600 PolarHBondContact N-O 3.1Å; Q550-R600 PolarHBondContact O-N 2.86Å
601	V	91.9	Very high	88.3	Confident	27 Å²	27	44.6 Å²	44.6	16%	0.164	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	116.9	166.6	-176.8	0	0	0	0	106.8	V547 I549 I598 I617 W698	V547-V601 HydrophobicContact CG1-CG1 4.15Å; I549-V601 HydrophobicContact CG1-CG1 4.45Å; I598-V601 HydrophobicContact CG2-CG2 3.53Å; V601-I617 HydrophobicContact CG2-CD1 4.01Å; V601-W698 HydrophobicContact CG2-CH2 3.81Å; V601-W698 HydrophobicContact CG2-CZ2 4.17Å
602	A	90	Very high	88.4	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	112.3	-177.1	0	0	0	0	0	109.1	I505 Y506 S509 V547 V548	I505-A602 HydrophobicContact CG2-CB 3.79Å; Y506-A602 HydrophobicContact CD1-CB 3.51Å; Y506-A602 HydrophobicContact CE1-CB 3.81Å; Y506-A602 HydrophobicContact CG-CB 4.38Å; S509-A602 WeakPolarHBondContact OG-CA 3.18Å; S509-A602 WeakPolarHBondContact OG-CB 3.09Å; V547-A602 CarbonylContact C-O 3.59Å; V547-A602 VanDerWaalsContact CA-O 3.25Å; V547-A602 WeakPolarHBondContact CA-O 3.18Å; V547-A602 WeakPolarHBondContact CG1-O 3.42Å; V548-A602 HydrophobicContact CB-CB 4.39Å; V548-A602 PolarHBondContact N-O 3.23Å; V548-A602 PolarHBondContact O-N 3.07Å
603	T	88.8	Confident	88.5	Confident	35 Å²	35	40.4 Å²	40.4	22%	0.215	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	138.5	174.6	53.4	0	0	0	0	108.8	V547	V547-T603 HydrophobicContact CG1-CG2 4.09Å; V547-T603 HydrophobicContact CG2-CG2 3.98Å
604	H	85.4	Confident	88.6	Confident	4 Å²	4	43.8 Å²	43.8	2%	0.019	22%	0.216	C	C	.	.			trans	-56.3	130.3	177.2	-176.9	-58.9	0	0	0	110.6	V465 L546 N606 Y607 Q608	V465-H604 VanDerWaalsContact CG1-CD2 3.48Å; V465-H604 WeakPolarHBondContact CG1-CD2 3.31Å; V465-H604 WeakPolarHBondContact CG1-NE2 3.07Å; L546-H604 WeakPolarHBondContact O-CB 3.3Å; L546-H604 PolarHBondContact O-N 3.13Å; H604-N606 VanDerWaalsContact C-N 3.34Å; H604-N606 PolarHBondContact ND1-N 2.98Å; H604-N606 PolarHBondContact O-N 3.39Å; H604-Y607 HydrophobicContact CB-CD2 3.81Å; H604-Y607 AromaticContact CE1-CD2 3.88Å; H604-Y607 AromaticContact CE1-CE2 3.69Å; H604-Y607 AromaticContact CG-CD2 3.53Å; H604-Y607 AromaticContact CG-CE2 3.98Å; H604-Y607 AromaticContact ND1-CD2 3.35Å; H604-Y607 VanDerWaalsContact ND1-CD2 3.35Å; H604-Y607 WeakPolarHBondContact ND1-CD2 3.41Å; H604-Y607 AromaticContact ND1-CE2 3.66Å; H604-Y607 AromaticContact NE2-CE2 3.97Å; H604-Y607 PolarHBondContact O-N 3.4Å; H604-Q608 PolarHBondContact O-N 3.4Å
605	P	78.3	Confident	88.7	Confident	42 Å²	42	45.7 Å²	45.7	27%	0.273	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-53.4	-43.3	-171.2	-29.6	34.9	0	0	0	115.2	V465 S508 Y607 Q608	V465-P605 HydrophobicContact CG2-CG 4.48Å; S508-P605 VanDerWaalsContact CB-CG 3.47Å; S508-P605 VanDerWaalsContact OG-CD 3.31Å; S508-P605 WeakPolarHBondContact OG-CD 3.15Å; S508-P605 WeakPolarHBondContact OG-CG 3.42Å; P605-Y607 PolarHBondContact O-N 3.4Å; P605-Q608 WeakPolarHBondContact O-CG 3.09Å; P605-Q608 PolarHBondContact O-N 2.82Å
606	N	78.9	Confident	88.8	Confident	106 Å²	106	45.7 Å²	45.7	57%	0.567	22%	0.221	S	C	*	.	G	3₁₀ helix	trans	-69.2	-17.6	-179.7	-60	-10.6	0	0	0	114.1	H604	H604-N606 VanDerWaalsContact C-N 3.34Å; H604-N606 PolarHBondContact ND1-N 2.98Å; H604-N606 PolarHBondContact O-N 3.39Å
607	Y	80.9	Confident	88.9	Confident	31 Å²	31	45.7 Å²	45.7	12%	0.122	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-110.9	13	-176.1	-59.8	-72.7	0	0	0	112.9	I468 C472 L546 H604 P605 M610 Y612	I468-Y607 HydrophobicContact CB-CE2 4.31Å; I468-Y607 WeakPolarHBondContact CB-OH 3.34Å; I468-Y607 HydrophobicContact CD1-CD2 4.16Å; I468-Y607 HydrophobicContact CD1-CE2 3.3Å; I468-Y607 HydrophobicContact CG1-CE2 4.01Å; I468-Y607 WeakPolarHBondContact CG2-OH 3.35Å; C472-Y607 HydrophobicContact CB-CE1 4.19Å; L546-Y607 HydrophobicContact CD2-CD2 4.38Å; H604-Y607 HydrophobicContact CB-CD2 3.81Å; H604-Y607 AromaticContact CE1-CD2 3.88Å; H604-Y607 AromaticContact CE1-CE2 3.69Å; H604-Y607 AromaticContact CG-CD2 3.53Å; H604-Y607 AromaticContact CG-CE2 3.98Å; H604-Y607 AromaticContact ND1-CD2 3.35Å; H604-Y607 VanDerWaalsContact ND1-CD2 3.35Å; H604-Y607 WeakPolarHBondContact ND1-CD2 3.41Å; H604-Y607 AromaticContact ND1-CE2 3.66Å; H604-Y607 AromaticContact NE2-CE2 3.97Å; H604-Y607 PolarHBondContact O-N 3.4Å; P605-Y607 PolarHBondContact O-N 3.4Å; Y607-M610 HydrophobicContact CD1-SD 3.78Å; Y607-M610 PolarHBondContact O-N 2.75Å; Y607-Y612 HydrophobicContact CD1-CE2 4.08Å; Y607-Y612 HydrophobicContact CG-CE2 4.21Å
608	Q	82.4	Confident	88.8	Confident	63 Å²	63	48.3 Å²	48.3	29%	0.294	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	147.2	172.5	-69.9	179	6.8	0	0	109.8	H604 P605 M610	H604-Q608 PolarHBondContact O-N 3.4Å; P605-Q608 WeakPolarHBondContact O-CG 3.09Å; P605-Q608 PolarHBondContact O-N 2.82Å; Q608-M610 PolarHBondContact O-N 2.78Å
609	R	82.8	Confident	88.7	Confident	226 Å²	226	49.1 Å²	49.1	85%	0.853	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.2	1.8	-179.4	-50.6	177.9	174.2	-179.4	-4.3	116.4	E693	R609-E693 IonicContact NH2-OE1 2.75Å; R609-E693 PolarHBondContact NH2-OE1 2.83Å
610	M	87.4	Confident	88.7	Confident	98 Å²	98	47.3 Å²	47.3	48%	0.483	23%	0.229	S	C	.	.	S	Bend	trans	-88.2	1.3	173.8	-65	-177.8	175.5	0	0	114.6	C472 P475 Y607 Q608 Y612	C472-M610 PolarHBondContact SG-SD 3.11Å; P475-M610 WeakPolarHBondContact CG-O 3.35Å; Y607-M610 HydrophobicContact CD1-SD 3.78Å; Y607-M610 PolarHBondContact O-N 2.75Å; Q608-M610 PolarHBondContact O-N 2.78Å; M610-Y612 HydrophobicContact CB-CD2 3.9Å; M610-Y612 HydrophobicContact CB-CE2 3.75Å; M610-Y612 HydrophobicContact SD-CE2 4.18Å
611	G	89	Confident	88.8	Confident	35 Å²	35	46.7 Å²	46.7	36%	0.361	23%	0.227	S	C	.	.	S	Bend	trans	91.4	-3.3	173.1	0	0	0	0	0	116.5	G613 K614 R615	G611-G613 VanDerWaalsContact C-N 3.31Å; G611-G613 PolarHBondContact O-N 2.77Å; G611-K614 WeakPolarHBondContact O-CB 3.33Å; G611-K614 PolarHBondContact O-N 3.05Å; G611-R615 PolarHBondContact O-N 2.71Å; G611-R615 VanDerWaalsContact O-N 3.12Å
612	Y	91.5	Very high	88.7	Confident	5 Å²	5	46.6 Å²	46.6	2%	0.02	23%	0.225	C	C	.	.	H	α-helix	trans	-56.4	-39.4	178.7	-64.5	-69.4	0	0	0	114.5	C472 P473 P475 L532 L546 Y607 M610 K614 R615 A616	C472-Y612 PolarHBondContact SG-OH 3.16Å; P473-Y612 WeakPolarHBondContact CD-OH 3.41Å; P473-Y612 PolarHBondContact O-OH 3.3Å; P475-Y612 HydrophobicContact CB-CD1 4.19Å; P475-Y612 HydrophobicContact CB-CE1 4.37Å; P475-Y612 HydrophobicContact CG-CD1 4.19Å; P475-Y612 HydrophobicContact CG-CE1 4.11Å; L532-Y612 HydrophobicContact CD2-CD1 4.11Å; L546-Y612 HydrophobicContact CD1-CD1 4.08Å; L546-Y612 HydrophobicContact CD1-CE1 3.8Å; Y607-Y612 HydrophobicContact CD1-CE2 4.08Å; Y607-Y612 HydrophobicContact CG-CE2 4.21Å; M610-Y612 HydrophobicContact CB-CD2 3.9Å; M610-Y612 HydrophobicContact CB-CE2 3.75Å; M610-Y612 HydrophobicContact SD-CE2 4.18Å; Y612-K614 VanDerWaalsContact C-N 3.3Å; Y612-K614 PolarHBondContact O-N 3.36Å; Y612-R615 PolarHBondContact O-N 2.87Å; Y612-A616 WeakPolarHBondContact O-CB 3.35Å; Y612-A616 PolarHBondContact O-N 3.1Å
613	G	92.1	Very high	88.8	Confident	6 Å²	6	46.9 Å²	46.9	6%	0.062	23%	0.227	C	C	.	.	H	α-helix	trans	-62.6	-36.6	175.7	0	0	0	0	0	112.6	G611 A616 I617	G611-G613 VanDerWaalsContact C-N 3.31Å; G611-G613 PolarHBondContact O-N 2.77Å; G613-A616 PolarHBondContact O-N 3.27Å; G613-I617 VanDerWaalsContact O-CG1 3.29Å; G613-I617 WeakPolarHBondContact O-CG1 3.48Å; G613-I617 PolarHBondContact O-N 2.83Å; G613-I617 VanDerWaalsContact O-N 3.12Å
614	K	92.4	Very high	88.8	Confident	119 Å²	119	45.6 Å²	45.6	52%	0.517	22%	0.218	S	C	.	.	H	α-helix	trans	-67	-45.3	177	-175.3	-176.6	176.1	-171.3	0	110.5	G611 Y612 I617 Q618	G611-K614 WeakPolarHBondContact O-CB 3.33Å; G611-K614 PolarHBondContact O-N 3.05Å; Y612-K614 VanDerWaalsContact C-N 3.3Å; Y612-K614 PolarHBondContact O-N 3.36Å; K614-I617 PolarHBondContact O-N 2.76Å; K614-Q618 WeakPolarHBondContact O-CB 3.35Å; K614-Q618 PolarHBondContact O-N 2.93Å
615	R	93.1	Very high	88.8	Confident	52 Å²	52	46.8 Å²	46.8	20%	0.196	23%	0.229	C	C	.	.	H	α-helix	trans	-57.8	-48.1	174.9	176.8	66.2	171.5	168.3	-2.3	111.8	P475 D476 L532 G611 Y612 I617 Q618 L619	P475-R615 HydrophobicContact CB-CB 4.34Å; P475-R615 WeakPolarHBondContact O-CG 3.28Å; P475-R615 PolarHBondContact O-NE 3.25Å; D476-R615 PolarHBondContact O-NH2 3.09Å; L532-R615 HydrophobicContact CD1-CG 4.44Å; G611-R615 PolarHBondContact O-N 2.71Å; G611-R615 VanDerWaalsContact O-N 3.12Å; Y612-R615 PolarHBondContact O-N 2.87Å; R615-I617 VanDerWaalsContact C-N 3.34Å; R615-I617 PolarHBondContact O-N 3.33Å; R615-Q618 WeakPolarHBondContact O-CB 3.29Å; R615-Q618 PolarHBondContact O-N 3.13Å; R615-L619 HydrophobicContact CG-CD1 4.13Å; R615-L619 WeakPolarHBondContact O-CG 3.36Å; R615-L619 PolarHBondContact O-N 2.97Å
616	A	94.4	Very high	89	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.9	-41.4	-178.6	0	0	0	0	0	112.1	L480 L532 V547 I549 Y612 G613 L620	L480-A616 HydrophobicContact CD1-CB 4.47Å; L532-A616 HydrophobicContact CB-CB 4.32Å; L532-A616 HydrophobicContact CD1-CB 4.36Å; L532-A616 HydrophobicContact CD2-CB 4.34Å; V547-A616 HydrophobicContact CB-CB 4.26Å; V547-A616 HydrophobicContact CG1-CB 4Å; I549-A616 HydrophobicContact CD1-CB 3.66Å; I549-A616 HydrophobicContact CG1-CB 4.49Å; Y612-A616 WeakPolarHBondContact O-CB 3.35Å; Y612-A616 PolarHBondContact O-N 3.1Å; G613-A616 PolarHBondContact O-N 3.27Å; A616-L620 WeakPolarHBondContact O-CB 3.32Å; A616-L620 PolarHBondContact O-N 3.47Å
617	I	94.6	Very high	88.7	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-69	-36.9	176	-65.4	-65.6	0	0	0	112	I549 I598 V601 G613 K614 R615 L620 K621 F697 W698 A701 F703	I549-I617 HydrophobicContact CD1-CD1 4.09Å; I598-I617 HydrophobicContact CD1-CD1 3.81Å; V601-I617 HydrophobicContact CG2-CD1 4.01Å; G613-I617 VanDerWaalsContact O-CG1 3.29Å; G613-I617 WeakPolarHBondContact O-CG1 3.48Å; G613-I617 PolarHBondContact O-N 2.83Å; G613-I617 VanDerWaalsContact O-N 3.12Å; K614-I617 PolarHBondContact O-N 2.76Å; R615-I617 VanDerWaalsContact C-N 3.34Å; R615-I617 PolarHBondContact O-N 3.33Å; I617-L620 PolarHBondContact O-N 3.16Å; I617-K621 HydrophobicContact CG2-CD 4.24Å; I617-K621 VanDerWaalsContact O-CG 3.28Å; I617-K621 WeakPolarHBondContact O-CG 3.45Å; I617-K621 PolarHBondContact O-N 3.41Å; I617-F697 HydrophobicContact CG1-CE1 4.46Å; I617-F697 HydrophobicContact CG1-CZ 3.98Å; I617-W698 HydrophobicContact CD1-CH2 4.12Å; I617-W698 HydrophobicContact CD1-CZ3 4.01Å; I617-W698 HydrophobicContact CG1-CZ3 4.41Å; I617-A701 HydrophobicContact CG2-CB 4.1Å; I617-F703 HydrophobicContact CG2-CE2 3.97Å
618	Q	93.1	Very high	87.6	Confident	93 Å²	93	55.3 Å²	55.3	44%	0.435	26%	0.255	S	S	.	.	H	α-helix	trans	-62	-50	174.9	-177	176.7	-6.6	0	0	111.2	K614 R615 L620 K621 D622	K614-Q618 WeakPolarHBondContact O-CB 3.35Å; K614-Q618 PolarHBondContact O-N 2.93Å; R615-Q618 WeakPolarHBondContact O-CB 3.29Å; R615-Q618 PolarHBondContact O-N 3.13Å; Q618-L620 VanDerWaalsContact C-N 3.3Å; Q618-L620 PolarHBondContact O-N 3.11Å; Q618-K621 WeakPolarHBondContact O-CB 3.3Å; Q618-K621 PolarHBondContact O-N 3.03Å; Q618-K621 VanDerWaalsContact O-N 3.12Å; Q618-D622 PolarHBondContact O-N 2.98Å
619	L	92.9	Very high	86.3	Confident	17 Å²	17	54.9 Å²	54.9	9%	0.089	26%	0.256	C	S	.	.	H	α-helix	trans	-60.8	-38.6	176.7	-69.1	175.4	0	0	0	112.3	L480 L532 R615 D622 Y623	L480-L619 HydrophobicContact CB-CB 4.04Å; L480-L619 HydrophobicContact CB-CD1 3.8Å; L480-L619 HydrophobicContact CD2-CB 4.03Å; L532-L619 HydrophobicContact CD1-CD1 4Å; R615-L619 HydrophobicContact CG-CD1 4.13Å; R615-L619 WeakPolarHBondContact O-CG 3.36Å; R615-L619 PolarHBondContact O-N 2.97Å; L619-D622 PolarHBondContact O-N 3.47Å; L619-Y623 WeakPolarHBondContact O-CB 3.31Å; L619-Y623 PolarHBondContact O-N 3.27Å
620	L	93.3	Very high	84.7	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.8	-41.6	174.9	-169.4	93.1	0	0	0	111.8	L480 F530 I549 V551 I598 A616 I617 Q618 Y623 Y624	L480-L620 HydrophobicContact CD2-CB 4.18Å; L480-L620 HydrophobicContact CD2-CD1 4.28Å; F530-L620 HydrophobicContact CD2-CD1 3.7Å; F530-L620 HydrophobicContact CE2-CD1 3.83Å; F530-L620 HydrophobicContact CG-CD1 4.06Å; F530-L620 HydrophobicContact CZ-CD1 4.28Å; I549-L620 HydrophobicContact CG2-CD1 4.45Å; V551-L620 HydrophobicContact CG1-CD1 4.25Å; V551-L620 HydrophobicContact CG1-CD2 4.23Å; I598-L620 HydrophobicContact CD1-CD2 3.88Å; I598-L620 HydrophobicContact CG1-CD2 4.11Å; A616-L620 WeakPolarHBondContact O-CB 3.32Å; A616-L620 PolarHBondContact O-N 3.47Å; I617-L620 PolarHBondContact O-N 3.16Å; Q618-L620 VanDerWaalsContact C-N 3.3Å; Q618-L620 PolarHBondContact O-N 3.11Å; L620-Y623 WeakPolarHBondContact O-CB 3.41Å; L620-Y623 PolarHBondContact O-N 2.99Å; L620-Y624 HydrophobicContact CD1-CE2 4.04Å; L620-Y624 HydrophobicContact CD2-CE2 4.4Å; L620-Y624 HydrophobicContact CG-CD2 4.06Å; L620-Y624 HydrophobicContact CG-CE2 3.94Å; L620-Y624 VanDerWaalsContact O-CD2 3.29Å; L620-Y624 WeakPolarHBondContact O-CD2 3.4Å; L620-Y624 PolarHBondContact O-N 3.4Å; L620-Y624 VanDerWaalsContact O-N 3.11Å
621	K	91.9	Very high	82.9	Confident	21 Å²	21	54 Å²	54	9%	0.091	27%	0.27	C	S	.	.	H	α-helix	trans	-65.4	-45.4	176	-72.8	169.5	177.8	-127.7	0	111.4	I617 Q618 Y623 Y624 A625 I684 A701 H725	I617-K621 HydrophobicContact CG2-CD 4.24Å; I617-K621 VanDerWaalsContact O-CG 3.28Å; I617-K621 WeakPolarHBondContact O-CG 3.45Å; I617-K621 PolarHBondContact O-N 3.41Å; Q618-K621 WeakPolarHBondContact O-CB 3.3Å; Q618-K621 PolarHBondContact O-N 3.03Å; Q618-K621 VanDerWaalsContact O-N 3.12Å; K621-Y623 VanDerWaalsContact C-N 3.25Å; K621-Y623 PolarHBondContact O-N 2.94Å; K621-Y624 PolarHBondContact O-N 3.2Å; K621-A625 WeakPolarHBondContact O-CB 3.2Å; K621-A625 PolarHBondContact O-N 2.98Å; K621-I684 HydrophobicContact CG-CD1 4.17Å; K621-A701 WeakPolarHBondContact CE-O 3.27Å; K621-A701 PolarHBondContact NZ-O 2.86Å; K621-H725 PolarHBondContact NZ-CD2 3.48Å; K621-H725 PolarHBondContact NZ-CE1 3.26Å; K621-H725 VanDerWaalsContact NZ-CE1 3.26Å; K621-H725 PolarHBondContact NZ-ND1 3.08Å; K621-H725 PolarHBondContact NZ-NE2 3.16Å
622	D	90.3	Very high	80.8	Confident	25 Å²	25	61.2 Å²	61.2	13%	0.134	29%	0.294	C	S	.	.	H	α-helix	trans	-64.8	-33	179.6	-66.8	-33.6	0	0	0	111.5	Q618 L619 R626 K627 H628	Q618-D622 PolarHBondContact O-N 2.98Å; L619-D622 PolarHBondContact O-N 3.47Å; D622-R626 PolarHBondContact O-N 3.35Å; D622-K627 HydrophobicContact CB-CD 4.3Å; D622-K627 PolarHBondContact O-N 3.16Å; D622-K627 VanDerWaalsContact O-N 3.11Å; D622-K627 WeakPolarHBondContact OD1-CD 3.44Å; D622-K627 IonicContact OD1-NZ 3.68Å; D622-K627 PolarHBondContact OD1-NZ 2.98Å; D622-H628 WeakPolarHBondContact CB-NE2 3.42Å
623	Y	90.4	Very high	78.5	Confident	6 Å²	6	66.4 Å²	66.4	2%	0.024	32%	0.322	C	S	.	.	H	α-helix	trans	-61.4	-56.1	170.9	178.3	-113.8	0	0	0	112	F530 L619 L620 K621 A625 R626 L673 R676 P678	F530-Y623 HydrophobicContact CE1-CD1 4.32Å; F530-Y623 HydrophobicContact CE1-CE1 4.11Å; F530-Y623 HydrophobicContact CZ-CD1 4.3Å; F530-Y623 HydrophobicContact CZ-CE1 4Å; L619-Y623 WeakPolarHBondContact O-CB 3.31Å; L619-Y623 PolarHBondContact O-N 3.27Å; L620-Y623 WeakPolarHBondContact O-CB 3.41Å; L620-Y623 PolarHBondContact O-N 2.99Å; K621-Y623 VanDerWaalsContact C-N 3.25Å; K621-Y623 PolarHBondContact O-N 2.94Å; Y623-A625 VanDerWaalsContact C-N 3.31Å; Y623-A625 PolarHBondContact O-N 2.92Å; Y623-R626 PolarHBondContact O-N 3.37Å; Y623-L673 HydrophobicContact CD1-CD2 4.37Å; Y623-L673 HydrophobicContact CD2-CB 3.95Å; Y623-L673 HydrophobicContact CD2-CD2 3.83Å; Y623-L673 HydrophobicContact CD2-CG 4.32Å; Y623-L673 HydrophobicContact CE2-CB 4.28Å; Y623-L673 HydrophobicContact CE2-CD2 3.99Å; Y623-L673 WeakPolarHBondContact CE2-O 3.47Å; Y623-L673 HydrophobicContact CG-CD2 4.03Å; Y623-R676 VanDerWaalsContact CE2-O 3.27Å; Y623-R676 WeakPolarHBondContact CE2-O 3.4Å; Y623-R676 WeakPolarHBondContact OH-CD 3.44Å; Y623-R676 WeakPolarHBondContact OH-CG 3.38Å; Y623-R676 PolarHBondContact OH-NH1 3.47Å; Y623-R676 PolarHBondContact OH-O 3.42Å; Y623-P678 HydrophobicContact CD1-CB 4.17Å; Y623-P678 HydrophobicContact CE1-CB 3.66Å; Y623-P678 HydrophobicContact CE2-CB 4.06Å; Y623-P678 HydrophobicContact CE2-CG 4.25Å; Y623-P678 WeakPolarHBondContact O-CG 3.31Å
624	Y	90.1	Very high	75.9	Confident	7 Å²	7	68.6 Å²	68.6	3%	0.027	35%	0.345	C	S	.	.	H	α-helix	trans	-71.4	-23.5	-179.4	-74.3	-62.5	0	0	0	113.9	V596 L620 K621 R626 P678 V681 I684	V596-Y624 HydrophobicContact CG1-CE2 4.09Å; V596-Y624 HydrophobicContact CG2-CD1 4.4Å; V596-Y624 HydrophobicContact CG2-CE1 4Å; V596-Y624 HydrophobicContact CG2-CE2 4.31Å; L620-Y624 HydrophobicContact CD1-CE2 4.04Å; L620-Y624 HydrophobicContact CD2-CE2 4.4Å; L620-Y624 HydrophobicContact CG-CD2 4.06Å; L620-Y624 HydrophobicContact CG-CE2 3.94Å; L620-Y624 VanDerWaalsContact O-CD2 3.29Å; L620-Y624 WeakPolarHBondContact O-CD2 3.4Å; L620-Y624 PolarHBondContact O-N 3.4Å; L620-Y624 VanDerWaalsContact O-N 3.11Å; K621-Y624 PolarHBondContact O-N 3.2Å; Y624-R626 PolarHBondContact O-N 3.34Å; Y624-P678 HydrophobicContact CD1-CB 4.12Å; Y624-P678 HydrophobicContact CE1-CB 4.44Å; Y624-V681 HydrophobicContact CD1-CB 4.32Å; Y624-V681 HydrophobicContact CD1-CG2 3.54Å; Y624-V681 HydrophobicContact CE1-CG2 3.93Å; Y624-V681 HydrophobicContact CG-CG2 4.27Å; Y624-I684 HydrophobicContact CD2-CD1 4.2Å
625	A	85.9	Confident	73.3	Confident	30 Å²	30	69.3 Å²	69.3	25%	0.248	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	0.8	170.1	0	0	0	0	0	113.3	K621 Y623 K627 P727	K621-A625 WeakPolarHBondContact O-CB 3.2Å; K621-A625 PolarHBondContact O-N 2.98Å; Y623-A625 VanDerWaalsContact C-N 3.31Å; Y623-A625 PolarHBondContact O-N 2.92Å; A625-K627 VanDerWaalsContact C-N 3.26Å; A625-K627 HydrophobicContact CB-CG 4.26Å; A625-K627 PolarHBondContact O-N 2.99Å; A625-P727 HydrophobicContact CB-CB 4.16Å
626	R	81.3	Confident	70.7	Confident	121 Å²	121	71.5 Å²	71.5	46%	0.457	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	29.1	179.2	-60.2	-177.8	175.6	178.2	-3	114.7	D622 Y623 Y624 H628 T629 P678	D622-R626 PolarHBondContact O-N 3.35Å; Y623-R626 PolarHBondContact O-N 3.37Å; Y624-R626 PolarHBondContact O-N 3.34Å; R626-H628 VanDerWaalsContact C-N 3.27Å; R626-H628 PolarHBondContact O-N 2.94Å; R626-T629 PolarHBondContact O-OG1 3.21Å; R626-P678 HydrophobicContact CG-CG 3.9Å
627	K	71.9	Confident	67.8	Low	144 Å²	144	75.2 Å²	75.2	63%	0.626	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-20.2	178.3	-66.6	-176.3	-171.8	164.5	0	113.8	D622 A625	D622-K627 HydrophobicContact CB-CD 4.3Å; D622-K627 PolarHBondContact O-N 3.16Å; D622-K627 VanDerWaalsContact O-N 3.11Å; D622-K627 WeakPolarHBondContact OD1-CD 3.44Å; D622-K627 IonicContact OD1-NZ 3.68Å; D622-K627 PolarHBondContact OD1-NZ 2.98Å; A625-K627 VanDerWaalsContact C-N 3.26Å; A625-K627 HydrophobicContact CB-CG 4.26Å; A625-K627 PolarHBondContact O-N 2.99Å
628	H	57.9	Low	65	Low	93 Å²	93	79.5 Å²	79.5	43%	0.431	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	4.6	-172.4	-66.6	-65.5	0	0	0	114.5	D622 R626 N630	D622-H628 WeakPolarHBondContact CB-NE2 3.42Å; R626-H628 VanDerWaalsContact C-N 3.27Å; R626-H628 PolarHBondContact O-N 2.94Å; H628-N630 PolarHBondContact O-N 2.61Å
629	T	55.6	Low	62.3	Low	53 Å²	53	84.1 Å²	84.1	33%	0.325	46%	0.46	S	S	.	.	S	Bend	trans	-81.4	115.8	175	49.7	0	0	0	0	109.1	R626 L631	R626-T629 PolarHBondContact O-OG1 3.21Å; T629-L631 PolarHBondContact O-N 2.99Å
630	N	49.1	Very low	59.5	Low	129 Å²	129	89.7 Å²	89.7	69%	0.69	49%	0.49	S	S	*	.			trans	-55.2	122	168.6	-80.6	-12.2	0	0	0	108.7	H628 E632	H628-N630 PolarHBondContact O-N 2.61Å; N630-E632 PolarHBondContact O-N 3.14Å
631	L	49.3	Very low	56.6	Low	177 Å²	177	93.8 Å²	93.8	93%	0.927	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-6.3	179.3	-87.9	144.4	0	0	0	113.4	T629	T629-L631 PolarHBondContact O-N 2.99Å
632	E	45.9	Very low	53.8	Low	186 Å²	186	95.7 Å²	95.7	87%	0.869	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-18.7	-173.7	-68.3	-171.3	162	0	0	114.5	N630 G634	N630-E632 PolarHBondContact O-N 3.14Å; E632-G634 PolarHBondContact O-N 2.95Å
633	D	43.3	Very low	51.2	Low	115 Å²	115	103 Å²	103	62%	0.615	58%	0.58	S	S	*	*	S	Bend	trans	-84.6	112.8	166.2	-74.7	-37	0	0	0	106.5	V636	D633-V636 HydrophobicContact CB-CG2 4.22Å
634	G	38.1	Very low	48.2	Very low	52 Å²	52	105.6 Å²	105.6	54%	0.536	61%	0.608	S	S	.	*			trans	-52.4	-177.7	164.7	0	0	0	0	0	110.5	E632 V636	E632-G634 PolarHBondContact O-N 2.95Å; G634-V636 PolarHBondContact O-N 2.79Å
635	P	36.5	Very low	45.5	Very low	134 Å²	134	111.8 Å²	111.8	87%	0.87	64%	0.64	S	S	*	*			trans	-59.8	93.2	165.2	28	-30.4	0	0	0	106.1	A637	P635-A637 PolarHBondContact O-N 3.3Å
636	V	38.1	Very low	42.9	Very low	98 Å²	98	116.9 Å²	116.9	59%	0.594	66%	0.659	S	S	*	*			trans	-58.9	94.5	153.1	-179.4	0	0	0	0	99	D633 G634 S638	D633-V636 HydrophobicContact CB-CG2 4.22Å; G634-V636 PolarHBondContact O-N 2.79Å; V636-S638 VanDerWaalsContact C-N 3.3Å; V636-S638 PolarHBondContact O-N 2.86Å
637	A	34.7	Very low	40.7	Very low	78 Å²	78	120 Å²	120	65%	0.645	68%	0.679	S	S	*	*			trans	-34.4	112.4	165.2	0	0	0	0	0	102.3	P635 K639	P635-A637 PolarHBondContact O-N 3.3Å; A637-K639 PolarHBondContact O-N 2.78Å
638	S	36.1	Very low	39.1	Very low	91 Å²	91	117.4 Å²	117.4	64%	0.636	68%	0.675	S	S	*	*			trans	-40.7	107.8	178.3	42.4	0	0	0	0	102.6	V636 D640	V636-S638 VanDerWaalsContact C-N 3.3Å; V636-S638 PolarHBondContact O-N 2.86Å; S638-D640 PolarHBondContact O-N 3.18Å
639	K	35.1	Very low	38	Very low	189 Å²	189	120.4 Å²	120.4	82%	0.822	69%	0.689	S	S	*	*			trans	-59.9	103.6	171.7	-89.4	-176.7	176.4	175.9	0	98.5	A637 A641	A637-K639 PolarHBondContact O-N 2.78Å; K639-A641 HydrophobicContact CB-CB 4.39Å; K639-A641 PolarHBondContact O-N 3.13Å
640	D	35.1	Very low	37.3	Very low	134 Å²	134	127.2 Å²	127.2	72%	0.717	72%	0.717	S	S	*	*			trans	-59.6	63.9	157	-81	-37	0	0	0	104.3	S638 G642	S638-D640 PolarHBondContact O-N 3.18Å; D640-G642 PolarHBondContact O-N 2.84Å
641	A	32.3	Very low	36.9	Very low	86 Å²	86	128 Å²	128	71%	0.711	72%	0.717	S	S	*	*			trans	-71.8	74.2	163.3	0	0	0	0	0	103.2	K639 K643	K639-A641 HydrophobicContact CB-CB 4.39Å; K639-A641 PolarHBondContact O-N 3.13Å; A641-K643 PolarHBondContact O-N 2.94Å
642	G	32.6	Very low	36.6	Very low	62 Å²	62	129.1 Å²	129.1	64%	0.639	72%	0.717	S	S	*	*	S	Bend	trans	52.4	58.3	167.4	0	0	0	0	0	115.2	D640	D640-G642 PolarHBondContact O-N 2.84Å
643	K	36.3	Very low	36.6	Very low	179 Å²	179	124.6 Å²	124.6	78%	0.778	70%	0.699	S	S	*	*			trans	-83.7	12.3	154	-80.2	-169.5	177.7	-179	0	112.6	A641	A641-K643 PolarHBondContact O-N 2.94Å
644	G	28	Very low	37.2	Very low	59 Å²	59	122.6 Å²	122.6	61%	0.608	69%	0.693	S	S	*	*	S	Bend	trans	-83.1	132.1	159.9	0	0	0	0	0	109.1	E646	G644-E646 PolarHBondContact O-N 3.02Å
645	I	33.2	Very low	38.2	Very low	137 Å²	137	122 Å²	122	70%	0.703	68%	0.678	S	S	*	*			trans	-40.5	133.3	154.3	-64	160	0	0	0	106.9	E647	I645-E647 PolarHBondContact O-N 3.09Å
646	E	30.7	Very low	39.2	Very low	137 Å²	137	120 Å²	120	64%	0.64	66%	0.66	S	S	*	*			trans	-60.8	95.7	161.1	-144.7	173.4	-145	0	0	104.3	G644 V648	G644-E646 PolarHBondContact O-N 3.02Å; E646-V648 HydrophobicContact CB-CG2 3.93Å; E646-V648 HydrophobicContact CG-CG2 3.75Å; E646-V648 PolarHBondContact O-N 3.34Å
647	E	35.7	Very low	39.9	Very low	186 Å²	186	123.3 Å²	123.3	87%	0.869	67%	0.666	S	S	*	*			trans	-62.8	78.5	158.5	-78.4	-176.3	174.1	0	0	104.7	I645 E649	I645-E647 PolarHBondContact O-N 3.09Å; E647-E649 PolarHBondContact O-N 2.83Å
648	V	37.3	Very low	41.1	Very low	90 Å²	90	120.6 Å²	120.6	55%	0.545	64%	0.64	S	S	.	*			trans	-71.7	120.5	163.4	-176.5	0	0	0	0	104	E646 E650	E646-V648 HydrophobicContact CB-CG2 3.93Å; E646-V648 HydrophobicContact CG-CG2 3.75Å; E646-V648 PolarHBondContact O-N 3.34Å; V648-E650 PolarHBondContact O-N 3.46Å
649	E	35.8	Very low	42	Very low	156 Å²	156	122.5 Å²	122.5	73%	0.729	64%	0.638	S	S	*	*			trans	-29.6	132.9	171.6	-65	173.5	157.2	0	0	110.5	E647 E651	E647-E649 PolarHBondContact O-N 2.83Å; E649-E651 PolarHBondContact O-N 3.21Å
650	E	40.3	Very low	43.2	Very low	197 Å²	197	114.9 Å²	114.9	92%	0.921	61%	0.607	S	S	*	*			trans	-61.5	66.8	171.9	-65.7	-178.5	153	0	0	109.7	V648 E652	V648-E650 PolarHBondContact O-N 3.46Å; E650-E652 PolarHBondContact O-N 3.26Å
651	E	40.5	Very low	44.4	Very low	146 Å²	146	117.3 Å²	117.3	68%	0.682	61%	0.606	S	S	*	*			trans	-73.4	115.9	167.2	-75.3	-165.2	159.2	0	0	107.1	E649 L653	E649-E651 PolarHBondContact O-N 3.21Å; E651-L653 PolarHBondContact O-N 3.42Å
652	E	42.4	Very low	45.8	Very low	199 Å²	199	117 Å²	117	93%	0.93	60%	0.597	S	S	*	*			trans	-51.4	68.5	-179.9	-59	176	146.2	0	0	113.6	E650 S654	E650-E652 PolarHBondContact O-N 3.26Å; E652-S654 PolarHBondContact O-N 2.99Å
653	L	46.8	Very low	47.4	Very low	92 Å²	92	120 Å²	120	48%	0.482	59%	0.588	S	S	.	*			trans	-83.7	108.6	172.3	-74.6	166.6	0	0	0	109.1	E651 E658	E651-L653 PolarHBondContact O-N 3.42Å; L653-E658 HydrophobicContact CB-CG 4.01Å
654	S	55.3	Low	48.3	Very low	72 Å²	72	116.2 Å²	116.2	50%	0.503	59%	0.585	S	S	.	*			trans	-53.2	138.9	170.2	180	0	0	0	0	111.4	E652 L656 K657	E652-S654 PolarHBondContact O-N 2.99Å; S654-L656 PolarHBondContact O-N 3.48Å; S654-K657 PolarHBondContact O-N 2.76Å
655	L	59.1	Low	49.8	Very low	40 Å²	40	123.9 Å²	123.9	21%	0.209	60%	0.595	C	S	.	*	T	Hydrogen-bonded Turn	trans	-44.7	-24	179.1	-69.4	169.6	0	0	0	115.2	L154	L154-L655 HydrophobicContact CG-CD2 4.14Å
656	L	57.9	Low	51.5	Low	93 Å²	93	120.9 Å²	120.9	49%	0.487	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.8	-19.4	179.6	-67.5	166.6	0	0	0	114.2	L204 P205 S654	L204-L656 HydrophobicContact CD2-CD2 3.74Å; L204-L656 HydrophobicContact CD2-CG 4.47Å; P205-L656 WeakPolarHBondContact CG-O 3.35Å; S654-L656 PolarHBondContact O-N 3.48Å
657	K	53.5	Low	53.7	Low	166 Å²	166	117.1 Å²	117.1	72%	0.722	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.6	-10.3	-176.2	-67.2	-177.5	-178.9	177	0	113.9	S654 Q659	S654-K657 PolarHBondContact O-N 2.76Å; K657-Q659 PolarHBondContact O-N 3.01Å
658	E	59.6	Low	56	Low	22 Å²	22	112.8 Å²	112.8	10%	0.103	55%	0.554	C	S	.	*			trans	-69.6	122.1	-178.4	-68.7	-170.4	141.7	0	0	111.5	S153 L154 L653	S153-E658 WeakPolarHBondContact CB-OE1 3.36Å; S153-E658 PolarHBondContact OG-OE1 2.76Å; S153-E658 PolarHBondContact OG-OE2 3.11Å; L154-E658 WeakPolarHBondContact CB-OE2 3.39Å; L154-E658 PolarHBondContact N-OE2 2.78Å; L653-E658 HydrophobicContact CB-CG 4.01Å
659	Q	53.8	Low	58.3	Low	130 Å²	130	110.4 Å²	110.4	61%	0.607	54%	0.538	S	S	*	.			trans	-106.6	123.2	167.4	-72.7	-173.9	-5.7	0	0	109.7	K657 R661	K657-Q659 PolarHBondContact O-N 3.01Å; Q659-R661 VanDerWaalsContact OE1-NH2 3.11Å
660	I	60.4	Low	60.8	Low	30 Å²	30	105.1 Å²	105.1	15%	0.154	51%	0.514	C	S	.	.			trans	-76.9	126.5	175.4	-69	179.6	0	0	0	109.4	L154 Y158 I185 L186 L206	L154-I660 HydrophobicContact CB-CD1 4.3Å; L154-I660 HydrophobicContact CD1-CD1 4.49Å; Y158-I660 WeakPolarHBondContact OH-CG2 3.36Å; I185-I660 HydrophobicContact CG2-CD1 3.51Å; L186-I660 HydrophobicContact CD2-CG2 3.48Å; L186-I660 VanDerWaalsContact CD2-CG2 3.48Å; L206-I660 HydrophobicContact CD1-CD1 3.54Å; L206-I660 HydrophobicContact CD1-CG1 4.41Å; L206-I660 HydrophobicContact CG-CD1 4.28Å
661	R	61.8	Low	63.1	Low	184 Å²	184	97.6 Å²	97.6	69%	0.694	48%	0.479	S	S	*	.			trans	-129.3	150.4	173.5	-64.4	-175.6	-175.6	178.7	3.3	110.5	Q659	Q659-R661 VanDerWaalsContact OE1-NH2 3.11Å
662	P	60.2	Low	65.4	Low	81 Å²	81	96.2 Å²	96.2	53%	0.526	47%	0.468	S	S	.	.			trans	-55.9	154.4	169	-20.8	31.8	0	0	0	111.3
663	R	66.1	Low	67.4	Low	123 Å²	123	87.8 Å²	87.8	46%	0.464	43%	0.429	S	S	.	.			trans	-55.6	139.5	179.3	-60.7	-175.3	-171.3	-168.3	2	111.5	E182 I666	E182-R663 IonicContact OE1-CZ 3.25Å; E182-R663 IonicContact OE1-NE 3.52Å; E182-R663 PolarHBondContact OE1-NE 3.15Å; E182-R663 IonicContact OE1-NH2 3.59Å; E182-R663 IonicContact OE2-CZ 2.61Å; E182-R663 IonicContact OE2-NE 2.76Å; E182-R663 PolarHBondContact OE2-NE 3.5Å; E182-R663 IonicContact OE2-NH2 2.65Å; E182-R663 PolarHBondContact OE2-NH2 2.9Å; R663-I666 HydrophobicContact CB-CG1 4.44Å
664	S	55	Low	69.1	Low	100 Å²	100	89 Å²	89	70%	0.699	43%	0.432	S	S	*	.	S	Bend	trans	-69.5	-35.3	-177.1	53.7	0	0	0	0	113.4
665	R	61	Low	70.5	Confident	221 Å²	221	91.2 Å²	91.2	83%	0.834	43%	0.434	S	S	*	.	S	Bend	trans	-118.1	104.1	174.8	-68.6	-177.4	-179.1	-179.9	2.6	109.8
666	I	67.9	Low	71.7	Confident	74 Å²	74	91.2 Å²	91.2	38%	0.379	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-98.1	129.8	175.9	-54.2	174.3	0	0	0	107.8	A487 R663	A487-I666 HydrophobicContact CB-CG2 3.87Å; R663-I666 HydrophobicContact CB-CG1 4.44Å
667	P	77.5	Confident	72.9	Confident	57 Å²	57	92 Å²	92	37%	0.37	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-64.4	162.9	174.1	26.1	-31.6	0	0	0	111.4	D484 D486 A487 L669	D484-P667 VanDerWaalsContact OD2-CB 3.3Å; D484-P667 WeakPolarHBondContact OD2-CB 3.3Å; D484-P667 WeakPolarHBondContact OD2-CG 3.3Å; D486-P667 HydrophobicContact CB-CG 4.39Å; A487-P667 HydrophobicContact CB-CG 4.23Å; A487-P667 WeakPolarHBondContact CB-O 3.5Å; P667-L669 PolarHBondContact O-N 3.4Å
668	T	84.3	Confident	74.5	Confident	95 Å²	95	84.3 Å²	84.3	58%	0.583	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-65	128.8	177.5	50.6	0	0	0	0	110.6	L670	T668-L670 VanDerWaalsContact C-N 3.29Å; T668-L670 PolarHBondContact O-N 3.17Å
669	L	86	Confident	75.7	Confident	40 Å²	40	86 Å²	86	21%	0.209	42%	0.415	C	S	.	.	S	Bend	trans	-58.3	-39.8	-176.4	179.5	65.8	0	0	0	113.2	V483 D484 A487 L488 F498 P667	V483-L669 HydrophobicContact CG1-CD1 4.3Å; D484-L669 PolarHBondContact N-O 2.85Å; A487-L669 HydrophobicContact CB-CB 4.31Å; A487-L669 HydrophobicContact CB-CD1 4.05Å; L488-L669 HydrophobicContact CB-CD1 3.88Å; L488-L669 HydrophobicContact CD1-CD1 4.06Å; F498-L669 HydrophobicContact CB-CD2 4.25Å; F498-L669 HydrophobicContact CD1-CD2 4.09Å; F498-L669 HydrophobicContact CD2-CD2 4.47Å; F498-L669 HydrophobicContact CG-CD2 4.02Å; P667-L669 PolarHBondContact O-N 3.4Å
670	L	88.3	Confident	77.3	Confident	46 Å²	46	84.6 Å²	84.6	24%	0.241	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	129.7	-178.1	-60.7	173.4	0	0	0	108.8	Y481 V483 F498 L533 P543 T668	Y481-L670 HydrophobicContact CD1-CB 4.15Å; V483-L670 HydrophobicContact CG2-CD2 4.13Å; F498-L670 HydrophobicContact CE2-CD2 4.49Å; F498-L670 HydrophobicContact CZ-CD2 3.96Å; L533-L670 HydrophobicContact CD1-CD1 3.62Å; L533-L670 HydrophobicContact CD1-CD2 4.36Å; P543-L670 HydrophobicContact CG-CD1 3.98Å; T668-L670 VanDerWaalsContact C-N 3.29Å; T668-L670 PolarHBondContact O-N 3.17Å
671	Q	88.8	Confident	78.7	Confident	38 Å²	38	83.4 Å²	83.4	18%	0.178	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	140.5	173.4	-67.3	175.5	-4.4	0	0	108.9	Y482	Y482-Q671 HydrophobicContact CD1-CB 4.38Å; Y482-Q671 PolarHBondContact N-O 2.79Å; Y482-Q671 PolarHBondContact O-N 2.79Å
672	R	87	Confident	80.1	Confident	118 Å²	118	76.7 Å²	76.7	45%	0.445	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	149.7	175.7	-62.5	-178	170.8	-171.4	-6.3	109.6	Y481 H674 E675	Y481-R672 HydrophobicContact CD1-CG 4.22Å; Y481-R672 HydrophobicContact CE1-CG 3.68Å; R672-H674 WeakPolarHBondContact CD-CE1 3.37Å; R672-H674 WeakPolarHBondContact CD-NE2 3.49Å; R672-H674 PolarHBondContact O-N 3.26Å; R672-E675 HydrophobicContact CB-CG 4.05Å; R672-E675 PolarHBondContact N-OE2 3.41Å; R672-E675 WeakPolarHBondContact O-CB 3.44Å; R672-E675 PolarHBondContact O-N 3.17Å
673	L	85.2	Confident	81.7	Confident	22 Å²	22	72.8 Å²	72.8	12%	0.115	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-63	-28.1	-176.9	-69.9	174.4	0	0	0	113.8	L480 F530 Y623 E675	L480-L673 HydrophobicContact CB-CD1 3.76Å; L480-L673 HydrophobicContact CD2-CD1 4.05Å; L480-L673 HydrophobicContact CG-CD1 4.11Å; L480-L673 WeakPolarHBondContact O-CD1 3.37Å; L480-L673 VanDerWaalsContact O-CG 3.28Å; L480-L673 WeakPolarHBondContact O-CG 3.46Å; F530-L673 HydrophobicContact CD1-CD2 3.88Å; F530-L673 HydrophobicContact CE1-CD2 3.64Å; Y623-L673 HydrophobicContact CD1-CD2 4.37Å; Y623-L673 HydrophobicContact CD2-CB 3.95Å; Y623-L673 HydrophobicContact CD2-CD2 3.83Å; Y623-L673 HydrophobicContact CD2-CG 4.32Å; Y623-L673 HydrophobicContact CE2-CB 4.28Å; Y623-L673 HydrophobicContact CE2-CD2 3.99Å; Y623-L673 WeakPolarHBondContact CE2-O 3.47Å; Y623-L673 HydrophobicContact CG-CD2 4.03Å; L673-E675 VanDerWaalsContact C-N 3.3Å
674	H	83.3	Confident	83	Confident	118 Å²	118	67 Å²	67	55%	0.546	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-74.1	-20.2	176	50.4	-102.4	0	0	0	113.4	R672 R676	R672-H674 WeakPolarHBondContact CD-CE1 3.37Å; R672-H674 WeakPolarHBondContact CD-NE2 3.49Å; R672-H674 PolarHBondContact O-N 3.26Å; H674-R676 VanDerWaalsContact C-N 3.32Å
675	E	84.3	Confident	84.9	Confident	118 Å²	118	62.2 Å²	62.2	55%	0.551	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-79.3	-17.4	-179.8	-62.8	165.4	177	0	0	112.1	R672 L673	R672-E675 HydrophobicContact CB-CG 4.05Å; R672-E675 PolarHBondContact N-OE2 3.41Å; R672-E675 WeakPolarHBondContact O-CB 3.44Å; R672-E675 PolarHBondContact O-N 3.17Å; L673-E675 VanDerWaalsContact C-N 3.3Å
676	R	83.9	Confident	86.6	Confident	39 Å²	39	51.9 Å²	51.9	15%	0.147	26%	0.261	C	S	.	.	S	Bend	trans	-120	117.1	-175.1	-176.6	-170.2	-175.2	-96	0	111.5	Y623 H674 E679	Y623-R676 VanDerWaalsContact CE2-O 3.27Å; Y623-R676 WeakPolarHBondContact CE2-O 3.4Å; Y623-R676 WeakPolarHBondContact OH-CD 3.44Å; Y623-R676 WeakPolarHBondContact OH-CG 3.38Å; Y623-R676 PolarHBondContact OH-NH1 3.47Å; Y623-R676 PolarHBondContact OH-O 3.42Å; H674-R676 VanDerWaalsContact C-N 3.32Å; R676-E679 IonicContact CZ-OE1 3.49Å; R676-E679 IonicContact CZ-OE2 2.7Å; R676-E679 IonicContact NH1-OE1 3.6Å; R676-E679 IonicContact NH1-OE2 3.57Å; R676-E679 PolarHBondContact NH1-OE2 3.33Å; R676-E679 IonicContact NH2-OE1 3.44Å; R676-E679 PolarHBondContact NH2-OE1 2.92Å; R676-E679 IonicContact NH2-OE2 2.73Å; R676-E679 PolarHBondContact NH2-OE2 3.28Å
677	V	83.9	Confident	87.8	Confident	111 Å²	111	49.9 Å²	49.9	67%	0.673	25%	0.254	S	S	*	.	P	Polyproline II helix	trans	-66.8	127	171.6	-176.7	0	0	0	0	110.5
678	P	85.6	Confident	88.5	Confident	4 Å²	4	48.4 Å²	48.4	3%	0.026	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-74.5	150.1	177	29.4	-35.2	0	0	0	112.8	Y623 Y624 R626	Y623-P678 HydrophobicContact CD1-CB 4.17Å; Y623-P678 HydrophobicContact CE1-CB 3.66Å; Y623-P678 HydrophobicContact CE2-CB 4.06Å; Y623-P678 HydrophobicContact CE2-CG 4.25Å; Y623-P678 WeakPolarHBondContact O-CG 3.31Å; Y624-P678 HydrophobicContact CD1-CB 4.12Å; Y624-P678 HydrophobicContact CE1-CB 4.44Å; R626-P678 HydrophobicContact CG-CG 3.9Å
679	E	86.1	Confident	88.8	Confident	58 Å²	58	44.9 Å²	44.9	27%	0.271	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-58.2	156.2	166.2	-61.9	84.8	176.3	0	0	111.5	H528 L553 R676	H528-E679 IonicContact NE2-OE1 2.73Å; L553-E679 HydrophobicContact CD1-CG 4.04Å; R676-E679 IonicContact CZ-OE1 3.49Å; R676-E679 IonicContact CZ-OE2 2.7Å; R676-E679 IonicContact NH1-OE1 3.6Å; R676-E679 IonicContact NH1-OE2 3.57Å; R676-E679 PolarHBondContact NH1-OE2 3.33Å; R676-E679 IonicContact NH2-OE1 3.44Å; R676-E679 PolarHBondContact NH2-OE1 2.92Å; R676-E679 IonicContact NH2-OE2 2.73Å; R676-E679 PolarHBondContact NH2-OE2 3.28Å
680	H	86.9	Confident	89	Confident	99 Å²	99	43.4 Å²	43.4	46%	0.458	22%	0.216	S	C	.	.	P	Polyproline II helix	trans	-72.4	128.8	172.7	-179.8	-90.8	0	0	0	110.2	C594 D682	C594-H680 PolarHBondContact SG-O 2.58Å; H680-D682 IonicContact CE1-OD1 3.33Å; H680-D682 PolarHBondContact CE1-OD1 2.98Å; H680-D682 IonicContact ND1-OD1 3.83Å
681	V	89.8	Confident	89	Confident	5 Å²	5	43 Å²	43	3%	0.03	22%	0.215	C	C	.	.			trans	-134.7	122.9	-174.1	178.1	0	0	0	0	110.5	V596 Y624 Y683 I684	V596-V681 HydrophobicContact CB-CG1 4.22Å; V596-V681 HydrophobicContact CG2-CB 4.18Å; V596-V681 HydrophobicContact CG2-CG1 3.62Å; V596-V681 HydrophobicContact CG2-CG2 3.4Å; V596-V681 VanDerWaalsContact CG2-CG2 3.4Å; Y624-V681 HydrophobicContact CD1-CB 4.32Å; Y624-V681 HydrophobicContact CD1-CG2 3.54Å; Y624-V681 HydrophobicContact CE1-CG2 3.93Å; Y624-V681 HydrophobicContact CG-CG2 4.27Å; V681-Y683 WeakPolarHBondContact CG1-O 3.48Å; V681-I684 HydrophobicContact CG1-CG1 4.21Å
682	D	91.3	Very high	89.1	Confident	43 Å²	43	42.9 Å²	42.9	23%	0.23	22%	0.217	C	C	.	.	S	Bend	trans	-85.7	-33.3	178.1	-61.5	-55.5	0	0	0	112.4	L593 C594 H680 P727	L593-D682 HydrophobicContact CB-CB 4.13Å; L593-D682 HydrophobicContact CD2-CB 4.35Å; C594-D682 PolarHBondContact N-OD2 3.21Å; C594-D682 WeakPolarHBondContact O-CB 3.35Å; C594-D682 PolarHBondContact O-N 3.25Å; H680-D682 IonicContact CE1-OD1 3.33Å; H680-D682 PolarHBondContact CE1-OD1 2.98Å; H680-D682 IonicContact ND1-OD1 3.83Å; D682-P727 WeakPolarHBondContact O-CD 3.16Å
683	Y	92.9	Very high	89.1	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	150.6	178.8	72.5	-89.9	0	0	0	112.7	I577 F590 L593 G595 V596 V681 L724	I577-Y683 HydrophobicContact CB-CE2 4.45Å; I577-Y683 HydrophobicContact CD1-CE2 4.44Å; I577-Y683 HydrophobicContact CG2-CE2 3.88Å; F590-Y683 HydrophobicContact CE1-CE1 4.12Å; F590-Y683 AromaticContact CE1-CZ 3.96Å; F590-Y683 HydrophobicContact CE2-CD1 4.45Å; F590-Y683 HydrophobicContact CE2-CE1 4.45Å; F590-Y683 HydrophobicContact CZ-CD1 4.15Å; F590-Y683 HydrophobicContact CZ-CD2 4.43Å; F590-Y683 AromaticContact CZ-CE1 3.81Å; F590-Y683 HydrophobicContact CZ-CE1 3.81Å; F590-Y683 HydrophobicContact CZ-CE2 4.12Å; F590-Y683 HydrophobicContact CZ-CG 4.44Å; F590-Y683 AromaticContact CZ-CZ 3.79Å; L593-Y683 HydrophobicContact CB-CD1 4.24Å; L593-Y683 HydrophobicContact CB-CE1 4.13Å; G595-Y683 CarbonylContact C-O 3.45Å; G595-Y683 VanDerWaalsContact CA-CE1 3.42Å; G595-Y683 VanDerWaalsContact CA-CZ 3.45Å; G595-Y683 VanDerWaalsContact CA-O 3.31Å; G595-Y683 WeakPolarHBondContact CA-O 3.34Å; V596-Y683 PolarHBondContact N-O 3.16Å; V681-Y683 WeakPolarHBondContact CG1-O 3.48Å; Y683-L724 HydrophobicContact CD2-CD2 3.98Å; Y683-L724 HydrophobicContact CE2-CD2 4.22Å
684	I	94.7	Very high	89.4	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	118.5	170.3	-55.9	173.6	0	0	0	107.2	V596 I598 K621 Y624 V681 F703 L724 H725	V596-I684 CarbonylContact O-C 3.58Å; V596-I684 VanDerWaalsContact O-CA 3.31Å; V596-I684 WeakPolarHBondContact O-CA 3.39Å; I598-I684 HydrophobicContact CD1-CG2 3.71Å; I598-I684 HydrophobicContact CG1-CG2 3.89Å; K621-I684 HydrophobicContact CG-CD1 4.17Å; Y624-I684 HydrophobicContact CD2-CD1 4.2Å; V681-I684 HydrophobicContact CG1-CG1 4.21Å; I684-F703 HydrophobicContact CG2-CE1 4.1Å; I684-F703 HydrophobicContact CG2-CZ 4.01Å; I684-F703 WeakPolarHBondContact O-CE1 3.45Å; I684-L724 CarbonylContact O-C 3.2Å; I684-H725 PolarHBondContact N-O 3.01Å; I684-H725 PolarHBondContact O-N 3.49Å
685	G	95.1	Very high	89.8	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	161.8	-179.3	0	0	0	0	0	113	V596 R597 I598 M723	V596-G685 PolarHBondContact O-N 3.16Å; R597-G685 CarbonylContact C-O 3.51Å; R597-G685 WeakPolarHBondContact CA-O 3.48Å; I598-G685 PolarHBondContact N-O 3.16Å; G685-M723 CarbonylContact C-O 3.53Å; G685-M723 VanDerWaalsContact CA-O 3.3Å; G685-M723 WeakPolarHBondContact CA-O 3.21Å
686	T	95.3	Very high	90.2	Very high	4 Å²	4	40.5 Å²	40.5	3%	0.025	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	150.5	168.2	-174.3	0	0	0	0	109.9	I598 Y688 W698 F703 I722 M723	I598-T686 PolarHBondContact O-OG1 2.94Å; T686-Y688 HydrophobicContact CG2-CD1 4.06Å; T686-Y688 HydrophobicContact CG2-CE1 4.15Å; T686-W698 HydrophobicContact CG2-CD2 3.85Å; T686-W698 HydrophobicContact CG2-CE3 4.07Å; T686-W698 HydrophobicContact CG2-CG 4.32Å; T686-W698 HydrophobicContact CG2-CH2 4.28Å; T686-W698 HydrophobicContact CG2-CZ2 4.08Å; T686-W698 HydrophobicContact CG2-CZ3 4.28Å; T686-W698 WeakPolarHBondContact OG1-CZ2 3.44Å; T686-F703 HydrophobicContact CG2-CD1 4.28Å; T686-F703 HydrophobicContact CG2-CE1 4.49Å; T686-I722 VanDerWaalsContact O-CA 3.3Å; T686-I722 WeakPolarHBondContact O-CA 3.41Å; T686-M723 HydrophobicContact CG2-CB 3.99Å; T686-M723 PolarHBondContact N-O 3.28Å; T686-M723 PolarHBondContact O-N 3.5Å
687	S	93	Very high	90.6	Very high	33 Å²	33	41.3 Å²	41.3	23%	0.231	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	124	173.8	-174.3	0	0	0	0	109.6	C721	S687-C721 WeakPolarHBondContact CA-O 3.44Å
688	Y	92.1	Very high	91.1	Very high	26 Å²	26	36.6 Å²	36.6	10%	0.102	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	162.1	-176.6	67.7	-80.9	0	0	0	111.9	T686 L694 L695 W698 S720 C721 M723	T686-Y688 HydrophobicContact CG2-CD1 4.06Å; T686-Y688 HydrophobicContact CG2-CE1 4.15Å; Y688-L694 HydrophobicContact CD2-CB 3.71Å; Y688-L694 HydrophobicContact CD2-CD1 3.64Å; Y688-L694 HydrophobicContact CD2-CG 4.32Å; Y688-L694 HydrophobicContact CE2-CB 3.45Å; Y688-L694 VanDerWaalsContact CE2-CB 3.45Å; Y688-L694 HydrophobicContact CE2-CD1 4.25Å; Y688-L694 HydrophobicContact CE2-CG 4.5Å; Y688-L694 HydrophobicContact CG-CD1 4.48Å; Y688-L695 WeakPolarHBondContact OH-CA 3.48Å; Y688-W698 AromaticContact CD1-CD1 3.83Å; Y688-W698 AromaticContact CD1-NE1 3.58Å; Y688-W698 AromaticContact CE1-CD1 3.27Å; Y688-W698 HydrophobicContact CE1-CG 4.1Å; Y688-W698 AromaticContact CE1-NE1 3.55Å; Y688-W698 AromaticContact CZ-CD1 3.41Å; Y688-W698 VanDerWaalsContact CZ-CD1 3.41Å; Y688-W698 AromaticContact CZ-NE1 3.97Å; Y688-S720 WeakPolarHBondContact O-CA 3.05Å; Y688-C721 PolarHBondContact N-O 3.2Å; Y688-C721 VanDerWaalsContact N-O 3.09Å; Y688-C721 PolarHBondContact O-N 3.01Å; Y688-M723 HydrophobicContact CE1-CG 3.98Å; Y688-M723 HydrophobicContact CE1-SD 3.79Å; Y688-M723 PolarHBondContact OH-SD 3.1Å
689	G	90.7	Very high	91.4	Very high	20 Å²	20	37.6 Å²	37.6	21%	0.206	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	123.5	171.9	0	0	0	0	0	111.3	T691 E718	G689-T691 PolarHBondContact O-N 2.66Å; G689-T691 VanDerWaalsContact O-N 3.16Å; G689-E718 WeakPolarHBondContact CA-OE2 3.35Å
690	L	91.4	Very high	91.6	Very high	10 Å²	10	40.7 Å²	40.7	5%	0.052	21%	0.208	C	C	.	.			trans	-66.3	114.3	-170.4	-178.4	69	0	0	0	111.4	L695 L708 H719 C721 F755 L759 L763	L690-L695 HydrophobicContact CD1-CB 4.26Å; L690-L695 HydrophobicContact CD1-CD1 4.14Å; L690-L695 HydrophobicContact CD1-CD2 4.36Å; L690-L695 HydrophobicContact CD1-CG 4.48Å; L690-L708 HydrophobicContact CB-CD1 4.34Å; L690-L708 HydrophobicContact CD2-CD1 3.85Å; L690-L708 HydrophobicContact CD2-CD2 4.42Å; L690-H719 VanDerWaalsContact CB-O 3.27Å; L690-H719 WeakPolarHBondContact CB-O 3.45Å; L690-H719 PolarHBondContact N-O 3.02Å; L690-C721 HydrophobicContact CB-CB 4.24Å; L690-C721 HydrophobicContact CD1-CB 4.15Å; L690-F755 HydrophobicContact CD2-CE2 3.99Å; L690-L759 HydrophobicContact CD1-CD1 4.24Å; L690-L759 HydrophobicContact CD2-CD1 4.28Å; L690-L759 HydrophobicContact CD2-CD2 3.9Å; L690-L759 HydrophobicContact CD2-CG 4.24Å; L690-L759 HydrophobicContact CG-CD1 4.1Å; L690-L759 HydrophobicContact CG-CD2 4.16Å; L690-L763 HydrophobicContact CD1-CD2 4.05Å; L690-L763 HydrophobicContact CD2-CD1 3.97Å; L690-L763 HydrophobicContact CD2-CD2 4.23Å; L690-L763 HydrophobicContact CD2-CG 4.49Å
691	T	88.8	Confident	91.8	Very high	37 Å²	37	36.9 Å²	36.9	23%	0.227	19%	0.193	C	C	.	.			trans	-131	154.8	170	63.2	0	0	0	0	110.5	G689 E693 L694 L695 E718	G689-T691 PolarHBondContact O-N 2.66Å; G689-T691 VanDerWaalsContact O-N 3.16Å; T691-E693 VanDerWaalsContact C-N 3.29Å; T691-E693 PolarHBondContact O-N 2.59Å; T691-L694 PolarHBondContact O-N 3.47Å; T691-L694 WeakPolarHBondContact OG1-CB 3.31Å; T691-L694 WeakPolarHBondContact OG1-CG 3.3Å; T691-L694 PolarHBondContact OG1-N 3.21Å; T691-L695 VanDerWaalsContact O-CB 3.3Å; T691-L695 WeakPolarHBondContact O-CB 3.3Å; T691-L695 PolarHBondContact O-N 2.9Å; T691-E718 HydrophobicContact CG2-CG 4.47Å; T691-E718 WeakPolarHBondContact CG2-OE1 3.33Å
692	T	89.3	Confident	91.8	Very high	36 Å²	36	37.6 Å²	37.6	22%	0.221	20%	0.202	C	C	.	.	H	α-helix	trans	-61	-36.9	-179.6	-56.8	0	0	0	0	112.5	K696	T692-K696 HydrophobicContact CG2-CD 4.38Å; T692-K696 VanDerWaalsContact O-CG 3.28Å; T692-K696 WeakPolarHBondContact O-CG 3.47Å; T692-K696 PolarHBondContact O-N 3.21Å
693	E	88.2	Confident	91.9	Very high	130 Å²	130	35.6 Å²	35.6	61%	0.607	19%	0.191	S	C	*	.	H	α-helix	trans	-68.2	-48.4	178.9	-64.2	-168	151.9	0	0	111.8	R609 T691 K696 F697	R609-E693 IonicContact NH2-OE1 2.75Å; R609-E693 PolarHBondContact NH2-OE1 2.83Å; T691-E693 VanDerWaalsContact C-N 3.29Å; T691-E693 PolarHBondContact O-N 2.59Å; E693-K696 PolarHBondContact O-N 3.42Å; E693-F697 PolarHBondContact O-N 3.25Å
694	L	90.7	Very high	92	Very high	71 Å²	71	35.7 Å²	35.7	37%	0.372	19%	0.192	S	C	.	.	H	α-helix	trans	-68.5	-38.9	179.8	-67	176.5	0	0	0	111.7	Y688 T691 K696 F697 W698	Y688-L694 HydrophobicContact CD2-CB 3.71Å; Y688-L694 HydrophobicContact CD2-CD1 3.64Å; Y688-L694 HydrophobicContact CD2-CG 4.32Å; Y688-L694 HydrophobicContact CE2-CB 3.45Å; Y688-L694 VanDerWaalsContact CE2-CB 3.45Å; Y688-L694 HydrophobicContact CE2-CD1 4.25Å; Y688-L694 HydrophobicContact CE2-CG 4.5Å; Y688-L694 HydrophobicContact CG-CD1 4.48Å; T691-L694 PolarHBondContact O-N 3.47Å; T691-L694 WeakPolarHBondContact OG1-CB 3.31Å; T691-L694 WeakPolarHBondContact OG1-CG 3.3Å; T691-L694 PolarHBondContact OG1-N 3.21Å; L694-K696 VanDerWaalsContact C-N 3.32Å; L694-K696 PolarHBondContact O-N 2.96Å; L694-F697 WeakPolarHBondContact O-CB 3.44Å; L694-F697 PolarHBondContact O-N 2.89Å; L694-W698 PolarHBondContact O-N 2.77Å
695	L	92.9	Very high	92	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-59.4	-44.2	176	-176	65.6	0	0	0	111.5	Y688 L690 T691 K699 M723 L759 A762 L763	Y688-L695 WeakPolarHBondContact OH-CA 3.48Å; L690-L695 HydrophobicContact CD1-CB 4.26Å; L690-L695 HydrophobicContact CD1-CD1 4.14Å; L690-L695 HydrophobicContact CD1-CD2 4.36Å; L690-L695 HydrophobicContact CD1-CG 4.48Å; T691-L695 VanDerWaalsContact O-CB 3.3Å; T691-L695 WeakPolarHBondContact O-CB 3.3Å; T691-L695 PolarHBondContact O-N 2.9Å; L695-K699 HydrophobicContact CD1-CD 4.34Å; L695-K699 HydrophobicContact CD1-CG 4.46Å; L695-K699 HydrophobicContact CG-CD 4.26Å; L695-K699 WeakPolarHBondContact O-CB 3.45Å; L695-K699 VanDerWaalsContact O-CG 3.29Å; L695-K699 WeakPolarHBondContact O-CG 3.41Å; L695-K699 PolarHBondContact O-N 3.12Å; L695-M723 HydrophobicContact CD1-CE 4.13Å; L695-M723 HydrophobicContact CD1-SD 4.03Å; L695-L759 HydrophobicContact CD2-CD1 3.76Å; L695-A762 HydrophobicContact CD2-CB 3.74Å; L695-L763 HydrophobicContact CD1-CD2 3.99Å; L695-L763 HydrophobicContact CD2-CD2 3.84Å; L695-L763 HydrophobicContact CD2-CG 4.02Å
696	K	91.9	Very high	91.9	Very high	124 Å²	124	35.7 Å²	35.7	54%	0.539	19%	0.192	S	C	.	.	H	α-helix	trans	-63	-43.5	175.4	-74.5	173.9	-178.1	178.6	0	111.6	T692 E693 L694 K699 N700	T692-K696 HydrophobicContact CG2-CD 4.38Å; T692-K696 VanDerWaalsContact O-CG 3.28Å; T692-K696 WeakPolarHBondContact O-CG 3.47Å; T692-K696 PolarHBondContact O-N 3.21Å; E693-K696 PolarHBondContact O-N 3.42Å; L694-K696 VanDerWaalsContact C-N 3.32Å; L694-K696 PolarHBondContact O-N 2.96Å; K696-K699 PolarHBondContact O-N 3.41Å; K696-N700 WeakPolarHBondContact O-CB 3.35Å; K696-N700 PolarHBondContact O-N 2.92Å; K696-N700 PolarHBondContact O-ND2 2.88Å
697	F	92.5	Very high	91.8	Very high	56 Å²	56	37.8 Å²	37.8	25%	0.246	20%	0.199	C	C	.	.	H	α-helix	trans	-56.5	-52.1	177.1	170.8	-99.7	0	0	0	111.7	I617 E693 L694 N700 A701	I617-F697 HydrophobicContact CG1-CE1 4.46Å; I617-F697 HydrophobicContact CG1-CZ 3.98Å; E693-F697 PolarHBondContact O-N 3.25Å; L694-F697 WeakPolarHBondContact O-CB 3.44Å; L694-F697 PolarHBondContact O-N 2.89Å; F697-N700 PolarHBondContact O-N 3.25Å; F697-A701 PolarHBondContact O-N 3.41Å
698	W	94.1	Very high	91.8	Very high	11 Å²	11	36.8 Å²	36.8	4%	0.042	19%	0.191	C	C	.	.	H	α-helix	trans	-69.1	-36.5	-178	-68.8	117.9	0	0	0	113	I598 V601 I617 T686 Y688 L694 A701 G702 F703 M723	I598-W698 HydrophobicContact CB-CH2 4.49Å; I598-W698 HydrophobicContact CD1-CH2 4.1Å; I598-W698 HydrophobicContact CD1-CZ3 4.02Å; I598-W698 HydrophobicContact CG2-CH2 4.11Å; V601-W698 HydrophobicContact CG2-CH2 3.81Å; V601-W698 HydrophobicContact CG2-CZ2 4.17Å; I617-W698 HydrophobicContact CD1-CH2 4.12Å; I617-W698 HydrophobicContact CD1-CZ3 4.01Å; I617-W698 HydrophobicContact CG1-CZ3 4.41Å; T686-W698 HydrophobicContact CG2-CD2 3.85Å; T686-W698 HydrophobicContact CG2-CE3 4.07Å; T686-W698 HydrophobicContact CG2-CG 4.32Å; T686-W698 HydrophobicContact CG2-CH2 4.28Å; T686-W698 HydrophobicContact CG2-CZ2 4.08Å; T686-W698 HydrophobicContact CG2-CZ3 4.28Å; T686-W698 WeakPolarHBondContact OG1-CZ2 3.44Å; Y688-W698 AromaticContact CD1-CD1 3.83Å; Y688-W698 AromaticContact CD1-NE1 3.58Å; Y688-W698 AromaticContact CE1-CD1 3.27Å; Y688-W698 HydrophobicContact CE1-CG 4.1Å; Y688-W698 AromaticContact CE1-NE1 3.55Å; Y688-W698 AromaticContact CZ-CD1 3.41Å; Y688-W698 VanDerWaalsContact CZ-CD1 3.41Å; Y688-W698 AromaticContact CZ-NE1 3.97Å; L694-W698 PolarHBondContact O-N 2.77Å; W698-A701 CarbonylContact O-C 3.58Å; W698-A701 WeakPolarHBondContact O-CB 3.24Å; W698-A701 PolarHBondContact O-N 2.87Å; W698-G702 PolarHBondContact O-N 3.49Å; W698-F703 HydrophobicContact CB-CB 4.2Å; W698-F703 HydrophobicContact CE3-CD1 4.42Å; W698-F703 AromaticContact CE3-CD2 3.66Å; W698-F703 HydrophobicContact CE3-CD2 3.66Å; W698-F703 HydrophobicContact CE3-CE1 4.45Å; W698-F703 AromaticContact CE3-CE2 3.68Å; W698-F703 HydrophobicContact CE3-CE2 3.68Å; W698-F703 HydrophobicContact CE3-CG 4.05Å; W698-F703 HydrophobicContact CE3-CZ 4.1Å; W698-F703 HydrophobicContact CZ3-CD2 4.23Å; W698-F703 HydrophobicContact CZ3-CE1 4.4Å; W698-F703 AromaticContact CZ3-CE2 3.76Å; W698-F703 HydrophobicContact CZ3-CE2 3.76Å; W698-F703 AromaticContact CZ3-CZ 3.87Å; W698-F703 HydrophobicContact CZ3-CZ 3.87Å; W698-F703 WeakPolarHBondContact O-CB 3.26Å; W698-F703 PolarHBondContact O-N 3.31Å; W698-M723 HydrophobicContact CB-CE 4.18Å; W698-M723 HydrophobicContact CB-SD 3.56Å; W698-M723 VanDerWaalsContact CB-SD 3.56Å; W698-M723 HydrophobicContact CG-SD 4.2Å
699	K	91.9	Very high	91.8	Very high	26 Å²	26	36.1 Å²	36.1	11%	0.113	19%	0.191	C	C	.	.	H	α-helix	trans	-64.8	-42.7	173.6	-76.2	-170.6	175.5	-151.3	0	112.6	L695 K696 A701 G702 M723 A762 L763 K765	L695-K699 HydrophobicContact CD1-CD 4.34Å; L695-K699 HydrophobicContact CD1-CG 4.46Å; L695-K699 HydrophobicContact CG-CD 4.26Å; L695-K699 WeakPolarHBondContact O-CB 3.45Å; L695-K699 VanDerWaalsContact O-CG 3.29Å; L695-K699 WeakPolarHBondContact O-CG 3.41Å; L695-K699 PolarHBondContact O-N 3.12Å; K696-K699 PolarHBondContact O-N 3.41Å; K699-A701 PolarHBondContact O-N 2.9Å; K699-G702 PolarHBondContact O-N 2.86Å; K699-M723 HydrophobicContact CG-CE 4.02Å; K699-A762 PolarHBondContact NZ-O 3.13Å; K699-L763 PolarHBondContact NZ-O 2.8Å; K699-K765 PolarHBondContact NZ-O 3.46Å
700	N	90.7	Very high	91.8	Very high	123 Å²	123	40.1 Å²	40.1	66%	0.658	20%	0.204	S	C	*	.	H	α-helix	trans	-65.5	-24.2	174.8	-70.6	-13.5	0	0	0	112.5	K696 F697 G702	K696-N700 WeakPolarHBondContact O-CB 3.35Å; K696-N700 PolarHBondContact O-N 2.92Å; K696-N700 PolarHBondContact O-ND2 2.88Å; F697-N700 PolarHBondContact O-N 3.25Å; N700-G702 VanDerWaalsContact C-N 3.32Å
701	A	90.9	Very high	91.7	Very high	19 Å²	19	46.7 Å²	46.7	16%	0.157	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-5.1	171.8	0	0	0	0	0	113.1	I617 K621 F697 W698 K699 F703	I617-A701 HydrophobicContact CG2-CB 4.1Å; K621-A701 WeakPolarHBondContact CE-O 3.27Å; K621-A701 PolarHBondContact NZ-O 2.86Å; F697-A701 PolarHBondContact O-N 3.41Å; W698-A701 CarbonylContact O-C 3.58Å; W698-A701 WeakPolarHBondContact O-CB 3.24Å; W698-A701 PolarHBondContact O-N 2.87Å; K699-A701 PolarHBondContact O-N 2.9Å; A701-F703 HydrophobicContact CB-CD2 3.91Å; A701-F703 HydrophobicContact CB-CE2 4.13Å
702	G	90.2	Very high	91.5	Very high	20 Å²	20	47.3 Å²	47.3	21%	0.206	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.4	22.1	178.8	0	0	0	0	0	115.2	W698 K699 N700 H725 S768	W698-G702 PolarHBondContact O-N 3.49Å; K699-G702 PolarHBondContact O-N 2.86Å; N700-G702 VanDerWaalsContact C-N 3.32Å; G702-H725 PolarHBondContact O-ND1 3.44Å; G702-S768 WeakPolarHBondContact CA-OG 3.17Å
703	F	93.7	Very high	91.2	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.246	C	C	.	.			trans	-88.2	150.8	174.2	-74.3	-106.1	0	0	0	111.7	I598 I617 I684 T686 W698 A701 M723 H725 N766	I598-F703 HydrophobicContact CD1-CE1 4.45Å; I598-F703 HydrophobicContact CD1-CZ 3.88Å; I617-F703 HydrophobicContact CG2-CE2 3.97Å; I684-F703 HydrophobicContact CG2-CE1 4.1Å; I684-F703 HydrophobicContact CG2-CZ 4.01Å; I684-F703 WeakPolarHBondContact O-CE1 3.45Å; T686-F703 HydrophobicContact CG2-CD1 4.28Å; T686-F703 HydrophobicContact CG2-CE1 4.49Å; W698-F703 HydrophobicContact CB-CB 4.2Å; W698-F703 HydrophobicContact CE3-CD1 4.42Å; W698-F703 AromaticContact CE3-CD2 3.66Å; W698-F703 HydrophobicContact CE3-CD2 3.66Å; W698-F703 HydrophobicContact CE3-CE1 4.45Å; W698-F703 AromaticContact CE3-CE2 3.68Å; W698-F703 HydrophobicContact CE3-CE2 3.68Å; W698-F703 HydrophobicContact CE3-CG 4.05Å; W698-F703 HydrophobicContact CE3-CZ 4.1Å; W698-F703 HydrophobicContact CZ3-CD2 4.23Å; W698-F703 HydrophobicContact CZ3-CE1 4.4Å; W698-F703 AromaticContact CZ3-CE2 3.76Å; W698-F703 HydrophobicContact CZ3-CE2 3.76Å; W698-F703 AromaticContact CZ3-CZ 3.87Å; W698-F703 HydrophobicContact CZ3-CZ 3.87Å; W698-F703 WeakPolarHBondContact O-CB 3.26Å; W698-F703 PolarHBondContact O-N 3.31Å; A701-F703 HydrophobicContact CB-CD2 3.91Å; A701-F703 HydrophobicContact CB-CE2 4.13Å; F703-M723 HydrophobicContact CB-CB 3.98Å; F703-M723 HydrophobicContact CB-CE 4.1Å; F703-M723 HydrophobicContact CD1-CB 4.44Å; F703-M723 WeakPolarHBondContact O-CE 3.35Å; F703-H725 HydrophobicContact CD1-CB 3.65Å; F703-H725 HydrophobicContact CD2-CB 4.24Å; F703-H725 HydrophobicContact CE1-CB 3.71Å; F703-H725 HydrophobicContact CE2-CB 4.3Å; F703-H725 HydrophobicContact CG-CB 3.93Å; F703-H725 HydrophobicContact CZ-CB 4.04Å; F703-N766 PolarHBondContact O-ND2 3.35Å
704	V	93.4	Very high	90.5	Very high	3 Å²	3	50 Å²	50	2%	0.018	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	126.6	-175.2	-175.6	0	0	0	0	110.1	M723 L724 L733 Y737 N766 V769	V704-M723 CarbonylContact O-C 3.59Å; V704-M723 WeakPolarHBondContact O-CA 3.18Å; V704-M723 WeakPolarHBondContact O-CB 3.33Å; V704-L724 PolarHBondContact N-O 3.17Å; V704-L724 PolarHBondContact O-N 2.83Å; V704-L733 HydrophobicContact CB-CD1 4.2Å; V704-L733 HydrophobicContact CB-CD2 4.09Å; V704-L733 HydrophobicContact CB-CG 4.17Å; V704-L733 HydrophobicContact CG1-CD1 4.45Å; V704-L733 HydrophobicContact CG1-CG 4.41Å; V704-L733 HydrophobicContact CG2-CD2 3.85Å; V704-L733 HydrophobicContact CG2-CG 4.29Å; V704-Y737 HydrophobicContact CG1-CD1 4.36Å; V704-Y737 HydrophobicContact CG1-CD2 3.69Å; V704-Y737 HydrophobicContact CG1-CE2 4.48Å; V704-Y737 HydrophobicContact CG1-CG 3.62Å; V704-N766 WeakPolarHBondContact CA-ND2 3.43Å; V704-V769 HydrophobicContact CB-CG2 4.37Å; V704-V769 HydrophobicContact CG1-CG2 3.88Å; V704-V769 HydrophobicContact CG2-CG2 3.52Å
705	P	94.4	Very high	89.4	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	132.3	-180	32.4	-32.7	0	0	0	110.6	M723 Y737 F740	P705-M723 HydrophobicContact CB-CE 4.12Å; P705-M723 HydrophobicContact CB-CG 4.12Å; P705-M723 HydrophobicContact CG-CE 4.31Å; P705-Y737 HydrophobicContact CG-CD2 4.03Å; P705-Y737 HydrophobicContact CG-CE2 3.65Å; P705-Y737 WeakPolarHBondContact O-CD2 3.17Å; P705-F740 HydrophobicContact CB-CD1 4.32Å; P705-F740 HydrophobicContact CB-CE1 3.72Å; P705-F740 HydrophobicContact CB-CZ 3.83Å; P705-F740 HydrophobicContact CG-CD1 4.12Å; P705-F740 HydrophobicContact CG-CE1 3.65Å; P705-F740 HydrophobicContact CG-CZ 4.27Å; P705-F740 WeakPolarHBondContact O-CD1 3.47Å
706	V	93.5	Very high	88.6	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	-28	-176.2	172.1	0	0	0	0	111.5	V581 Y585 I722 L724 L733 Y736 F740	V581-V706 HydrophobicContact CG2-CG1 4.38Å; Y585-V706 HydrophobicContact CE2-CG1 3.64Å; Y585-V706 PolarHBondContact OH-O 2.87Å; V706-I722 PolarHBondContact N-O 3.16Å; V706-L724 HydrophobicContact CB-CD1 4.32Å; V706-L724 HydrophobicContact CB-CG 4.3Å; V706-L724 HydrophobicContact CG1-CD1 4.35Å; V706-L724 HydrophobicContact CG2-CB 4.23Å; V706-L724 HydrophobicContact CG2-CD1 3.92Å; V706-L724 HydrophobicContact CG2-CG 3.91Å; V706-L733 HydrophobicContact CG2-CD1 3.86Å; V706-Y736 HydrophobicContact CG1-CG 4.37Å; V706-F740 VanDerWaalsContact C-CD2 3.48Å; V706-F740 WeakPolarHBondContact O-CD2 3.23Å
707	Y	94	Very high	87.9	Confident	47 Å²	47	47.4 Å²	47.4	18%	0.184	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	146.3	179.3	170.6	-90.4	0	0	0	111.4	Q584 C721 I722	Q584-Y707 HydrophobicContact CB-CD2 4.19Å; Q584-Y707 HydrophobicContact CG-CD2 3.92Å; Q584-Y707 HydrophobicContact CG-CE2 4.41Å; Y707-C721 CarbonylContact O-C 3.59Å; Y707-C721 WeakPolarHBondContact O-CA 3.23Å; Y707-C721 PolarHBondContact O-SG 3.02Å; Y707-C721 VanDerWaalsContact O-SG 3.41Å; Y707-I722 HydrophobicContact CD1-CB 4.46Å; Y707-I722 HydrophobicContact CD1-CD1 3.71Å; Y707-I722 HydrophobicContact CD1-CG1 3.95Å; Y707-I722 HydrophobicContact CE1-CD1 4.45Å; Y707-I722 HydrophobicContact CG-CD1 4.25Å; Y707-I722 PolarHBondContact N-O 2.9Å; Y707-I722 PolarHBondContact O-N 3.42Å
708	L	93.6	Very high	87.6	Confident	12 Å²	12	47.8 Å²	47.8	6%	0.063	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	125.1	174.3	-179.9	65.3	0	0	0	108.7	L690 H719 S720 C721 F740 F752 F755 L763	L690-L708 HydrophobicContact CB-CD1 4.34Å; L690-L708 HydrophobicContact CD2-CD1 3.85Å; L690-L708 HydrophobicContact CD2-CD2 4.42Å; L708-H719 HydrophobicContact CD1-CB 3.82Å; L708-S720 WeakPolarHBondContact CA-O 3.34Å; L708-C721 HydrophobicContact CD1-CB 4.04Å; L708-F740 HydrophobicContact CB-CE2 3.85Å; L708-F740 HydrophobicContact CB-CZ 4.32Å; L708-F752 HydrophobicContact CD2-CD1 4.48Å; L708-F752 HydrophobicContact CD2-CD2 4.32Å; L708-F752 HydrophobicContact CD2-CE1 3.95Å; L708-F752 HydrophobicContact CD2-CE2 3.77Å; L708-F752 HydrophobicContact CD2-CZ 3.56Å; L708-F752 HydrophobicContact CG-CE1 4.22Å; L708-F752 HydrophobicContact CG-CE2 4.47Å; L708-F752 HydrophobicContact CG-CZ 3.85Å; L708-F755 HydrophobicContact CD2-CE2 4.18Å; L708-L763 HydrophobicContact CD2-CD1 4.34Å
709	S	91.9	Very high	87.4	Confident	12 Å²	12	48.1 Å²	48.1	8%	0.084	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	140.3	179.8	72.7	0	0	0	0	111.5	K711 H719 S720	S709-K711 PolarHBondContact OG-O 3.25Å; S709-H719 PolarHBondContact O-ND1 2.65Å; S709-S720 PolarHBondContact N-O 3.18Å; S709-S720 PolarHBondContact OG-N 3.46Å
710	Q	90.1	Very high	87.4	Confident	104 Å²	104	49.1 Å²	49.1	49%	0.486	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	-39.3	173.4	-67.6	179.2	30	0	0	111.6	S712 H719 L747 T751 F752	Q710-S712 PolarHBondContact O-N 3.13Å; Q710-H719 PolarHBondContact O-CE1 3.15Å; Q710-H719 PolarHBondContact O-ND1 3.14Å; Q710-L747 HydrophobicContact CG-CD1 4.21Å; Q710-T751 HydrophobicContact CB-CG2 4.17Å; Q710-T751 WeakPolarHBondContact O-CG2 3.12Å; Q710-F752 HydrophobicContact CG-CZ 4.44Å
711	K	88.6	Confident	87.6	Confident	148 Å²	148	43.3 Å²	43.3	64%	0.643	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-74.4	128.1	172.8	-166.8	179.6	174.6	-175.5	0	109	S709 E714	S709-K711 PolarHBondContact OG-O 3.25Å; K711-E714 IonicContact NZ-OE1 2.91Å; K711-E714 PolarHBondContact NZ-OE1 3.19Å
712	S	86.1	Confident	87.8	Confident	50 Å²	50	42.4 Å²	42.4	35%	0.35	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	149.2	167.7	56.6	0	0	0	0	109.8	Q710 E714	Q710-S712 PolarHBondContact O-N 3.13Å; S712-E714 PolarHBondContact O-N 3.31Å
713	N	82.9	Confident	88.1	Confident	72 Å²	72	41.5 Å²	41.5	39%	0.385	22%	0.217	S	C	.	.	P	Polyproline II helix	trans	-72.1	126.9	172.2	-174.5	0.8	0	0	0	109.3	L715 T716 A717 E718	N713-L715 PolarHBondContact O-N 3.19Å; N713-L715 VanDerWaalsContact O-N 3.13Å; N713-L715 PolarHBondContact OD1-N 2.99Å; N713-T716 PolarHBondContact O-N 2.64Å; N713-A717 WeakPolarHBondContact O-CA 3.38Å; N713-A717 PolarHBondContact O-N 3.13Å; N713-E718 PolarHBondContact N-O 3.15Å
714	E	71.8	Confident	88.1	Confident	150 Å²	150	41.5 Å²	41.5	70%	0.701	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-28.7	-178.8	-69.7	163.9	-153.8	0	0	112.5	K711 S712	K711-E714 IonicContact NZ-OE1 2.91Å; K711-E714 PolarHBondContact NZ-OE1 3.19Å; S712-E714 PolarHBondContact O-N 3.31Å
715	L	69.1	Low	88.1	Confident	72 Å²	72	43.2 Å²	43.2	38%	0.377	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-33.1	-175.8	-67.8	173.8	0	0	0	114.7	P389 Y511 K512 N713	P389-L715 WeakPolarHBondContact CG-O 3.09Å; Y511-L715 WeakPolarHBondContact CE1-O 3.49Å; Y511-L715 PolarHBondContact OH-O 3.34Å; Y511-L715 VanDerWaalsContact OH-O 3.04Å; K512-L715 HydrophobicContact CD-CD1 4.06Å; N713-L715 PolarHBondContact O-N 3.19Å; N713-L715 VanDerWaalsContact O-N 3.13Å; N713-L715 PolarHBondContact OD1-N 2.99Å
716	T	74.8	Confident	87.9	Confident	20 Å²	20	44 Å²	44	12%	0.123	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.1	-14.6	-178.7	56.2	0	0	0	0	112.6	Y511 N713 E718	Y511-T716 HydrophobicContact CD1-CG2 3.46Å; Y511-T716 VanDerWaalsContact CD1-CG2 3.46Å; Y511-T716 HydrophobicContact CE1-CG2 3.62Å; Y511-T716 HydrophobicContact CG-CG2 4.06Å; N713-T716 PolarHBondContact O-N 2.64Å; T716-E718 PolarHBondContact O-N 3.19Å; T716-E718 PolarHBondContact OG1-N 3.04Å
717	A	77.6	Confident	87.3	Confident	51 Å²	51	45.4 Å²	45.4	42%	0.421	24%	0.238	S	C	.	.			trans	55.4	16.6	-165	0	0	0	0	0	114	P389 N713	P389-A717 HydrophobicContact CB-CB 4.08Å; P389-A717 HydrophobicContact CG-CB 3.88Å; N713-A717 WeakPolarHBondContact O-CA 3.38Å; N713-A717 PolarHBondContact O-N 3.13Å
718	E	85.6	Confident	86.4	Confident	63 Å²	63	47.6 Å²	47.6	29%	0.294	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-100.9	153.6	179.3	-64.7	170.5	176.3	0	0	111	G689 T691 N713 T716	G689-E718 WeakPolarHBondContact CA-OE2 3.35Å; T691-E718 HydrophobicContact CG2-CG 4.47Å; T691-E718 WeakPolarHBondContact CG2-OE1 3.33Å; N713-E718 PolarHBondContact N-O 3.15Å; T716-E718 PolarHBondContact O-N 3.19Å; T716-E718 PolarHBondContact OG1-N 3.04Å
719	H	90.9	Very high	85.2	Confident	19 Å²	19	52.2 Å²	52.2	9%	0.088	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	135.5	175.2	-66.1	-106.5	0	0	0	110.3	L690 L708 S709 Q710 C721 F752 F755	L690-H719 VanDerWaalsContact CB-O 3.27Å; L690-H719 WeakPolarHBondContact CB-O 3.45Å; L690-H719 PolarHBondContact N-O 3.02Å; L708-H719 HydrophobicContact CD1-CB 3.82Å; S709-H719 PolarHBondContact O-ND1 2.65Å; Q710-H719 PolarHBondContact O-CE1 3.15Å; Q710-H719 PolarHBondContact O-ND1 3.14Å; H719-C721 PolarHBondContact O-N 3.38Å; H719-F752 AromaticContact CE1-CE1 3.88Å; H719-F752 AromaticContact ND1-CE1 3.63Å; H719-F755 HydrophobicContact CB-CZ 4.07Å; H719-F755 AromaticContact CD2-CE1 3.26Å; H719-F755 WeakPolarHBondContact CD2-CE1 3.45Å; H719-F755 AromaticContact CD2-CZ 3.24Å; H719-F755 WeakPolarHBondContact CD2-CZ 3.39Å; H719-F755 AromaticContact CG-CZ 3.62Å; H719-F755 AromaticContact NE2-CE1 3.44Å; H719-F755 WeakPolarHBondContact NE2-CE1 3.26Å; H719-F755 AromaticContact NE2-CZ 3.7Å
720	S	92	Very high	84.4	Confident	47 Å²	47	53.9 Å²	53.9	33%	0.329	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	123.4	179.5	-63.7	0	0	0	0	110.3	Y688 L708 S709	Y688-S720 WeakPolarHBondContact O-CA 3.05Å; L708-S720 WeakPolarHBondContact CA-O 3.34Å; S709-S720 PolarHBondContact N-O 3.18Å; S709-S720 PolarHBondContact OG-N 3.46Å
721	C	94.3	Very high	83.9	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	135.3	175	-173.3	0	0	0	0	110.3	S687 Y688 L690 Y707 L708 H719	S687-C721 WeakPolarHBondContact CA-O 3.44Å; Y688-C721 PolarHBondContact N-O 3.2Å; Y688-C721 VanDerWaalsContact N-O 3.09Å; Y688-C721 PolarHBondContact O-N 3.01Å; L690-C721 HydrophobicContact CB-CB 4.24Å; L690-C721 HydrophobicContact CD1-CB 4.15Å; Y707-C721 CarbonylContact O-C 3.59Å; Y707-C721 WeakPolarHBondContact O-CA 3.23Å; Y707-C721 PolarHBondContact O-SG 3.02Å; Y707-C721 VanDerWaalsContact O-SG 3.41Å; L708-C721 HydrophobicContact CD1-CB 4.04Å; H719-C721 PolarHBondContact O-N 3.38Å
722	I	95.6	Very high	83.8	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	126.5	170	-58.2	171.2	0	0	0	108.2	I577 N580 T686 V706 Y707 L724	I577-I722 HydrophobicContact CD1-CG2 4.24Å; I577-I722 HydrophobicContact CG1-CG2 4.12Å; I577-I722 HydrophobicContact CG2-CG2 4.21Å; N580-I722 HydrophobicContact CB-CD1 3.82Å; T686-I722 VanDerWaalsContact O-CA 3.3Å; T686-I722 WeakPolarHBondContact O-CA 3.41Å; V706-I722 PolarHBondContact N-O 3.16Å; Y707-I722 HydrophobicContact CD1-CB 4.46Å; Y707-I722 HydrophobicContact CD1-CD1 3.71Å; Y707-I722 HydrophobicContact CD1-CG1 3.95Å; Y707-I722 HydrophobicContact CE1-CD1 4.45Å; Y707-I722 HydrophobicContact CG-CD1 4.25Å; Y707-I722 PolarHBondContact N-O 2.9Å; Y707-I722 PolarHBondContact O-N 3.42Å; I722-L724 HydrophobicContact CG2-CD2 4.01Å
723	M	95.4	Very high	84	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	140	173.8	-52.4	-173.9	71.9	0	0	110.3	G685 T686 Y688 L695 W698 K699 F703 V704 P705	G685-M723 CarbonylContact C-O 3.53Å; G685-M723 VanDerWaalsContact CA-O 3.3Å; G685-M723 WeakPolarHBondContact CA-O 3.21Å; T686-M723 HydrophobicContact CG2-CB 3.99Å; T686-M723 PolarHBondContact N-O 3.28Å; T686-M723 PolarHBondContact O-N 3.5Å; Y688-M723 HydrophobicContact CE1-CG 3.98Å; Y688-M723 HydrophobicContact CE1-SD 3.79Å; Y688-M723 PolarHBondContact OH-SD 3.1Å; L695-M723 HydrophobicContact CD1-CE 4.13Å; L695-M723 HydrophobicContact CD1-SD 4.03Å; W698-M723 HydrophobicContact CB-CE 4.18Å; W698-M723 HydrophobicContact CB-SD 3.56Å; W698-M723 VanDerWaalsContact CB-SD 3.56Å; W698-M723 HydrophobicContact CG-SD 4.2Å; K699-M723 HydrophobicContact CG-CE 4.02Å; F703-M723 HydrophobicContact CB-CB 3.98Å; F703-M723 HydrophobicContact CB-CE 4.1Å; F703-M723 HydrophobicContact CD1-CB 4.44Å; F703-M723 WeakPolarHBondContact O-CE 3.35Å; V704-M723 CarbonylContact O-C 3.59Å; V704-M723 WeakPolarHBondContact O-CA 3.18Å; V704-M723 WeakPolarHBondContact O-CB 3.33Å; P705-M723 HydrophobicContact CB-CE 4.12Å; P705-M723 HydrophobicContact CB-CG 4.12Å; P705-M723 HydrophobicContact CG-CE 4.31Å
724	L	94.5	Very high	84.2	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	153.6	-179.1	-54.3	-175.6	0	0	0	110.9	I577 F590 Y683 I684 V704 V706 I722 W732 L733	I577-L724 HydrophobicContact CD1-CD2 4.28Å; I577-L724 HydrophobicContact CG2-CD2 3.8Å; F590-L724 HydrophobicContact CE2-CD1 3.89Å; F590-L724 HydrophobicContact CZ-CD1 3.76Å; Y683-L724 HydrophobicContact CD2-CD2 3.98Å; Y683-L724 HydrophobicContact CE2-CD2 4.22Å; I684-L724 CarbonylContact O-C 3.2Å; V704-L724 PolarHBondContact N-O 3.17Å; V704-L724 PolarHBondContact O-N 2.83Å; V706-L724 HydrophobicContact CB-CD1 4.32Å; V706-L724 HydrophobicContact CB-CG 4.3Å; V706-L724 HydrophobicContact CG1-CD1 4.35Å; V706-L724 HydrophobicContact CG2-CB 4.23Å; V706-L724 HydrophobicContact CG2-CD1 3.92Å; V706-L724 HydrophobicContact CG2-CG 3.91Å; I722-L724 HydrophobicContact CG2-CD2 4.01Å; L724-W732 HydrophobicContact CD1-CZ3 4.27Å; L724-L733 HydrophobicContact CB-CD1 3.85Å; L724-L733 HydrophobicContact CD1-CD1 4.46Å
725	H	93.1	Very high	84.9	Confident	39 Å²	39	43.7 Å²	43.7	18%	0.181	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	137	171.3	174.5	72.4	0	0	0	107.8	K621 I684 G702 F703	K621-H725 PolarHBondContact NZ-CD2 3.48Å; K621-H725 PolarHBondContact NZ-CE1 3.26Å; K621-H725 VanDerWaalsContact NZ-CE1 3.26Å; K621-H725 PolarHBondContact NZ-ND1 3.08Å; K621-H725 PolarHBondContact NZ-NE2 3.16Å; I684-H725 PolarHBondContact N-O 3.01Å; I684-H725 PolarHBondContact O-N 3.49Å; G702-H725 PolarHBondContact O-ND1 3.44Å; F703-H725 HydrophobicContact CD1-CB 3.65Å; F703-H725 HydrophobicContact CD2-CB 4.24Å; F703-H725 HydrophobicContact CE1-CB 3.71Å; F703-H725 HydrophobicContact CE2-CB 4.3Å; F703-H725 HydrophobicContact CG-CB 3.93Å; F703-H725 HydrophobicContact CZ-CB 4.04Å
726	T	90.1	Very high	86	Confident	18 Å²	18	41.3 Å²	41.3	11%	0.11	25%	0.251	C	S	.	.			trans	-105.6	122.4	177.9	49	0	0	0	0	108.4	N728 T730 W732 L733	T726-N728 VanDerWaalsContact CB-O 3.23Å; T726-N728 WeakPolarHBondContact CB-O 3.44Å; T726-N728 PolarHBondContact O-N 3.36Å; T726-N728 PolarHBondContact OG1-O 3.05Å; T726-T730 WeakPolarHBondContact CG2-OG1 3.49Å; T726-W732 HydrophobicContact CG2-CH2 3.58Å; T726-W732 HydrophobicContact CG2-CZ2 3.4Å; T726-W732 HydrophobicContact CG2-CZ3 4.44Å; T726-L733 HydrophobicContact CG2-CB 4.39Å; T726-L733 HydrophobicContact CG2-CD2 4.13Å
727	P	80.9	Confident	86.7	Confident	28 Å²	28	40.4 Å²	40.4	18%	0.182	25%	0.245	C	C	.	.	S	Bend	trans	-65.9	-32.2	177.7	24.7	-30.9	0	0	0	111.4	A625 D682	A625-P727 HydrophobicContact CB-CB 4.16Å; D682-P727 WeakPolarHBondContact O-CD 3.16Å
728	N	75.9	Confident	87.2	Confident	93 Å²	93	40.7 Å²	40.7	50%	0.497	24%	0.238	S	C	.	.	S	Bend	trans	-97.7	137.8	170.5	-62.1	-28.8	0	0	0	109.4	T726 T730	T726-N728 VanDerWaalsContact CB-O 3.23Å; T726-N728 WeakPolarHBondContact CB-O 3.44Å; T726-N728 PolarHBondContact O-N 3.36Å; T726-N728 PolarHBondContact OG1-O 3.05Å; N728-T730 PolarHBondContact O-N 3.02Å
729	A	68.8	Low	87.4	Confident	110 Å²	110	40 Å²	40	91%	0.909	24%	0.236	S	C	*	.			trans	-67.8	93.6	-179.7	0	0	0	0	0	110.8
730	T	73.6	Confident	87.4	Confident	47 Å²	47	39.4 Å²	39.4	29%	0.288	23%	0.233	S	C	.	.			trans	-108.2	139.3	178.9	55.7	0	0	0	0	111.6	T726 N728 W732	T726-T730 WeakPolarHBondContact CG2-OG1 3.49Å; N728-T730 PolarHBondContact O-N 3.02Å; T730-W732 PolarHBondContact O-N 2.65Å; T730-W732 PolarHBondContact OG1-NE1 2.64Å; T730-W732 VanDerWaalsContact OG1-NE1 3.13Å
731	P	80.4	Confident	87.3	Confident	114 Å²	114	38.9 Å²	38.9	74%	0.74	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-22.6	-173.4	28.2	-34.5	0	0	0	113.9	L733 G734	P731-L733 VanDerWaalsContact C-N 3.29Å; P731-L733 PolarHBondContact O-N 3.46Å; P731-G734 PolarHBondContact O-N 3.2Å
732	W	87.2	Confident	87	Confident	59 Å²	59	45.3 Å²	45.3	22%	0.223	25%	0.248	C	C	.	.	H	α-helix	trans	-64.5	-29	-173.9	59.1	-106.5	0	0	0	113.7	F590 L593 L724 T726 T730 G734 L735 Y736	F590-W732 HydrophobicContact CD2-CZ3 4.35Å; F590-W732 AromaticContact CE2-CH2 3.87Å; F590-W732 HydrophobicContact CE2-CH2 3.87Å; F590-W732 AromaticContact CE2-CZ3 3.83Å; F590-W732 HydrophobicContact CE2-CZ3 3.83Å; L593-W732 HydrophobicContact CD1-CZ2 4.25Å; L724-W732 HydrophobicContact CD1-CZ3 4.27Å; T726-W732 HydrophobicContact CG2-CH2 3.58Å; T726-W732 HydrophobicContact CG2-CZ2 3.4Å; T726-W732 HydrophobicContact CG2-CZ3 4.44Å; T730-W732 PolarHBondContact O-N 2.65Å; T730-W732 PolarHBondContact OG1-NE1 2.64Å; T730-W732 VanDerWaalsContact OG1-NE1 3.13Å; W732-G734 VanDerWaalsContact C-N 3.26Å; W732-G734 PolarHBondContact O-N 2.95Å; W732-L735 WeakPolarHBondContact O-CB 3.14Å; W732-L735 PolarHBondContact O-N 2.77Å; W732-Y736 HydrophobicContact CD2-CE2 4.42Å; W732-Y736 AromaticContact CE3-CD2 3.49Å; W732-Y736 HydrophobicContact CE3-CD2 3.49Å; W732-Y736 VanDerWaalsContact CE3-CD2 3.49Å; W732-Y736 AromaticContact CE3-CE2 3.36Å; W732-Y736 HydrophobicContact CE3-CE2 3.36Å; W732-Y736 AromaticContact CZ3-CD2 3.74Å; W732-Y736 HydrophobicContact CZ3-CD2 3.74Å; W732-Y736 AromaticContact CZ3-CE2 3.65Å; W732-Y736 HydrophobicContact CZ3-CE2 3.65Å; W732-Y736 PolarHBondContact O-N 3.09Å
733	L	88.9	Confident	86.8	Confident	11 Å²	11	48.8 Å²	48.8	6%	0.058	26%	0.261	C	S	.	.	H	α-helix	trans	-64.5	-34	179.5	-177.5	61	0	0	0	111.8	V704 V706 L724 T726 P731 Y737	V704-L733 HydrophobicContact CB-CD1 4.2Å; V704-L733 HydrophobicContact CB-CD2 4.09Å; V704-L733 HydrophobicContact CB-CG 4.17Å; V704-L733 HydrophobicContact CG1-CD1 4.45Å; V704-L733 HydrophobicContact CG1-CG 4.41Å; V704-L733 HydrophobicContact CG2-CD2 3.85Å; V704-L733 HydrophobicContact CG2-CG 4.29Å; V706-L733 HydrophobicContact CG2-CD1 3.86Å; L724-L733 HydrophobicContact CB-CD1 3.85Å; L724-L733 HydrophobicContact CD1-CD1 4.46Å; T726-L733 HydrophobicContact CG2-CB 4.39Å; T726-L733 HydrophobicContact CG2-CD2 4.13Å; P731-L733 VanDerWaalsContact C-N 3.29Å; P731-L733 PolarHBondContact O-N 3.46Å; L733-Y737 PolarHBondContact O-N 3.19Å; L733-Y737 VanDerWaalsContact O-N 3.1Å
734	G	87.1	Confident	86.6	Confident	15 Å²	15	49 Å²	49	16%	0.155	26%	0.263	C	S	.	.	H	α-helix	trans	-64.7	-39.5	175.4	0	0	0	0	0	112.5	P731 W732 Y737 Q738	P731-G734 PolarHBondContact O-N 3.2Å; W732-G734 VanDerWaalsContact C-N 3.26Å; W732-G734 PolarHBondContact O-N 2.95Å; G734-Y737 PolarHBondContact O-N 2.74Å; G734-Q738 WeakPolarHBondContact O-CG 3.46Å; G734-Q738 PolarHBondContact O-N 3.31Å
735	L	87.9	Confident	86.4	Confident	110 Å²	110	49.3 Å²	49.3	58%	0.576	26%	0.264	S	S	*	.	H	α-helix	trans	-64.7	-44.7	177.9	-61.4	176.3	0	0	0	111.6	W732 Y737 Q738 D739	W732-L735 WeakPolarHBondContact O-CB 3.14Å; W732-L735 PolarHBondContact O-N 2.77Å; L735-Y737 VanDerWaalsContact C-N 3.3Å; L735-Y737 PolarHBondContact O-N 3.01Å; L735-Q738 PolarHBondContact O-N 3.3Å; L735-D739 PolarHBondContact O-N 3.43Å; L735-D739 VanDerWaalsContact O-N 3.13Å
736	Y	90.5	Very high	86.3	Confident	22 Å²	22	52.9 Å²	52.9	9%	0.086	28%	0.279	C	S	.	.	H	α-helix	trans	-62.2	-38.2	174.4	-70.3	-40.4	0	0	0	112.2	V581 Y585 D587 F590 V706 W732 D739 F740	V581-Y736 HydrophobicContact CG1-CE2 4.47Å; Y585-Y736 AromaticContact CD1-CD1 3.69Å; Y585-Y736 HydrophobicContact CD1-CD1 3.69Å; Y585-Y736 HydrophobicContact CD1-CE1 4.03Å; Y585-Y736 HydrophobicContact CD2-CD1 4.15Å; Y585-Y736 HydrophobicContact CD2-CE1 4.21Å; Y585-Y736 AromaticContact CE1-CD1 3.75Å; Y585-Y736 HydrophobicContact CE1-CD1 3.75Å; Y585-Y736 HydrophobicContact CE2-CD1 4.22Å; Y585-Y736 AromaticContact CG-CD1 3.9Å; Y585-Y736 HydrophobicContact CG-CD1 3.9Å; Y585-Y736 AromaticContact CG-CE1 3.86Å; Y585-Y736 HydrophobicContact CG-CE1 3.86Å; Y585-Y736 PolarHBondContact OH-O 3.33Å; D587-Y736 PolarHBondContact OD2-OH 3.08Å; F590-Y736 AromaticContact CD2-CE2 3.81Å; F590-Y736 HydrophobicContact CD2-CE2 3.81Å; F590-Y736 HydrophobicContact CE2-CE2 4.14Å; V706-Y736 HydrophobicContact CG1-CG 4.37Å; W732-Y736 HydrophobicContact CD2-CE2 4.42Å; W732-Y736 AromaticContact CE3-CD2 3.49Å; W732-Y736 HydrophobicContact CE3-CD2 3.49Å; W732-Y736 VanDerWaalsContact CE3-CD2 3.49Å; W732-Y736 AromaticContact CE3-CE2 3.36Å; W732-Y736 HydrophobicContact CE3-CE2 3.36Å; W732-Y736 AromaticContact CZ3-CD2 3.74Å; W732-Y736 HydrophobicContact CZ3-CD2 3.74Å; W732-Y736 AromaticContact CZ3-CE2 3.65Å; W732-Y736 HydrophobicContact CZ3-CE2 3.65Å; W732-Y736 PolarHBondContact O-N 3.09Å; Y736-D739 PolarHBondContact O-N 3.35Å; Y736-F740 VanDerWaalsContact O-CB 3.24Å; Y736-F740 WeakPolarHBondContact O-CB 3.44Å; Y736-F740 PolarHBondContact O-N 3.35Å
737	Y	90.6	Very high	86.3	Confident	1 Å²	1	53.6 Å²	53.6	0%	0.004	28%	0.282	C	S	.	.	H	α-helix	trans	-66.2	-37.9	178	-176.2	-126.5	0	0	0	112.7	V704 P705 L733 G734 L735 F740 R741 L763 L764 N766 V769 T771	V704-Y737 HydrophobicContact CG1-CD1 4.36Å; V704-Y737 HydrophobicContact CG1-CD2 3.69Å; V704-Y737 HydrophobicContact CG1-CE2 4.48Å; V704-Y737 HydrophobicContact CG1-CG 3.62Å; P705-Y737 HydrophobicContact CG-CD2 4.03Å; P705-Y737 HydrophobicContact CG-CE2 3.65Å; P705-Y737 WeakPolarHBondContact O-CD2 3.17Å; L733-Y737 PolarHBondContact O-N 3.19Å; L733-Y737 VanDerWaalsContact O-N 3.1Å; G734-Y737 PolarHBondContact O-N 2.74Å; L735-Y737 VanDerWaalsContact C-N 3.3Å; L735-Y737 PolarHBondContact O-N 3.01Å; Y737-F740 HydrophobicContact CD2-CD1 4.03Å; Y737-F740 HydrophobicContact CE2-CD1 4.08Å; Y737-F740 PolarHBondContact O-N 2.94Å; Y737-R741 HydrophobicContact CD2-CG 4.31Å; Y737-R741 HydrophobicContact CE1-CG 4.2Å; Y737-R741 HydrophobicContact CE2-CG 3.87Å; Y737-R741 WeakPolarHBondContact O-CG 3.44Å; Y737-R741 PolarHBondContact O-N 3.29Å; Y737-L763 PolarHBondContact OH-O 3.3Å; Y737-L763 VanDerWaalsContact OH-O 3.13Å; Y737-L764 PolarHBondContact OH-O 3.38Å; Y737-N766 HydrophobicContact CE1-CB 3.95Å; Y737-N766 HydrophobicContact CE2-CB 4.46Å; Y737-N766 WeakPolarHBondContact OH-CB 3.49Å; Y737-N766 PolarHBondContact OH-N 2.91Å; Y737-V769 HydrophobicContact CD1-CB 4.03Å; Y737-V769 HydrophobicContact CD1-CG1 4.06Å; Y737-V769 HydrophobicContact CD1-CG2 4.33Å; Y737-T771 HydrophobicContact CD1-CG2 3.91Å; Y737-T771 HydrophobicContact CE1-CG2 3.85Å
738	Q	87.5	Confident	86.8	Confident	58 Å²	58	52.3 Å²	52.3	27%	0.271	27%	0.274	S	S	.	.	H	α-helix	trans	-62.9	-46.5	175.6	-71.2	167.6	19.9	0	0	111.6	G734 L735 R741 R742 S774	G734-Q738 WeakPolarHBondContact O-CG 3.46Å; G734-Q738 PolarHBondContact O-N 3.31Å; L735-Q738 PolarHBondContact O-N 3.3Å; Q738-R741 PolarHBondContact O-N 3.39Å; Q738-R742 PolarHBondContact O-N 3.13Å; Q738-S774 PolarHBondContact NE2-OG 2.91Å
739	D	89.6	Confident	87.3	Confident	47 Å²	47	49.5 Å²	49.5	25%	0.251	27%	0.267	S	S	.	.	H	α-helix	trans	-66.6	-40.5	177.1	-172.4	48.9	0	0	0	111.6	Y585 L735 Y736 R741 R742 R743	Y585-D739 WeakPolarHBondContact CD1-OD2 3.14Å; Y585-D739 HydrophobicContact CE1-CB 4.05Å; Y585-D739 WeakPolarHBondContact CE1-OD2 3.48Å; L735-D739 PolarHBondContact O-N 3.43Å; L735-D739 VanDerWaalsContact O-N 3.13Å; Y736-D739 PolarHBondContact O-N 3.35Å; D739-R741 PolarHBondContact O-N 3.22Å; D739-R742 PolarHBondContact O-N 3.08Å; D739-R743 WeakPolarHBondContact O-CG 3.49Å; D739-R743 PolarHBondContact O-N 3.3Å; D739-R743 IonicContact OD1-NE 3.02Å; D739-R743 IonicContact OD2-CZ 2.81Å; D739-R743 IonicContact OD2-NE 3.55Å; D739-R743 PolarHBondContact OD2-NE 3.44Å; D739-R743 IonicContact OD2-NH2 2.7Å; D739-R743 PolarHBondContact OD2-NH2 3.31Å
740	F	91.8	Very high	88.2	Confident	7 Å²	7	51.9 Å²	51.9	3%	0.031	26%	0.257	C	S	.	.	H	α-helix	trans	-54.9	-50.2	171.2	173.6	-98.1	0	0	0	111.9	P705 V706 L708 Y736 Y737 R742 R743 V744	P705-F740 HydrophobicContact CB-CD1 4.32Å; P705-F740 HydrophobicContact CB-CE1 3.72Å; P705-F740 HydrophobicContact CB-CZ 3.83Å; P705-F740 HydrophobicContact CG-CD1 4.12Å; P705-F740 HydrophobicContact CG-CE1 3.65Å; P705-F740 HydrophobicContact CG-CZ 4.27Å; P705-F740 WeakPolarHBondContact O-CD1 3.47Å; V706-F740 VanDerWaalsContact C-CD2 3.48Å; V706-F740 WeakPolarHBondContact O-CD2 3.23Å; L708-F740 HydrophobicContact CB-CE2 3.85Å; L708-F740 HydrophobicContact CB-CZ 4.32Å; Y736-F740 VanDerWaalsContact O-CB 3.24Å; Y736-F740 WeakPolarHBondContact O-CB 3.44Å; Y736-F740 PolarHBondContact O-N 3.35Å; Y737-F740 HydrophobicContact CD2-CD1 4.03Å; Y737-F740 HydrophobicContact CE2-CD1 4.08Å; Y737-F740 PolarHBondContact O-N 2.94Å; F740-R742 VanDerWaalsContact C-N 3.34Å; F740-R742 PolarHBondContact O-N 3.23Å; F740-R743 PolarHBondContact O-N 3.27Å; F740-V744 HydrophobicContact CD1-CG2 4.19Å; F740-V744 HydrophobicContact CD2-CG2 3.92Å; F740-V744 HydrophobicContact CE1-CG2 3.81Å; F740-V744 HydrophobicContact CE2-CG2 3.53Å; F740-V744 HydrophobicContact CG-CG2 4.24Å; F740-V744 HydrophobicContact CZ-CG2 3.49Å; F740-V744 VanDerWaalsContact CZ-CG2 3.49Å; F740-V744 WeakPolarHBondContact O-CB 3.26Å; F740-V744 VanDerWaalsContact O-CG2 3.26Å; F740-V744 WeakPolarHBondContact O-CG2 3.12Å; F740-V744 PolarHBondContact O-N 2.59Å
741	R	89.9	Confident	88.8	Confident	37 Å²	37	52.6 Å²	52.6	14%	0.14	26%	0.261	C	S	.	.	H	α-helix	trans	-56.8	-47.1	177.3	-77.9	179.1	67	-176	3.7	111.3	Y737 Q738 D739 R743 V744 L745 L764 T771 F821	Y737-R741 HydrophobicContact CD2-CG 4.31Å; Y737-R741 HydrophobicContact CE1-CG 4.2Å; Y737-R741 HydrophobicContact CE2-CG 3.87Å; Y737-R741 WeakPolarHBondContact O-CG 3.44Å; Y737-R741 PolarHBondContact O-N 3.29Å; Q738-R741 PolarHBondContact O-N 3.39Å; D739-R741 PolarHBondContact O-N 3.22Å; R741-R743 PolarHBondContact O-N 3.36Å; R741-V744 PolarHBondContact O-N 3.21Å; R741-L745 WeakPolarHBondContact O-CB 3.43Å; R741-L745 VanDerWaalsContact O-CG 3.27Å; R741-L745 WeakPolarHBondContact O-CG 3.24Å; R741-L745 PolarHBondContact O-N 3.35Å; R741-L764 PolarHBondContact NE-O 3.04Å; R741-T771 PolarHBondContact NH1-OG1 3.47Å; R741-T771 VanDerWaalsContact NH1-OG1 3.14Å; R741-F821 PolarHBondContact NH2-O 2.99Å
742	R	88.2	Confident	89.2	Confident	134 Å²	134	47.2 Å²	47.2	51%	0.506	23%	0.226	S	C	.	.	H	α-helix	trans	-60.9	-44.5	179.3	-173	-177.6	-177.1	-164	0.8	112	Q738 D739 F740 K746	Q738-R742 PolarHBondContact O-N 3.13Å; D739-R742 PolarHBondContact O-N 3.08Å; F740-R742 VanDerWaalsContact C-N 3.34Å; F740-R742 PolarHBondContact O-N 3.23Å; R742-K746 WeakPolarHBondContact O-CG 3.36Å; R742-K746 PolarHBondContact O-N 2.55Å
743	R	90.8	Very high	89.3	Confident	75 Å²	75	50.6 Å²	50.6	28%	0.283	24%	0.239	S	C	.	.	H	α-helix	trans	-66.7	-46.4	178.6	-69.6	179.2	-167.9	-149.5	10.9	111.7	Q584 D739 F740 R741 L745 K746 L747	Q584-R743 VanDerWaalsContact CD-NH1 3.26Å; Q584-R743 PolarHBondContact O-NH1 3.26Å; Q584-R743 PolarHBondContact O-NH2 3.4Å; Q584-R743 VanDerWaalsContact O-NH2 3.11Å; D739-R743 WeakPolarHBondContact O-CG 3.49Å; D739-R743 PolarHBondContact O-N 3.3Å; D739-R743 IonicContact OD1-NE 3.02Å; D739-R743 IonicContact OD2-CZ 2.81Å; D739-R743 IonicContact OD2-NE 3.55Å; D739-R743 PolarHBondContact OD2-NE 3.44Å; D739-R743 IonicContact OD2-NH2 2.7Å; D739-R743 PolarHBondContact OD2-NH2 3.31Å; F740-R743 PolarHBondContact O-N 3.27Å; R741-R743 PolarHBondContact O-N 3.36Å; R743-L745 PolarHBondContact O-N 3.18Å; R743-K746 PolarHBondContact O-N 3.35Å; R743-L747 WeakPolarHBondContact O-CG 3.5Å; R743-L747 PolarHBondContact O-N 3.1Å; R743-L747 VanDerWaalsContact O-N 3.07Å
744	V	91.2	Very high	89.1	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.024	28%	0.278	C	S	.	.	H	α-helix	trans	-59.9	-47.6	-179.9	169.5	0	0	0	0	110.3	F740 R741 K746 L747 M748	F740-V744 HydrophobicContact CD1-CG2 4.19Å; F740-V744 HydrophobicContact CD2-CG2 3.92Å; F740-V744 HydrophobicContact CE1-CG2 3.81Å; F740-V744 HydrophobicContact CE2-CG2 3.53Å; F740-V744 HydrophobicContact CG-CG2 4.24Å; F740-V744 HydrophobicContact CZ-CG2 3.49Å; F740-V744 VanDerWaalsContact CZ-CG2 3.49Å; F740-V744 WeakPolarHBondContact O-CB 3.26Å; F740-V744 VanDerWaalsContact O-CG2 3.26Å; F740-V744 WeakPolarHBondContact O-CG2 3.12Å; F740-V744 PolarHBondContact O-N 2.59Å; R741-V744 PolarHBondContact O-N 3.21Å; V744-K746 PolarHBondContact O-N 3.27Å; V744-L747 CarbonylContact O-C 3.55Å; V744-L747 PolarHBondContact O-N 3.45Å; V744-M748 HydrophobicContact CG1-CE 3.28Å; V744-M748 HydrophobicContact CG1-CG 4.12Å; V744-M748 HydrophobicContact CG1-SD 4.47Å; V744-M748 WeakPolarHBondContact O-CG 3.35Å; V744-M748 PolarHBondContact O-N 3.2Å
745	L	90.8	Very high	89.1	Confident	6 Å²	6	59.4 Å²	59.4	3%	0.031	28%	0.276	C	S	.	.	H	α-helix	trans	-53.4	-40.9	176.3	-75.3	170.8	0	0	0	112.9	R741 R743 L764 F821 Q822 L839 V843	R741-L745 WeakPolarHBondContact O-CB 3.43Å; R741-L745 VanDerWaalsContact O-CG 3.27Å; R741-L745 WeakPolarHBondContact O-CG 3.24Å; R741-L745 PolarHBondContact O-N 3.35Å; R743-L745 PolarHBondContact O-N 3.18Å; L745-L764 HydrophobicContact CD1-CD2 4.4Å; L745-L764 HydrophobicContact CD2-CD1 3.63Å; L745-L764 HydrophobicContact CD2-CD2 3.74Å; L745-L764 HydrophobicContact CD2-CG 4.35Å; L745-L764 HydrophobicContact CG-CD2 3.77Å; L745-F821 HydrophobicContact CD1-CB 3.81Å; L745-F821 HydrophobicContact CD2-CB 3.69Å; L745-F821 HydrophobicContact CD2-CD2 4.38Å; L745-F821 HydrophobicContact CD2-CG 4.16Å; L745-F821 HydrophobicContact CG-CB 4.42Å; L745-Q822 HydrophobicContact CD1-CG 4.24Å; L745-L839 HydrophobicContact CD2-CD1 4.31Å; L745-V843 VanDerWaalsContact O-CG1 3.23Å; L745-V843 WeakPolarHBondContact O-CG1 3.24Å
746	K	90.4	Very high	89.2	Confident	114 Å²	114	59.3 Å²	59.3	50%	0.496	27%	0.272	S	S	.	.	H	α-helix	trans	-72.2	-26.9	177.2	-69.3	-179.5	175.6	-171.3	0	114	R742 R743 V744	R742-K746 WeakPolarHBondContact O-CG 3.36Å; R742-K746 PolarHBondContact O-N 2.55Å; R743-K746 PolarHBondContact O-N 3.35Å; V744-K746 PolarHBondContact O-N 3.27Å
747	L	91.5	Very high	89.2	Confident	34 Å²	34	58.3 Å²	58.3	18%	0.178	27%	0.268	C	S	.	.	H	α-helix	trans	-89.6	-16.9	-179.5	-69.2	171.7	0	0	0	113.1	Q710 R743 V744 G749 K750 T751 F752	Q710-L747 HydrophobicContact CG-CD1 4.21Å; R743-L747 WeakPolarHBondContact O-CG 3.5Å; R743-L747 PolarHBondContact O-N 3.1Å; R743-L747 VanDerWaalsContact O-N 3.07Å; V744-L747 CarbonylContact O-C 3.55Å; V744-L747 PolarHBondContact O-N 3.45Å; L747-G749 PolarHBondContact O-N 2.96Å; L747-K750 CarbonylContact O-C 3.6Å; L747-K750 PolarHBondContact O-N 2.96Å; L747-T751 PolarHBondContact O-N 3.33Å; L747-F752 HydrophobicContact CB-CD2 3.67Å; L747-F752 HydrophobicContact CB-CE2 3.51Å; L747-F752 HydrophobicContact CD1-CE2 3.97Å; L747-F752 HydrophobicContact CG-CE2 4.38Å; L747-F752 PolarHBondContact O-N 2.92Å
748	M	90	Very high	89.1	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-57.3	-42.5	-178	-81.3	-72.7	177.2	0	0	113.9	V744 K750 F752 R753 C760 L763 V843 Q844	V744-M748 HydrophobicContact CG1-CE 3.28Å; V744-M748 HydrophobicContact CG1-CG 4.12Å; V744-M748 HydrophobicContact CG1-SD 4.47Å; V744-M748 WeakPolarHBondContact O-CG 3.35Å; V744-M748 PolarHBondContact O-N 3.2Å; M748-K750 VanDerWaalsContact C-N 3.27Å; M748-K750 PolarHBondContact O-N 3.05Å; M748-F752 CarbonylContact O-C 3.42Å; M748-F752 HydrophobicContact SD-CB 4.18Å; M748-R753 WeakPolarHBondContact O-CA 3.49Å; M748-R753 PolarHBondContact O-N 3.42Å; M748-R753 VanDerWaalsContact O-N 3.12Å; M748-C760 HydrophobicContact CE-CB 3.49Å; M748-C760 VanDerWaalsContact CE-CB 3.49Å; M748-C760 HydrophobicContact SD-CB 3.68Å; M748-C760 PolarHBondContact SD-SG 3.42Å; M748-L763 HydrophobicContact CE-CD1 4.01Å; M748-V843 HydrophobicContact CB-CG1 3.61Å; M748-V843 HydrophobicContact CG-CG1 4.41Å; M748-Q844 HydrophobicContact CB-CG 4.47Å
749	G	86.1	Confident	89.3	Confident	35 Å²	35	62 Å²	62	36%	0.361	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-6	176.8	0	0	0	0	0	114.9	L747 V843	L747-G749 PolarHBondContact O-N 2.96Å; G749-V843 WeakPolarHBondContact CA-O 3.34Å; G749-V843 PolarHBondContact N-O 2.82Å
750	K	88.5	Confident	89.4	Confident	160 Å²	160	59.8 Å²	59.8	70%	0.696	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	-99.7	-178.4	-61.5	-179.4	-178.9	-176.2	0	109.5	L747 M748 F752 R753	L747-K750 CarbonylContact O-C 3.6Å; L747-K750 PolarHBondContact O-N 2.96Å; M748-K750 VanDerWaalsContact C-N 3.27Å; M748-K750 PolarHBondContact O-N 3.05Å; K750-F752 VanDerWaalsContact C-N 3.32Å; K750-F752 PolarHBondContact O-N 3.21Å; K750-R753 PolarHBondContact O-N 2.73Å
751	T	85.9	Confident	89.2	Confident	62 Å²	62	60.5 Å²	60.5	38%	0.38	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-30.9	-174	-44.3	0	0	0	0	112.9	Q710 L747	Q710-T751 HydrophobicContact CB-CG2 4.17Å; Q710-T751 WeakPolarHBondContact O-CG2 3.12Å; L747-T751 PolarHBondContact O-N 3.33Å
752	F	88.7	Confident	89.3	Confident	1 Å²	1	60.1 Å²	60.1	0%	0.004	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	22.7	-175.6	-46.5	-50.6	0	0	0	113.5	L708 Q710 H719 L747 M748 K750 E754 F755	L708-F752 HydrophobicContact CD2-CD1 4.48Å; L708-F752 HydrophobicContact CD2-CD2 4.32Å; L708-F752 HydrophobicContact CD2-CE1 3.95Å; L708-F752 HydrophobicContact CD2-CE2 3.77Å; L708-F752 HydrophobicContact CD2-CZ 3.56Å; L708-F752 HydrophobicContact CG-CE1 4.22Å; L708-F752 HydrophobicContact CG-CE2 4.47Å; L708-F752 HydrophobicContact CG-CZ 3.85Å; Q710-F752 HydrophobicContact CG-CZ 4.44Å; H719-F752 AromaticContact CE1-CE1 3.88Å; H719-F752 AromaticContact ND1-CE1 3.63Å; L747-F752 HydrophobicContact CB-CD2 3.67Å; L747-F752 HydrophobicContact CB-CE2 3.51Å; L747-F752 HydrophobicContact CD1-CE2 3.97Å; L747-F752 HydrophobicContact CG-CE2 4.38Å; L747-F752 PolarHBondContact O-N 2.92Å; M748-F752 CarbonylContact O-C 3.42Å; M748-F752 HydrophobicContact SD-CB 4.18Å; K750-F752 VanDerWaalsContact C-N 3.32Å; K750-F752 PolarHBondContact O-N 3.21Å; F752-E754 VanDerWaalsContact C-N 3.26Å; F752-E754 PolarHBondContact O-N 2.81Å; F752-F755 HydrophobicContact CB-CD1 4.45Å; F752-F755 HydrophobicContact CB-CD2 3.71Å; F752-F755 HydrophobicContact CB-CE2 3.87Å; F752-F755 HydrophobicContact CB-CG 4.02Å; F752-F755 HydrophobicContact CB-CZ 4.31Å; F752-F755 HydrophobicContact CD1-CD2 4.28Å; F752-F755 HydrophobicContact CD1-CE1 4.09Å; F752-F755 AromaticContact CD1-CE2 3.55Å; F752-F755 HydrophobicContact CD1-CE2 3.55Å; F752-F755 AromaticContact CD1-CZ 3.43Å; F752-F755 HydrophobicContact CD1-CZ 3.43Å; F752-F755 VanDerWaalsContact CD1-CZ 3.43Å; F752-F755 HydrophobicContact CE1-CE2 4.26Å; F752-F755 HydrophobicContact CE1-CZ 4.05Å; F752-F755 HydrophobicContact CG-CD2 4.17Å; F752-F755 AromaticContact CG-CE2 3.81Å; F752-F755 HydrophobicContact CG-CE2 3.81Å; F752-F755 HydrophobicContact CG-CZ 4.14Å; F752-F755 WeakPolarHBondContact O-CB 3.11Å; F752-F755 PolarHBondContact O-N 3.48Å
753	R	88.6	Confident	89.4	Confident	130 Å²	130	53.7 Å²	53.7	49%	0.491	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-36	-179.7	-178.7	170.5	-172	-156.5	2.4	112.5	M748 K750 F755 Q844 G845 K846	M748-R753 WeakPolarHBondContact O-CA 3.49Å; M748-R753 PolarHBondContact O-N 3.42Å; M748-R753 VanDerWaalsContact O-N 3.12Å; K750-R753 PolarHBondContact O-N 2.73Å; R753-F755 VanDerWaalsContact C-N 3.28Å; R753-F755 PolarHBondContact O-N 2.97Å; R753-Q844 WeakPolarHBondContact CG-O 3.4Å; R753-G845 PolarHBondContact NE-O 3.35Å; R753-G845 PolarHBondContact NH2-O 3.16Å; R753-K846 WeakPolarHBondContact O-CE 3.49Å
754	E	84.6	Confident	89.2	Confident	185 Å²	185	50.4 Å²	50.4	86%	0.864	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-11.3	-178.7	-61.5	-172.2	172.6	0	0	113.7	F752	F752-E754 VanDerWaalsContact C-N 3.26Å; F752-E754 PolarHBondContact O-N 2.81Å
755	F	88.7	Confident	88.8	Confident	26 Å²	26	54.9 Å²	54.9	11%	0.114	26%	0.264	C	S	.	.	S	Bend	trans	-65.8	143.4	-179.2	-76.4	7	0	0	0	111.9	L690 L708 H719 F752 R753 T757 L759 C760 Q844 K846	L690-F755 HydrophobicContact CD2-CE2 3.99Å; L708-F755 HydrophobicContact CD2-CE2 4.18Å; H719-F755 HydrophobicContact CB-CZ 4.07Å; H719-F755 AromaticContact CD2-CE1 3.26Å; H719-F755 WeakPolarHBondContact CD2-CE1 3.45Å; H719-F755 AromaticContact CD2-CZ 3.24Å; H719-F755 WeakPolarHBondContact CD2-CZ 3.39Å; H719-F755 AromaticContact CG-CZ 3.62Å; H719-F755 AromaticContact NE2-CE1 3.44Å; H719-F755 WeakPolarHBondContact NE2-CE1 3.26Å; H719-F755 AromaticContact NE2-CZ 3.7Å; F752-F755 HydrophobicContact CB-CD1 4.45Å; F752-F755 HydrophobicContact CB-CD2 3.71Å; F752-F755 HydrophobicContact CB-CE2 3.87Å; F752-F755 HydrophobicContact CB-CG 4.02Å; F752-F755 HydrophobicContact CB-CZ 4.31Å; F752-F755 HydrophobicContact CD1-CD2 4.28Å; F752-F755 HydrophobicContact CD1-CE1 4.09Å; F752-F755 AromaticContact CD1-CE2 3.55Å; F752-F755 HydrophobicContact CD1-CE2 3.55Å; F752-F755 AromaticContact CD1-CZ 3.43Å; F752-F755 HydrophobicContact CD1-CZ 3.43Å; F752-F755 VanDerWaalsContact CD1-CZ 3.43Å; F752-F755 HydrophobicContact CE1-CE2 4.26Å; F752-F755 HydrophobicContact CE1-CZ 4.05Å; F752-F755 HydrophobicContact CG-CD2 4.17Å; F752-F755 AromaticContact CG-CE2 3.81Å; F752-F755 HydrophobicContact CG-CE2 3.81Å; F752-F755 HydrophobicContact CG-CZ 4.14Å; F752-F755 WeakPolarHBondContact O-CB 3.11Å; F752-F755 PolarHBondContact O-N 3.48Å; R753-F755 VanDerWaalsContact C-N 3.28Å; R753-F755 PolarHBondContact O-N 2.97Å; F755-T757 PolarHBondContact O-N 3.46Å; F755-L759 HydrophobicContact CD2-CD2 4.19Å; F755-L759 HydrophobicContact CG-CD2 4.39Å; F755-C760 WeakPolarHBondContact CB-SG 3.24Å; F755-Q844 PolarHBondContact O-NE2 3.39Å; F755-K846 WeakPolarHBondContact O-CE 3.05Å; F755-K846 PolarHBondContact O-NZ 3.31Å
756	E	88.7	Confident	88.4	Confident	108 Å²	108	55.4 Å²	55.4	51%	0.505	27%	0.266	S	S	.	.			trans	-55.9	129.3	169.4	-66	-178.7	-177.3	0	0	110.2	K758 L759 C760 E854	E756-K758 PolarHBondContact O-N 2.87Å; E756-L759 HydrophobicContact CB-CB 4.26Å; E756-L759 WeakPolarHBondContact O-CA 3.37Å; E756-L759 VanDerWaalsContact O-CB 3.3Å; E756-L759 WeakPolarHBondContact O-CB 3.31Å; E756-L759 PolarHBondContact O-N 2.85Å; E756-C760 PolarHBondContact O-N 3.14Å; E756-C760 VanDerWaalsContact O-N 3.08Å; E756-C760 PolarHBondContact O-SG 3.12Å; E756-E854 VanDerWaalsContact C-OE1 3.32Å; E756-E854 WeakPolarHBondContact CA-OE1 3.49Å
757	T	90.4	Very high	87.9	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.006	29%	0.286	C	S	.	.	H	α-helix	trans	-56.8	-33.7	178.6	-61.4	0	0	0	0	111.4	F755 L759 C760 L761 G836 A840 Q844 K846 E854	F755-T757 PolarHBondContact O-N 3.46Å; T757-L759 PolarHBondContact O-N 2.88Å; T757-C760 PolarHBondContact O-N 2.95Å; T757-L761 WeakPolarHBondContact O-CG 3.47Å; T757-L761 PolarHBondContact O-N 3.04Å; T757-G836 WeakPolarHBondContact CG2-O 3.32Å; T757-A840 HydrophobicContact CG2-CB 3.96Å; T757-Q844 PolarHBondContact OG1-OE1 3.46Å; T757-K846 PolarHBondContact OG1-NZ 2.92Å; T757-K846 VanDerWaalsContact OG1-NZ 3.09Å; T757-E854 PolarHBondContact N-OE1 2.66Å
758	K	90	Very high	86.8	Confident	122 Å²	122	61 Å²	61	53%	0.53	30%	0.296	S	S	.	.	H	α-helix	trans	-62.3	-40.7	173.5	-66.8	175.1	-175	164.4	0	112.3	E756 A762	E756-K758 PolarHBondContact O-N 2.87Å; K758-A762 VanDerWaalsContact O-CB 3.3Å; K758-A762 WeakPolarHBondContact O-CB 3.39Å; K758-A762 PolarHBondContact O-N 3.19Å
759	L	90.9	Very high	85.9	Confident	14 Å²	14	61.8 Å²	61.8	7%	0.073	30%	0.301	C	S	.	.	H	α-helix	trans	-67	-42.7	176.7	178.4	66	0	0	0	110.6	L690 L695 F755 E756 T757 A762 L763	L690-L759 HydrophobicContact CD1-CD1 4.24Å; L690-L759 HydrophobicContact CD2-CD1 4.28Å; L690-L759 HydrophobicContact CD2-CD2 3.9Å; L690-L759 HydrophobicContact CD2-CG 4.24Å; L690-L759 HydrophobicContact CG-CD1 4.1Å; L690-L759 HydrophobicContact CG-CD2 4.16Å; L695-L759 HydrophobicContact CD2-CD1 3.76Å; F755-L759 HydrophobicContact CD2-CD2 4.19Å; F755-L759 HydrophobicContact CG-CD2 4.39Å; E756-L759 HydrophobicContact CB-CB 4.26Å; E756-L759 WeakPolarHBondContact O-CA 3.37Å; E756-L759 VanDerWaalsContact O-CB 3.3Å; E756-L759 WeakPolarHBondContact O-CB 3.31Å; E756-L759 PolarHBondContact O-N 2.85Å; T757-L759 PolarHBondContact O-N 2.88Å; L759-A762 CarbonylContact O-C 3.6Å; L759-A762 WeakPolarHBondContact O-CB 3.31Å; L759-A762 PolarHBondContact O-N 3.1Å; L759-L763 WeakPolarHBondContact O-CG 3.24Å; L759-L763 PolarHBondContact O-N 3.17Å
760	C	90.8	Very high	84.9	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-63.9	-45.8	179.8	-59.4	0	0	0	0	112.4	M748 F755 E756 T757 A762 L763 L764 L839 Q844	M748-C760 HydrophobicContact CE-CB 3.49Å; M748-C760 VanDerWaalsContact CE-CB 3.49Å; M748-C760 HydrophobicContact SD-CB 3.68Å; M748-C760 PolarHBondContact SD-SG 3.42Å; F755-C760 WeakPolarHBondContact CB-SG 3.24Å; E756-C760 PolarHBondContact O-N 3.14Å; E756-C760 VanDerWaalsContact O-N 3.08Å; E756-C760 PolarHBondContact O-SG 3.12Å; T757-C760 PolarHBondContact O-N 2.95Å; C760-A762 VanDerWaalsContact C-N 3.3Å; C760-A762 PolarHBondContact O-N 3.49Å; C760-L763 WeakPolarHBondContact O-CB 3.42Å; C760-L763 PolarHBondContact O-N 2.9Å; C760-L764 WeakPolarHBondContact O-CG 3.24Å; C760-L764 PolarHBondContact O-N 3.3Å; C760-L839 HydrophobicContact CB-CD2 3.52Å; C760-Q844 PolarHBondContact SG-NE2 2.93Å
761	L	89.6	Confident	83.5	Confident	23 Å²	23	60.7 Å²	60.7	12%	0.12	30%	0.296	C	S	.	.	H	α-helix	trans	-59.3	-44.3	171.8	-77.2	175.9	0	0	0	111.6	T757 L763 L764 K765 F821 Q835 G836 L839	T757-L761 WeakPolarHBondContact O-CG 3.47Å; T757-L761 PolarHBondContact O-N 3.04Å; L761-L763 VanDerWaalsContact C-N 3.29Å; L761-L763 PolarHBondContact O-N 3.25Å; L761-L764 PolarHBondContact O-N 3.05Å; L761-K765 PolarHBondContact O-N 2.99Å; L761-F821 HydrophobicContact CD2-CE1 3.94Å; L761-F821 HydrophobicContact CD2-CZ 4.1Å; L761-Q835 HydrophobicContact CD2-CB 3.93Å; L761-G836 VanDerWaalsContact CD1-CA 3.48Å; L761-L839 HydrophobicContact CD2-CB 4.37Å; L761-L839 HydrophobicContact CD2-CD2 3.88Å; L761-L839 HydrophobicContact CG-CD2 3.89Å
762	A	90.2	Very high	81.8	Confident	28 Å²	28	66.8 Å²	66.8	23%	0.231	32%	0.321	C	S	.	.	H	α-helix	trans	-58.6	-43	177.8	0	0	0	0	0	110.3	L695 K699 K758 L759 C760 L764 K765	L695-A762 HydrophobicContact CD2-CB 3.74Å; K699-A762 PolarHBondContact NZ-O 3.13Å; K758-A762 VanDerWaalsContact O-CB 3.3Å; K758-A762 WeakPolarHBondContact O-CB 3.39Å; K758-A762 PolarHBondContact O-N 3.19Å; L759-A762 CarbonylContact O-C 3.6Å; L759-A762 WeakPolarHBondContact O-CB 3.31Å; L759-A762 PolarHBondContact O-N 3.1Å; C760-A762 VanDerWaalsContact C-N 3.3Å; C760-A762 PolarHBondContact O-N 3.49Å; A762-L764 PolarHBondContact O-N 3.33Å; A762-K765 PolarHBondContact O-N 3.48Å
763	L	90.1	Very high	79.9	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-58.6	-43.8	178.1	-74.5	170.6	0	0	0	113.2	L690 L695 K699 L708 Y737 M748 L759 C760 L761 K765	L690-L763 HydrophobicContact CD1-CD2 4.05Å; L690-L763 HydrophobicContact CD2-CD1 3.97Å; L690-L763 HydrophobicContact CD2-CD2 4.23Å; L690-L763 HydrophobicContact CD2-CG 4.49Å; L695-L763 HydrophobicContact CD1-CD2 3.99Å; L695-L763 HydrophobicContact CD2-CD2 3.84Å; L695-L763 HydrophobicContact CD2-CG 4.02Å; K699-L763 PolarHBondContact NZ-O 2.8Å; L708-L763 HydrophobicContact CD2-CD1 4.34Å; Y737-L763 PolarHBondContact OH-O 3.3Å; Y737-L763 VanDerWaalsContact OH-O 3.13Å; M748-L763 HydrophobicContact CE-CD1 4.01Å; L759-L763 WeakPolarHBondContact O-CG 3.24Å; L759-L763 PolarHBondContact O-N 3.17Å; C760-L763 WeakPolarHBondContact O-CB 3.42Å; C760-L763 PolarHBondContact O-N 2.9Å; L761-L763 VanDerWaalsContact C-N 3.29Å; L761-L763 PolarHBondContact O-N 3.25Å; L763-K765 VanDerWaalsContact C-N 3.34Å; L763-K765 PolarHBondContact O-N 3.13Å
764	L	86.6	Confident	78	Confident	5 Å²	5	65.3 Å²	65.3	3%	0.026	34%	0.342	C	S	.	.	H	α-helix	trans	-72.2	-22.9	-174.4	-65.6	173.4	0	0	0	114.4	Y737 R741 L745 C760 L761 A762 F821 L839	Y737-L764 PolarHBondContact OH-O 3.38Å; R741-L764 PolarHBondContact NE-O 3.04Å; L745-L764 HydrophobicContact CD1-CD2 4.4Å; L745-L764 HydrophobicContact CD2-CD1 3.63Å; L745-L764 HydrophobicContact CD2-CD2 3.74Å; L745-L764 HydrophobicContact CD2-CG 4.35Å; L745-L764 HydrophobicContact CG-CD2 3.77Å; C760-L764 WeakPolarHBondContact O-CG 3.24Å; C760-L764 PolarHBondContact O-N 3.3Å; L761-L764 PolarHBondContact O-N 3.05Å; A762-L764 PolarHBondContact O-N 3.33Å; L764-F821 HydrophobicContact CD1-CB 4.45Å; L764-F821 HydrophobicContact CD1-CD1 3.8Å; L764-F821 HydrophobicContact CD1-CE1 4.24Å; L764-F821 HydrophobicContact CD1-CG 4.09Å; L764-L839 HydrophobicContact CD1-CD1 3.77Å; L764-L839 HydrophobicContact CD1-CD2 4.27Å
765	K	84.3	Confident	76.4	Confident	99 Å²	99	61.7 Å²	61.7	43%	0.43	34%	0.343	S	S	.	.			trans	-106	124.3	178.6	-66.8	-170.6	176.7	-173.3	0	111.6	K699 L761 A762 L763 Q835	K699-K765 PolarHBondContact NZ-O 3.46Å; L761-K765 PolarHBondContact O-N 2.99Å; A762-K765 PolarHBondContact O-N 3.48Å; L763-K765 VanDerWaalsContact C-N 3.34Å; L763-K765 PolarHBondContact O-N 3.13Å; K765-Q835 VanDerWaalsContact NZ-CD 3.32Å; K765-Q835 VanDerWaalsContact NZ-NE2 3.16Å
766	N	82.8	Confident	75.1	Confident	16 Å²	16	64 Å²	64	9%	0.086	36%	0.356	C	S	.	.			trans	-137.4	124.7	170.6	-163.2	-13.3	0	0	0	110.3	F703 V704 Y737 S768	F703-N766 PolarHBondContact O-ND2 3.35Å; V704-N766 WeakPolarHBondContact CA-ND2 3.43Å; Y737-N766 HydrophobicContact CE1-CB 3.95Å; Y737-N766 HydrophobicContact CE2-CB 4.46Å; Y737-N766 WeakPolarHBondContact OH-CB 3.49Å; Y737-N766 PolarHBondContact OH-N 2.91Å; N766-S768 PolarHBondContact O-N 3.36Å; N766-S768 PolarHBondContact OD1-N 3.38Å; N766-S768 PolarHBondContact OD1-OG 2.82Å; N766-S768 VanDerWaalsContact OD1-OG 3.12Å
767	K	78.4	Confident	73.9	Confident	208 Å²	208	66.5 Å²	66.5	90%	0.904	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-16.8	-180	-59.6	-173	-179.5	-172.1	0	113.3	V769	K767-V769 VanDerWaalsContact C-N 3.29Å
768	S	69.8	Low	73.1	Confident	57 Å²	57	70.1 Å²	70.1	40%	0.399	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-10.5	-174.1	-41.5	0	0	0	0	113.2	G702 N766	G702-S768 WeakPolarHBondContact CA-OG 3.17Å; N766-S768 PolarHBondContact O-N 3.36Å; N766-S768 PolarHBondContact OD1-N 3.38Å; N766-S768 PolarHBondContact OD1-OG 2.82Å; N766-S768 VanDerWaalsContact OD1-OG 3.12Å
769	V	70.6	Confident	72.7	Confident	18 Å²	18	64.6 Å²	64.6	11%	0.109	36%	0.364	C	S	.	.	S	Bend	trans	-132	116.5	-179.7	-179.5	0	0	0	0	107.4	V704 Y737 K767 T771	V704-V769 HydrophobicContact CB-CG2 4.37Å; V704-V769 HydrophobicContact CG1-CG2 3.88Å; V704-V769 HydrophobicContact CG2-CG2 3.52Å; Y737-V769 HydrophobicContact CD1-CB 4.03Å; Y737-V769 HydrophobicContact CD1-CG1 4.06Å; Y737-V769 HydrophobicContact CD1-CG2 4.33Å; K767-V769 VanDerWaalsContact C-N 3.29Å; V769-T771 HydrophobicContact CG1-CG2 4.33Å; V769-T771 PolarHBondContact O-N 3.11Å
770	D	64.4	Low	72.2	Confident	135 Å²	135	68 Å²	68	72%	0.722	38%	0.382	S	S	*	.			trans	-70.9	98.3	172.1	-69.1	-27.7	0	0	0	108.8	E772	D770-E772 PolarHBondContact O-N 2.91Å
771	T	58.8	Low	72	Confident	37 Å²	37	69.8 Å²	69.8	23%	0.227	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-77.7	-9.1	173.4	48	0	0	0	0	112.7	Y737 R741 V769 S774	Y737-T771 HydrophobicContact CD1-CG2 3.91Å; Y737-T771 HydrophobicContact CE1-CG2 3.85Å; R741-T771 PolarHBondContact NH1-OG1 3.47Å; R741-T771 VanDerWaalsContact NH1-OG1 3.14Å; V769-T771 HydrophobicContact CG1-CG2 4.33Å; V769-T771 PolarHBondContact O-N 3.11Å; T771-S774 PolarHBondContact O-OG 2.85Å
772	E	51.7	Low	71.8	Confident	190 Å²	190	72.7 Å²	72.7	89%	0.888	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-80	-19.4	177.5	-64.5	177.8	-177.1	0	0	112	D770	D770-E772 PolarHBondContact O-N 2.91Å
773	G	47.6	Very low	71.5	Confident	72 Å²	72	73.6 Å²	73.6	74%	0.742	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-92.8	0.5	-179.5	0	0	0	0	0	115.6
774	S	49.1	Very low	71.4	Confident	28 Å²	28	73.6 Å²	73.6	20%	0.196	41%	0.41	C	S	.	.	S	Bend	trans	-86.3	138.5	176	73	0	0	0	0	110.3	Q738 T771 L776	Q738-S774 PolarHBondContact NE2-OG 2.91Å; T771-S774 PolarHBondContact O-OG 2.85Å; S774-L776 PolarHBondContact O-N 3.41Å; S774-L776 WeakPolarHBondContact OG-CD1 3.49Å
775	A	51.7	Low	71.5	Confident	109 Å²	109	76.9 Å²	76.9	90%	0.901	43%	0.427	S	S	*	.			trans	-60.3	48.6	178.6	0	0	0	0	0	115	K777	A775-K777 PolarHBondContact O-N 3.33Å
776	L	61.4	Low	71.7	Confident	74 Å²	74	77.7 Å²	77.7	39%	0.387	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-76.6	118.9	169	-73	164.2	0	0	0	106.6	S774 V778	S774-L776 PolarHBondContact O-N 3.41Å; S774-L776 WeakPolarHBondContact OG-CD1 3.49Å; L776-V778 PolarHBondContact O-N 3.31Å
777	K	63.6	Low	71.9	Confident	161 Å²	161	80.3 Å²	80.3	70%	0.7	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-58.1	129.1	174.4	-68.4	-173.7	176.1	-171.4	0	109.1	A775	A775-K777 PolarHBondContact O-N 3.33Å
778	V	73.6	Confident	72.5	Confident	77 Å²	77	70.7 Å²	70.7	47%	0.467	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-58.3	152.5	170.3	-178.9	0	0	0	0	108.7	L776 D780 D826	L776-V778 PolarHBondContact O-N 3.31Å; V778-D780 PolarHBondContact O-N 3.42Å; V778-D826 HydrophobicContact CG1-CB 4.07Å
779	L	79.8	Confident	73.5	Confident	6 Å²	6	73.5 Å²	73.5	3%	0.031	42%	0.418	C	S	.	.			trans	-62.7	104.7	179.9	-177.3	71.5	0	0	0	111.1	M783 L784 L819 R824 I825 F877 V880	L779-M783 HydrophobicContact CD1-CB 4.41Å; L779-M783 HydrophobicContact CD1-CG 4.2Å; L779-M783 HydrophobicContact CD1-SD 4.17Å; L779-L784 HydrophobicContact CD2-CD1 4.21Å; L779-L819 HydrophobicContact CD1-CD1 4.35Å; L779-L819 HydrophobicContact CD1-CD2 4.4Å; L779-R824 WeakPolarHBondContact CB-O 3.13Å; L779-R824 PolarHBondContact N-O 3.2Å; L779-R824 VanDerWaalsContact N-O 3.08Å; L779-I825 HydrophobicContact CD2-CG1 4.47Å; L779-F877 HydrophobicContact CD2-CD1 3.79Å; L779-F877 HydrophobicContact CD2-CE1 3.69Å; L779-V880 HydrophobicContact CD2-CG2 4.49Å; L779-V880 WeakPolarHBondContact O-CG1 3.49Å
780	D	82.3	Confident	74.4	Confident	85 Å²	85	77.1 Å²	77.1	46%	0.455	44%	0.442	S	S	.	.			trans	-92.9	157.7	172.8	-59.7	-33.8	0	0	0	111.8	V778 P782 M783 L784	V778-D780 PolarHBondContact O-N 3.42Å; D780-P782 HydrophobicContact CB-CG 4.08Å; D780-M783 WeakPolarHBondContact O-CA 3.47Å; D780-M783 WeakPolarHBondContact O-CB 3.35Å; D780-M783 PolarHBondContact O-N 3.33Å; D780-L784 PolarHBondContact O-N 2.96Å
781	K	84.6	Confident	75.6	Confident	38 Å²	38	76.2 Å²	76.2	17%	0.165	43%	0.433	C	S	.	.	H	α-helix	trans	-46.6	-50.9	173	178.4	63.1	175.2	143.8	0	115.1	M783 L784 D785 L881 H884	K781-M783 PolarHBondContact O-N 3Å; K781-L784 WeakPolarHBondContact O-CA 3.48Å; K781-L784 WeakPolarHBondContact O-CB 3.43Å; K781-L784 PolarHBondContact O-N 3.49Å; K781-D785 WeakPolarHBondContact CE-OD2 3.28Å; K781-D785 IonicContact NZ-OD1 3.12Å; K781-D785 PolarHBondContact NZ-OD1 3.24Å; K781-D785 IonicContact NZ-OD2 3.19Å; K781-D785 PolarHBondContact NZ-OD2 2.94Å; K781-D785 PolarHBondContact O-N 3.31Å; K781-L881 HydrophobicContact CD-CD2 3.35Å; K781-H884 HydrophobicContact CB-CB 3.78Å; K781-H884 HydrophobicContact CG-CB 4.23Å
782	P	85.7	Confident	77.2	Confident	84 Å²	84	75.6 Å²	75.6	55%	0.545	43%	0.428	S	S	.	.	H	α-helix	trans	-62.3	-29.8	178.5	21.5	-34.1	0	0	0	113.1	D780 V786	D780-P782 HydrophobicContact CB-CG 4.08Å; P782-V786 WeakPolarHBondContact O-CG2 3.33Å; P782-V786 PolarHBondContact O-N 2.87Å
783	M	84.4	Confident	79	Confident	46 Å²	46	67.4 Å²	67.4	23%	0.227	39%	0.391	C	S	.	.	H	α-helix	trans	-71.7	-39.9	172.8	-175.1	176.7	-72	0	0	110.6	L779 D780 K781 D785 V786 Y787 R824	L779-M783 HydrophobicContact CD1-CB 4.41Å; L779-M783 HydrophobicContact CD1-CG 4.2Å; L779-M783 HydrophobicContact CD1-SD 4.17Å; D780-M783 WeakPolarHBondContact O-CA 3.47Å; D780-M783 WeakPolarHBondContact O-CB 3.35Å; D780-M783 PolarHBondContact O-N 3.33Å; K781-M783 PolarHBondContact O-N 3Å; M783-D785 VanDerWaalsContact C-N 3.3Å; M783-D785 PolarHBondContact O-N 2.73Å; M783-V786 WeakPolarHBondContact O-CB 3.43Å; M783-V786 PolarHBondContact O-N 2.91Å; M783-V786 VanDerWaalsContact O-N 3.15Å; M783-Y787 HydrophobicContact CG-CD2 4.11Å; M783-Y787 HydrophobicContact CG-CE2 3.86Å; M783-Y787 VanDerWaalsContact O-CD2 3.28Å; M783-Y787 WeakPolarHBondContact O-CD2 3.29Å; M783-Y787 PolarHBondContact O-N 3.08Å; M783-Y787 HydrophobicContact SD-CE2 4.44Å; M783-R824 PolarHBondContact SD-NH1 3.07Å
784	L	87.3	Confident	81	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-60.5	-39.7	177.7	-165.6	147.9	0	0	0	111.7	L779 D780 K781 V786 Y787 F788 L793 F877 V880	L779-L784 HydrophobicContact CD2-CD1 4.21Å; D780-L784 PolarHBondContact O-N 2.96Å; K781-L784 WeakPolarHBondContact O-CA 3.48Å; K781-L784 WeakPolarHBondContact O-CB 3.43Å; K781-L784 PolarHBondContact O-N 3.49Å; L784-V786 VanDerWaalsContact C-N 3.28Å; L784-V786 PolarHBondContact O-N 3.4Å; L784-Y787 PolarHBondContact O-N 3.12Å; L784-F788 HydrophobicContact CG-CD2 4.3Å; L784-F788 PolarHBondContact O-N 3.43Å; L784-L793 HydrophobicContact CD2-CD1 3.46Å; L784-L793 VanDerWaalsContact CD2-CD1 3.46Å; L784-L793 HydrophobicContact CD2-CD2 3.96Å; L784-L793 HydrophobicContact CD2-CG 4.26Å; L784-F877 HydrophobicContact CD1-CB 4.11Å; L784-F877 HydrophobicContact CD1-CD1 4Å; L784-F877 HydrophobicContact CD1-CG 4.14Å; L784-V880 HydrophobicContact CD1-CG1 4.48Å
785	D	88.6	Confident	83.1	Confident	74 Å²	74	70.9 Å²	70.9	40%	0.396	38%	0.382	S	S	.	.	H	α-helix	trans	-69.2	-20.8	176.7	-68.4	-28.7	0	0	0	114.1	K781 M783	K781-D785 WeakPolarHBondContact CE-OD2 3.28Å; K781-D785 IonicContact NZ-OD1 3.12Å; K781-D785 PolarHBondContact NZ-OD1 3.24Å; K781-D785 IonicContact NZ-OD2 3.19Å; K781-D785 PolarHBondContact NZ-OD2 2.94Å; K781-D785 PolarHBondContact O-N 3.31Å; M783-D785 VanDerWaalsContact C-N 3.3Å; M783-D785 PolarHBondContact O-N 2.73Å
786	V	89.2	Confident	85	Confident	116 Å²	116	65.9 Å²	65.9	70%	0.703	34%	0.34	S	S	*	.	H	α-helix	trans	-73.8	-34.5	172.6	171.8	0	0	0	0	111.3	P782 M783 L784	P782-V786 WeakPolarHBondContact O-CG2 3.33Å; P782-V786 PolarHBondContact O-N 2.87Å; M783-V786 WeakPolarHBondContact O-CB 3.43Å; M783-V786 PolarHBondContact O-N 2.91Å; M783-V786 VanDerWaalsContact O-N 3.15Å; L784-V786 VanDerWaalsContact C-N 3.28Å; L784-V786 PolarHBondContact O-N 3.4Å
787	Y	87.6	Confident	86.3	Confident	72 Å²	72	64.6 Å²	64.6	28%	0.282	33%	0.332	S	S	.	.	H	α-helix	trans	-92	-34.7	-177.4	-73.5	-79.4	0	0	0	113	M783 L784 D815 L819 R824	M783-Y787 HydrophobicContact CG-CD2 4.11Å; M783-Y787 HydrophobicContact CG-CE2 3.86Å; M783-Y787 VanDerWaalsContact O-CD2 3.28Å; M783-Y787 WeakPolarHBondContact O-CD2 3.29Å; M783-Y787 PolarHBondContact O-N 3.08Å; M783-Y787 HydrophobicContact SD-CE2 4.44Å; L784-Y787 PolarHBondContact O-N 3.12Å; Y787-D815 HydrophobicContact CD1-CB 4.31Å; Y787-L819 HydrophobicContact CD2-CD1 4.37Å; Y787-L819 HydrophobicContact CD2-CD2 4.09Å; Y787-L819 HydrophobicContact CE2-CD2 3.83Å; Y787-L819 HydrophobicContact CG-CD1 4.38Å; Y787-R824 PolarHBondContact OH-NH1 3.44Å
788	F	91.6	Very high	87.7	Confident	5 Å²	5	58.3 Å²	58.3	2%	0.022	31%	0.309	C	S	.	.			trans	-130.9	133.3	-172.4	-56.5	-69	0	0	0	111.7	L784 D792 L793 L812 D815 I816 L819 F877	L784-F788 HydrophobicContact CG-CD2 4.3Å; L784-F788 PolarHBondContact O-N 3.43Å; F788-D792 HydrophobicContact CB-CB 4.45Å; F788-L793 HydrophobicContact CB-CD2 3.89Å; F788-L793 HydrophobicContact CB-CG 4.16Å; F788-L793 HydrophobicContact CD2-CD2 4.35Å; F788-L793 HydrophobicContact CG-CD2 4.17Å; F788-L812 HydrophobicContact CD1-CD2 4.24Å; F788-L812 HydrophobicContact CE1-CB 4.35Å; F788-L812 HydrophobicContact CE1-CD2 4.45Å; F788-D815 HydrophobicContact CE1-CB 3.94Å; F788-D815 HydrophobicContact CZ-CB 3.84Å; F788-I816 HydrophobicContact CE1-CG1 4.05Å; F788-I816 HydrophobicContact CZ-CG1 3.64Å; F788-L819 HydrophobicContact CE2-CD1 3.75Å; F788-L819 HydrophobicContact CZ-CD1 4.24Å; F788-F877 HydrophobicContact CE2-CE2 4.11Å; F788-F877 AromaticContact CE2-CZ 3.99Å; F788-F877 HydrophobicContact CE2-CZ 3.99Å; F788-F877 HydrophobicContact CZ-CE2 4.4Å; F788-F877 HydrophobicContact CZ-CZ 4.4Å
789	L	90.4	Very high	88.5	Confident	116 Å²	116	55.4 Å²	55.4	61%	0.607	29%	0.289	S	S	*	.			trans	-77.2	157.6	167.8	-65	165	0	0	0	110	H791 D792 L793	L789-H791 PolarHBondContact O-N 3.38Å; L789-H791 VanDerWaalsContact O-N 3.15Å; L789-D792 WeakPolarHBondContact CB-OD2 3.43Å; L789-D792 PolarHBondContact N-OD2 3.48Å; L789-D792 VanDerWaalsContact N-OD2 3.16Å; L789-D792 WeakPolarHBondContact O-CB 3.37Å; L789-D792 PolarHBondContact O-N 3.33Å; L789-L793 PolarHBondContact O-N 3.14Å
790	P	89.1	Confident	89	Confident	94 Å²	94	55.9 Å²	55.9	61%	0.61	29%	0.294	S	S	*	.	H	α-helix	trans	-54	-37.2	177	-28.1	35.4	0	0	0	113.7	D792 L793 Q794	P790-D792 VanDerWaalsContact C-N 3.33Å; P790-D792 PolarHBondContact O-N 3.48Å; P790-L793 PolarHBondContact O-N 3.49Å; P790-Q794 PolarHBondContact O-N 3.24Å; P790-Q794 VanDerWaalsContact O-N 3.12Å
791	H	90.3	Very high	89.4	Confident	116 Å²	116	58.4 Å²	58.4	54%	0.537	30%	0.297	S	S	.	.	H	α-helix	trans	-66	-31.8	176	175.2	-102.4	0	0	0	113	L789 Q794 R795	L789-H791 PolarHBondContact O-N 3.38Å; L789-H791 VanDerWaalsContact O-N 3.15Å; H791-Q794 WeakPolarHBondContact O-CB 3.46Å; H791-Q794 PolarHBondContact O-N 3.06Å; H791-R795 WeakPolarHBondContact CE1-CD 3.19Å; H791-R795 WeakPolarHBondContact O-CG 3.27Å; H791-R795 PolarHBondContact O-N 3.48Å
792	D	90.9	Very high	89.6	Confident	24 Å²	24	63.8 Å²	63.8	13%	0.128	32%	0.323	C	S	.	.	H	α-helix	trans	-70.1	-38.5	177.8	-62.9	-38.9	0	0	0	111.5	F788 L789 P790 Q794 R795 L796 L812	F788-D792 HydrophobicContact CB-CB 4.45Å; L789-D792 WeakPolarHBondContact CB-OD2 3.43Å; L789-D792 PolarHBondContact N-OD2 3.48Å; L789-D792 VanDerWaalsContact N-OD2 3.16Å; L789-D792 WeakPolarHBondContact O-CB 3.37Å; L789-D792 PolarHBondContact O-N 3.33Å; P790-D792 VanDerWaalsContact C-N 3.33Å; P790-D792 PolarHBondContact O-N 3.48Å; D792-Q794 VanDerWaalsContact C-N 3.32Å; D792-R795 WeakPolarHBondContact O-CB 3.45Å; D792-R795 PolarHBondContact O-N 2.99Å; D792-R795 IonicContact OD1-NH1 2.83Å; D792-R795 PolarHBondContact OD1-NH1 3.04Å; D792-L796 PolarHBondContact O-N 3.43Å; D792-L812 HydrophobicContact CB-CD1 3.97Å; D792-L812 HydrophobicContact CB-CD2 3.74Å
793	L	89.9	Confident	89.7	Confident	19 Å²	19	66.4 Å²	66.4	10%	0.099	33%	0.328	C	S	.	.	H	α-helix	trans	-64.4	-38.7	172.3	-57.9	174.1	0	0	0	111.2	L784 F788 L789 P790 L796 E797 F877 L881	L784-L793 HydrophobicContact CD2-CD1 3.46Å; L784-L793 VanDerWaalsContact CD2-CD1 3.46Å; L784-L793 HydrophobicContact CD2-CD2 3.96Å; L784-L793 HydrophobicContact CD2-CG 4.26Å; F788-L793 HydrophobicContact CB-CD2 3.89Å; F788-L793 HydrophobicContact CB-CG 4.16Å; F788-L793 HydrophobicContact CD2-CD2 4.35Å; F788-L793 HydrophobicContact CG-CD2 4.17Å; L789-L793 PolarHBondContact O-N 3.14Å; P790-L793 PolarHBondContact O-N 3.49Å; L793-L796 PolarHBondContact O-N 3.4Å; L793-E797 WeakPolarHBondContact O-CB 3.37Å; L793-E797 PolarHBondContact O-N 3.44Å; L793-F877 HydrophobicContact CD2-CD2 4.27Å; L793-L881 HydrophobicContact CD1-CD1 4.34Å
794	Q	90.3	Very high	89.8	Confident	121 Å²	121	65.5 Å²	65.5	57%	0.565	33%	0.326	S	S	*	.	H	α-helix	trans	-65	-37.4	174.7	-170.5	-176.6	0.9	0	0	112.5	P790 H791 D792 E797 S798	P790-Q794 PolarHBondContact O-N 3.24Å; P790-Q794 VanDerWaalsContact O-N 3.12Å; H791-Q794 WeakPolarHBondContact O-CB 3.46Å; H791-Q794 PolarHBondContact O-N 3.06Å; D792-Q794 VanDerWaalsContact C-N 3.32Å; Q794-E797 PolarHBondContact O-N 3.34Å; Q794-S798 WeakPolarHBondContact O-CB 3.46Å; Q794-S798 PolarHBondContact O-N 2.92Å; Q794-S798 PolarHBondContact O-OG 2.87Å
795	R	92.6	Very high	89.7	Confident	52 Å²	52	71.4 Å²	71.4	20%	0.196	35%	0.353	C	S	.	.	H	α-helix	trans	-64.2	-44.9	173	-75	166.3	61.5	-164.3	9.9	111.4	H791 D792 E797 S798 Y799 L808 D811	H791-R795 WeakPolarHBondContact CE1-CD 3.19Å; H791-R795 WeakPolarHBondContact O-CG 3.27Å; H791-R795 PolarHBondContact O-N 3.48Å; D792-R795 WeakPolarHBondContact O-CB 3.45Å; D792-R795 PolarHBondContact O-N 2.99Å; D792-R795 IonicContact OD1-NH1 2.83Å; D792-R795 PolarHBondContact OD1-NH1 3.04Å; R795-E797 VanDerWaalsContact C-N 3.3Å; R795-E797 PolarHBondContact O-N 2.87Å; R795-S798 PolarHBondContact O-N 2.96Å; R795-Y799 PolarHBondContact O-N 3.18Å; R795-L808 VanDerWaalsContact CZ-O 3.27Å; R795-L808 PolarHBondContact NE-O 3.44Å; R795-L808 PolarHBondContact NH2-O 3.44Å; R795-D811 IonicContact CZ-OD1 2.79Å; R795-D811 IonicContact CZ-OD2 2.91Å; R795-D811 IonicContact NH1-OD2 3.36Å; R795-D811 PolarHBondContact NH1-OD2 2.96Å; R795-D811 VanDerWaalsContact NH2-CG 3.25Å; R795-D811 IonicContact NH2-OD1 3.5Å; R795-D811 PolarHBondContact NH2-OD1 3.24Å; R795-D811 IonicContact NH2-OD2 2.64Å; R795-D811 PolarHBondContact NH2-OD2 3.07Å
796	L	91.1	Very high	89.6	Confident	3 Å²	3	69.8 Å²	69.8	2%	0.016	34%	0.343	C	S	.	.	H	α-helix	trans	-62.5	-38.9	176.1	-172.4	68.4	0	0	0	111.6	D792 L793 Y799 A800 I816 M870 N874 F877	D792-L796 PolarHBondContact O-N 3.43Å; L793-L796 PolarHBondContact O-N 3.4Å; L796-Y799 WeakPolarHBondContact O-CB 3.37Å; L796-Y799 PolarHBondContact O-N 3.07Å; L796-A800 WeakPolarHBondContact O-CB 3.38Å; L796-A800 PolarHBondContact O-N 3.03Å; L796-I816 HydrophobicContact CD1-CD1 4.06Å; L796-I816 HydrophobicContact CD2-CD1 4.22Å; L796-M870 HydrophobicContact CD1-SD 4.37Å; L796-N874 HydrophobicContact CD2-CB 4.2Å; L796-N874 HydrophobicContact CG-CB 4.24Å; L796-F877 HydrophobicContact CD2-CD2 3.72Å; L796-F877 HydrophobicContact CD2-CE2 3.86Å
797	E	90.6	Very high	89.5	Confident	47 Å²	47	73.2 Å²	73.2	22%	0.22	34%	0.343	C	S	.	.	H	α-helix	trans	-65.4	-45.1	174.5	175.6	173.1	156.6	0	0	112.5	L793 Q794 R795 Y799 A800 R801 R878	L793-E797 WeakPolarHBondContact O-CB 3.37Å; L793-E797 PolarHBondContact O-N 3.44Å; Q794-E797 PolarHBondContact O-N 3.34Å; R795-E797 VanDerWaalsContact C-N 3.3Å; R795-E797 PolarHBondContact O-N 2.87Å; E797-Y799 PolarHBondContact O-N 3.23Å; E797-A800 PolarHBondContact O-N 3.3Å; E797-R801 WeakPolarHBondContact O-CG 3.34Å; E797-R801 PolarHBondContact O-N 3.27Å; E797-R801 IonicContact OE1-CZ 3.91Å; E797-R801 IonicContact OE1-NH1 3.34Å; E797-R801 PolarHBondContact OE1-NH1 3.47Å; E797-R801 IonicContact OE1-NH2 2.77Å; E797-R801 PolarHBondContact OE1-NH2 3.44Å; E797-R878 IonicContact OE1-NH2 3.03Å; E797-R878 PolarHBondContact OE1-NH2 3.21Å; E797-R878 IonicContact OE2-CZ 2.82Å; E797-R878 IonicContact OE2-NE 2.71Å; E797-R878 IonicContact OE2-NH2 3.65Å; E797-R878 PolarHBondContact OE2-NH2 2.98Å
798	S	91.2	Very high	89.6	Confident	30 Å²	30	74.4 Å²	74.4	21%	0.21	35%	0.354	C	S	.	.	H	α-helix	trans	-58.9	-39.6	174	-57.5	0	0	0	0	111	Q794 R795 R801 Q802 Q803	Q794-S798 WeakPolarHBondContact O-CB 3.46Å; Q794-S798 PolarHBondContact O-N 2.92Å; Q794-S798 PolarHBondContact O-OG 2.87Å; R795-S798 PolarHBondContact O-N 2.96Å; S798-R801 PolarHBondContact O-N 3.44Å; S798-Q802 PolarHBondContact O-N 3.13Å; S798-Q803 WeakPolarHBondContact O-CB 3.15Å; S798-Q803 PolarHBondContact O-N 2.71Å
799	Y	91.8	Very high	89.5	Confident	16 Å²	16	74.1 Å²	74.1	6%	0.063	35%	0.353	C	S	.	.	H	α-helix	trans	-65.6	-46.5	174.9	-176.5	-103.3	0	0	0	111.5	R795 L796 E797 R801 Q802 S804 F806 I809 F866 F867 M870	R795-Y799 PolarHBondContact O-N 3.18Å; L796-Y799 WeakPolarHBondContact O-CB 3.37Å; L796-Y799 PolarHBondContact O-N 3.07Å; E797-Y799 PolarHBondContact O-N 3.23Å; Y799-R801 PolarHBondContact O-N 2.84Å; Y799-R801 VanDerWaalsContact O-N 3.16Å; Y799-Q802 PolarHBondContact O-N 3.42Å; Y799-S804 WeakPolarHBondContact CA-OG 3.46Å; Y799-S804 VanDerWaalsContact CB-OG 3.29Å; Y799-S804 WeakPolarHBondContact CB-OG 3.42Å; Y799-S804 WeakPolarHBondContact CD2-O 3.47Å; Y799-S804 PolarHBondContact N-OG 2.73Å; Y799-F806 HydrophobicContact CE2-CB 4.33Å; Y799-I809 HydrophobicContact CD1-CD1 3.33Å; Y799-I809 HydrophobicContact CD1-CG1 4.46Å; Y799-I809 HydrophobicContact CD2-CD1 3.91Å; Y799-I809 HydrophobicContact CD2-CG1 4.3Å; Y799-I809 HydrophobicContact CE1-CD1 3.41Å; Y799-I809 VanDerWaalsContact CE1-CD1 3.41Å; Y799-I809 HydrophobicContact CE2-CD1 4Å; Y799-I809 HydrophobicContact CG-CD1 3.58Å; Y799-I809 HydrophobicContact CG-CG1 4.27Å; Y799-I809 HydrophobicContact CG-CG2 4.18Å; Y799-F866 HydrophobicContact CE1-CD1 4.37Å; Y799-F866 AromaticContact CE1-CE1 3.93Å; Y799-F866 HydrophobicContact CE1-CE1 3.93Å; Y799-F866 AromaticContact CZ-CE1 3.91Å; Y799-F866 WeakPolarHBondContact OH-CD1 3.37Å; Y799-F866 WeakPolarHBondContact OH-CE1 3.39Å; Y799-F867 HydrophobicContact CD1-CD2 4.48Å; Y799-F867 AromaticContact CE1-CD2 3.94Å; Y799-F867 HydrophobicContact CE1-CD2 3.94Å; Y799-F867 VanDerWaalsContact O-CE2 3.28Å; Y799-F867 WeakPolarHBondContact O-CE2 3.35Å; Y799-M870 HydrophobicContact CD1-CB 4Å; Y799-M870 HydrophobicContact CD1-CG 4.37Å; Y799-M870 HydrophobicContact CE1-CB 3.85Å; Y799-M870 HydrophobicContact CE1-CG 3.97Å
800	A	89.9	Confident	89.4	Confident	15 Å²	15	72.3 Å²	72.3	12%	0.124	34%	0.343	C	S	.	.	H	α-helix	trans	-61.5	-23.1	177.2	0	0	0	0	0	113.3	L796 E797 F867 N874	L796-A800 WeakPolarHBondContact O-CB 3.38Å; L796-A800 PolarHBondContact O-N 3.03Å; E797-A800 PolarHBondContact O-N 3.3Å; A800-F867 WeakPolarHBondContact O-CZ 3.4Å; A800-N874 HydrophobicContact CB-CB 4.21Å
801	R	90.4	Very high	89.4	Confident	138 Å²	138	71.8 Å²	71.8	52%	0.521	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	4.1	172.2	-71.4	-177.6	174.3	138.7	7.1	114.5	E797 S798 Y799 Q803	E797-R801 WeakPolarHBondContact O-CG 3.34Å; E797-R801 PolarHBondContact O-N 3.27Å; E797-R801 IonicContact OE1-CZ 3.91Å; E797-R801 IonicContact OE1-NH1 3.34Å; E797-R801 PolarHBondContact OE1-NH1 3.47Å; E797-R801 IonicContact OE1-NH2 2.77Å; E797-R801 PolarHBondContact OE1-NH2 3.44Å; S798-R801 PolarHBondContact O-N 3.44Å; Y799-R801 PolarHBondContact O-N 2.84Å; Y799-R801 VanDerWaalsContact O-N 3.16Å; R801-Q803 VanDerWaalsContact C-N 3.25Å; R801-Q803 HydrophobicContact CB-CG 4.09Å; R801-Q803 PolarHBondContact O-N 2.93Å
802	Q	88.3	Confident	89.5	Confident	152 Å²	152	66.8 Å²	66.8	71%	0.71	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	25.6	-176	-57.1	178.4	-9	0	0	114.4	S798 Y799 F867	S798-Q802 PolarHBondContact O-N 3.13Å; Y799-Q802 PolarHBondContact O-N 3.42Å; Q802-F867 HydrophobicContact CG-CD2 4.36Å; Q802-F867 HydrophobicContact CG-CE1 4.28Å; Q802-F867 HydrophobicContact CG-CE2 3.38Å; Q802-F867 HydrophobicContact CG-CZ 3.35Å
803	Q	88.4	Confident	89.4	Confident	139 Å²	139	65.7 Å²	65.7	65%	0.65	31%	0.306	S	S	*	.			trans	-94.7	-11.3	-179.6	-64.9	178.1	-29.7	0	0	113.3	S798 R801	S798-Q803 WeakPolarHBondContact O-CB 3.15Å; S798-Q803 PolarHBondContact O-N 2.71Å; R801-Q803 VanDerWaalsContact C-N 3.25Å; R801-Q803 HydrophobicContact CB-CG 4.09Å; R801-Q803 PolarHBondContact O-N 2.93Å
804	S	85.6	Confident	89.5	Confident	27 Å²	27	67.7 Å²	67.7	19%	0.189	32%	0.319	C	S	.	.	S	Bend	trans	-130.1	153.5	-178.6	62.2	0	0	0	0	112.4	Y799	Y799-S804 WeakPolarHBondContact CA-OG 3.46Å; Y799-S804 VanDerWaalsContact CB-OG 3.29Å; Y799-S804 WeakPolarHBondContact CB-OG 3.42Å; Y799-S804 WeakPolarHBondContact CD2-O 3.47Å; Y799-S804 PolarHBondContact N-OG 2.73Å
805	E	86.8	Confident	89.5	Confident	123 Å²	123	64.2 Å²	64.2	58%	0.575	31%	0.305	S	S	*	.			trans	-77	154	176	-68.1	-169.8	-173.4	0	0	112.4	R807 L808	E805-R807 PolarHBondContact O-N 3.39Å; E805-R807 VanDerWaalsContact O-N 3.11Å; E805-R807 IonicContact OE2-NE 3.74Å; E805-R807 PolarHBondContact OE2-NE 3.05Å; E805-R807 IonicContact OE2-NH2 3.23Å; E805-L808 PolarHBondContact O-N 3.14Å; E805-L808 VanDerWaalsContact O-N 3.07Å
806	F	85.8	Confident	89.4	Confident	40 Å²	40	61.7 Å²	61.7	18%	0.175	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-49.8	-37.2	175	166.2	-107.1	0	0	0	113.7	Y799 L808 I809 I810 L813 L841 V848 L863 F866	Y799-F806 HydrophobicContact CE2-CB 4.33Å; F806-L808 PolarHBondContact O-N 3.11Å; F806-L808 VanDerWaalsContact O-N 3.16Å; F806-I809 WeakPolarHBondContact O-CG1 3.45Å; F806-I809 PolarHBondContact O-N 2.75Å; F806-I809 VanDerWaalsContact O-N 3.14Å; F806-I810 HydrophobicContact CD1-CD1 3.9Å; F806-I810 HydrophobicContact CD1-CG1 4.14Å; F806-I810 HydrophobicContact CE1-CD1 3.43Å; F806-I810 VanDerWaalsContact CE1-CD1 3.43Å; F806-I810 HydrophobicContact CE1-CG1 3.7Å; F806-I810 HydrophobicContact CE2-CG1 4.19Å; F806-I810 HydrophobicContact CZ-CD1 3.94Å; F806-I810 HydrophobicContact CZ-CG1 3.73Å; F806-I810 WeakPolarHBondContact O-CG1 3.42Å; F806-L813 HydrophobicContact CE2-CD1 3.94Å; F806-L813 HydrophobicContact CZ-CD1 4.32Å; F806-L841 HydrophobicContact CE2-CD1 4.27Å; F806-L841 HydrophobicContact CZ-CD1 4.21Å; F806-V848 HydrophobicContact CE1-CG2 4.46Å; F806-L863 HydrophobicContact CD1-CD2 4.39Å; F806-L863 HydrophobicContact CD2-CD2 4.35Å; F806-L863 HydrophobicContact CG-CD2 4.19Å; F806-F866 AromaticContact CD2-CD1 3.89Å; F806-F866 HydrophobicContact CD2-CD1 3.89Å; F806-F866 AromaticContact CD2-CE1 3.37Å; F806-F866 HydrophobicContact CD2-CE1 3.37Å; F806-F866 AromaticContact CD2-CZ 3.88Å; F806-F866 HydrophobicContact CD2-CZ 3.88Å; F806-F866 HydrophobicContact CE2-CD1 4.06Å; F806-F866 AromaticContact CE2-CE1 3.52Å; F806-F866 HydrophobicContact CE2-CE1 3.52Å; F806-F866 HydrophobicContact CE2-CE2 4.17Å; F806-F866 AromaticContact CE2-CZ 3.56Å; F806-F866 HydrophobicContact CE2-CZ 3.56Å
807	R	87.8	Confident	89.3	Confident	189 Å²	189	61.6 Å²	61.6	71%	0.713	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-59.5	-28.8	-178	-65.8	-179.8	-123.4	-112.8	0.5	113.4	E805 I809	E805-R807 PolarHBondContact O-N 3.39Å; E805-R807 VanDerWaalsContact O-N 3.11Å; E805-R807 IonicContact OE2-NE 3.74Å; E805-R807 PolarHBondContact OE2-NE 3.05Å; E805-R807 IonicContact OE2-NH2 3.23Å; R807-I809 VanDerWaalsContact C-N 3.25Å; R807-I809 PolarHBondContact O-N 3.28Å
808	L	88.8	Confident	89.2	Confident	96 Å²	96	61.5 Å²	61.5	50%	0.503	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-79.4	-0	-178.5	-69.4	175.6	0	0	0	113.9	R795 E805 F806	R795-L808 VanDerWaalsContact CZ-O 3.27Å; R795-L808 PolarHBondContact NE-O 3.44Å; R795-L808 PolarHBondContact NH2-O 3.44Å; E805-L808 PolarHBondContact O-N 3.14Å; E805-L808 VanDerWaalsContact O-N 3.07Å; F806-L808 PolarHBondContact O-N 3.11Å; F806-L808 VanDerWaalsContact O-N 3.16Å
809	I	90	Very high	89.1	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-125.4	0.1	177.4	58.8	159.7	0	0	0	113.2	Y799 F806 R807 D811 L812 L813 F866 M870	Y799-I809 HydrophobicContact CD1-CD1 3.33Å; Y799-I809 HydrophobicContact CD1-CG1 4.46Å; Y799-I809 HydrophobicContact CD2-CD1 3.91Å; Y799-I809 HydrophobicContact CD2-CG1 4.3Å; Y799-I809 HydrophobicContact CE1-CD1 3.41Å; Y799-I809 VanDerWaalsContact CE1-CD1 3.41Å; Y799-I809 HydrophobicContact CE2-CD1 4Å; Y799-I809 HydrophobicContact CG-CD1 3.58Å; Y799-I809 HydrophobicContact CG-CG1 4.27Å; Y799-I809 HydrophobicContact CG-CG2 4.18Å; F806-I809 WeakPolarHBondContact O-CG1 3.45Å; F806-I809 PolarHBondContact O-N 2.75Å; F806-I809 VanDerWaalsContact O-N 3.14Å; R807-I809 VanDerWaalsContact C-N 3.25Å; R807-I809 PolarHBondContact O-N 3.28Å; I809-D811 VanDerWaalsContact C-N 3.26Å; I809-D811 PolarHBondContact O-N 2.88Å; I809-L812 PolarHBondContact O-N 3.38Å; I809-L812 VanDerWaalsContact O-N 3.09Å; I809-L813 HydrophobicContact CD1-CD2 4.45Å; I809-L813 WeakPolarHBondContact O-CG 3.41Å; I809-L813 PolarHBondContact O-N 2.87Å; I809-F866 HydrophobicContact CD1-CE1 3.74Å; I809-F866 HydrophobicContact CD1-CZ 3.92Å; I809-M870 HydrophobicContact CD1-CG 4.11Å
810	I	88.7	Confident	88.9	Confident	78 Å²	78	60.9 Å²	60.9	40%	0.4	29%	0.287	S	S	.	.	H	α-helix	trans	-59.5	-38.7	-175.9	-65.7	178.6	0	0	0	111.5	F806 L812 L813	F806-I810 HydrophobicContact CD1-CD1 3.9Å; F806-I810 HydrophobicContact CD1-CG1 4.14Å; F806-I810 HydrophobicContact CE1-CD1 3.43Å; F806-I810 VanDerWaalsContact CE1-CD1 3.43Å; F806-I810 HydrophobicContact CE1-CG1 3.7Å; F806-I810 HydrophobicContact CE2-CG1 4.19Å; F806-I810 HydrophobicContact CZ-CD1 3.94Å; F806-I810 HydrophobicContact CZ-CG1 3.73Å; F806-I810 WeakPolarHBondContact O-CG1 3.42Å; I810-L812 VanDerWaalsContact C-N 3.28Å; I810-L812 PolarHBondContact O-N 3.29Å; I810-L813 PolarHBondContact O-N 3.11Å
811	D	89.4	Confident	88.7	Confident	83 Å²	83	60.7 Å²	60.7	44%	0.444	28%	0.284	S	S	.	.	H	α-helix	trans	-56.8	-40.2	176.1	53.2	-33.5	0	0	0	112.1	R795 I809 L813	R795-D811 IonicContact CZ-OD1 2.79Å; R795-D811 IonicContact CZ-OD2 2.91Å; R795-D811 IonicContact NH1-OD2 3.36Å; R795-D811 PolarHBondContact NH1-OD2 2.96Å; R795-D811 VanDerWaalsContact NH2-CG 3.25Å; R795-D811 IonicContact NH2-OD1 3.5Å; R795-D811 PolarHBondContact NH2-OD1 3.24Å; R795-D811 IonicContact NH2-OD2 2.64Å; R795-D811 PolarHBondContact NH2-OD2 3.07Å; I809-D811 VanDerWaalsContact C-N 3.26Å; I809-D811 PolarHBondContact O-N 2.88Å; D811-L813 VanDerWaalsContact C-N 3.34Å; D811-L813 PolarHBondContact O-N 3.01Å
812	L	91	Very high	88.4	Confident	10 Å²	10	55.6 Å²	55.6	5%	0.052	27%	0.266	C	S	.	.	H	α-helix	trans	-76.9	-18.3	-177.8	-52.2	-179.7	0	0	0	113.5	F788 D792 I809 I810 T814 D815 I816	F788-L812 HydrophobicContact CD1-CD2 4.24Å; F788-L812 HydrophobicContact CE1-CB 4.35Å; F788-L812 HydrophobicContact CE1-CD2 4.45Å; D792-L812 HydrophobicContact CB-CD1 3.97Å; D792-L812 HydrophobicContact CB-CD2 3.74Å; I809-L812 PolarHBondContact O-N 3.38Å; I809-L812 VanDerWaalsContact O-N 3.09Å; I810-L812 VanDerWaalsContact C-N 3.28Å; I810-L812 PolarHBondContact O-N 3.29Å; L812-T814 VanDerWaalsContact C-N 3.29Å; L812-T814 PolarHBondContact O-N 3.42Å; L812-D815 PolarHBondContact O-N 2.94Å; L812-I816 HydrophobicContact CB-CD1 4.17Å; L812-I816 VanDerWaalsContact O-CG1 3.3Å; L812-I816 WeakPolarHBondContact O-CG1 3.15Å; L812-I816 PolarHBondContact O-N 2.84Å; L812-I816 VanDerWaalsContact O-N 3.13Å
813	L	90	Very high	88	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-66.1	-31.8	-172	-61	-179.9	0	0	0	113.8	F806 I809 I810 D811 D815 A817 L841 F866 M870	F806-L813 HydrophobicContact CE2-CD1 3.94Å; F806-L813 HydrophobicContact CZ-CD1 4.32Å; I809-L813 HydrophobicContact CD1-CD2 4.45Å; I809-L813 WeakPolarHBondContact O-CG 3.41Å; I809-L813 PolarHBondContact O-N 2.87Å; I810-L813 PolarHBondContact O-N 3.11Å; D811-L813 VanDerWaalsContact C-N 3.34Å; D811-L813 PolarHBondContact O-N 3.01Å; L813-D815 VanDerWaalsContact C-N 3.33Å; L813-A817 WeakPolarHBondContact O-CB 3.43Å; L813-A817 PolarHBondContact O-N 3.48Å; L813-L841 HydrophobicContact CD1-CB 4.47Å; L813-F866 HydrophobicContact CD1-CE2 3.89Å; L813-F866 HydrophobicContact CD1-CZ 3.72Å; L813-F866 HydrophobicContact CD2-CE2 3.81Å; L813-F866 HydrophobicContact CD2-CZ 3.48Å; L813-F866 VanDerWaalsContact CD2-CZ 3.48Å; L813-F866 HydrophobicContact CG-CZ 4.24Å; L813-M870 HydrophobicContact CD2-CE 4.27Å; L813-M870 HydrophobicContact CD2-SD 3.58Å; L813-M870 VanDerWaalsContact CD2-SD 3.58Å
814	T	90.4	Very high	87.6	Confident	61 Å²	61	46.3 Å²	46.3	37%	0.374	23%	0.234	S	C	.	.	H	α-helix	trans	-62.5	-46	-179.8	-54.3	0	0	0	0	110.1	L812 Q818 G842	L812-T814 VanDerWaalsContact C-N 3.29Å; L812-T814 PolarHBondContact O-N 3.42Å; T814-Q818 WeakPolarHBondContact O-CB 3.4Å; T814-Q818 VanDerWaalsContact O-CG 3.24Å; T814-Q818 WeakPolarHBondContact O-CG 3.47Å; T814-Q818 PolarHBondContact O-N 2.66Å; T814-G842 WeakPolarHBondContact CA-O 3.34Å; T814-G842 PolarHBondContact OG1-O 3.37Å
815	D	90.4	Very high	87.3	Confident	48 Å²	48	45.6 Å²	45.6	26%	0.257	23%	0.228	S	C	.	.	H	α-helix	trans	-72.4	-43.8	-178.3	-61.1	-52	0	0	0	111.6	Y787 F788 L812 L813 A817 Q818 L819	Y787-D815 HydrophobicContact CD1-CB 4.31Å; F788-D815 HydrophobicContact CE1-CB 3.94Å; F788-D815 HydrophobicContact CZ-CB 3.84Å; L812-D815 PolarHBondContact O-N 2.94Å; L813-D815 VanDerWaalsContact C-N 3.33Å; D815-A817 VanDerWaalsContact C-N 3.33Å; D815-A817 PolarHBondContact O-N 3.32Å; D815-Q818 PolarHBondContact O-N 2.93Å; D815-L819 WeakPolarHBondContact O-CG 3.41Å; D815-L819 PolarHBondContact O-N 3.33Å
816	I	90.1	Very high	86.3	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-57.5	-47.6	175.5	-64.6	170.3	0	0	0	110.5	F788 L796 L812 L819 Y820 M870 C873 F877	F788-I816 HydrophobicContact CE1-CG1 4.05Å; F788-I816 HydrophobicContact CZ-CG1 3.64Å; L796-I816 HydrophobicContact CD1-CD1 4.06Å; L796-I816 HydrophobicContact CD2-CD1 4.22Å; L812-I816 HydrophobicContact CB-CD1 4.17Å; L812-I816 VanDerWaalsContact O-CG1 3.3Å; L812-I816 WeakPolarHBondContact O-CG1 3.15Å; L812-I816 PolarHBondContact O-N 2.84Å; L812-I816 VanDerWaalsContact O-N 3.13Å; I816-L819 PolarHBondContact O-N 2.95Å; I816-Y820 WeakPolarHBondContact O-CB 3.26Å; I816-Y820 PolarHBondContact O-N 3.39Å; I816-M870 HydrophobicContact CD1-SD 4.3Å; I816-M870 HydrophobicContact CG2-CE 4.39Å; I816-C873 HydrophobicContact CG2-CB 4.3Å; I816-F877 HydrophobicContact CD1-CE2 4.45Å; I816-F877 HydrophobicContact CG1-CE2 4.09Å; I816-F877 HydrophobicContact CG1-CZ 4.23Å
817	A	90.3	Very high	85.5	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-67.4	-38.3	180	0	0	0	0	0	111.9	L813 D815 Y820 F821 L838 V843	L813-A817 WeakPolarHBondContact O-CB 3.43Å; L813-A817 PolarHBondContact O-N 3.48Å; D815-A817 VanDerWaalsContact C-N 3.33Å; D815-A817 PolarHBondContact O-N 3.32Å; A817-Y820 PolarHBondContact O-N 3.02Å; A817-F821 HydrophobicContact CB-CD2 4.4Å; A817-F821 HydrophobicContact CB-CE2 4.46Å; A817-F821 WeakPolarHBondContact O-CD2 3.15Å; A817-F821 PolarHBondContact O-N 3.45Å; A817-L838 HydrophobicContact CB-CD1 3.92Å; A817-L838 HydrophobicContact CB-CG 3.87Å; A817-V843 HydrophobicContact CB-CG2 3.54Å
818	Q	88.4	Confident	85.2	Confident	46 Å²	46	38.9 Å²	38.9	22%	0.215	23%	0.228	C	C	.	.	H	α-helix	trans	-62.8	-44.8	175.3	-79.2	-175.8	34.7	0	0	112.4	T814 D815 Y820 Q822	T814-Q818 WeakPolarHBondContact O-CB 3.4Å; T814-Q818 VanDerWaalsContact O-CG 3.24Å; T814-Q818 WeakPolarHBondContact O-CG 3.47Å; T814-Q818 PolarHBondContact O-N 2.66Å; D815-Q818 PolarHBondContact O-N 2.93Å; Q818-Y820 VanDerWaalsContact C-N 3.34Å; Q818-Q822 VanDerWaalsContact O-CB 3.26Å; Q818-Q822 WeakPolarHBondContact O-CB 3.23Å; Q818-Q822 WeakPolarHBondContact O-CG 3.15Å; Q818-Q822 PolarHBondContact O-N 3.24Å
819	L	88	Confident	84.8	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-62.8	-42.5	177.2	-69.5	173.5	0	0	0	111.3	L779 Y787 F788 D815 I816 G823 R824 I825	L779-L819 HydrophobicContact CD1-CD1 4.35Å; L779-L819 HydrophobicContact CD1-CD2 4.4Å; Y787-L819 HydrophobicContact CD2-CD1 4.37Å; Y787-L819 HydrophobicContact CD2-CD2 4.09Å; Y787-L819 HydrophobicContact CE2-CD2 3.83Å; Y787-L819 HydrophobicContact CG-CD1 4.38Å; F788-L819 HydrophobicContact CE2-CD1 3.75Å; F788-L819 HydrophobicContact CZ-CD1 4.24Å; D815-L819 WeakPolarHBondContact O-CG 3.41Å; D815-L819 PolarHBondContact O-N 3.33Å; I816-L819 PolarHBondContact O-N 2.95Å; L819-G823 PolarHBondContact O-N 3.31Å; L819-R824 PolarHBondContact O-N 3.44Å; L819-R824 VanDerWaalsContact O-N 3.15Å; L819-I825 HydrophobicContact CB-CD1 3.96Å; L819-I825 HydrophobicContact CB-CG1 3.99Å
820	Y	88.5	Confident	84.6	Confident	31 Å²	31	42.7 Å²	42.7	12%	0.122	24%	0.244	C	C	.	.	H	α-helix	trans	-61.5	-55.4	176.7	-178.3	-108.8	0	0	0	112.4	I816 A817 Q818 Q822 G823 L828 L830 Q835 L838	I816-Y820 WeakPolarHBondContact O-CB 3.26Å; I816-Y820 PolarHBondContact O-N 3.39Å; A817-Y820 PolarHBondContact O-N 3.02Å; Q818-Y820 VanDerWaalsContact C-N 3.34Å; Y820-Q822 VanDerWaalsContact C-N 3.27Å; Y820-Q822 PolarHBondContact O-N 2.93Å; Y820-G823 PolarHBondContact O-N 3.33Å; Y820-L828 HydrophobicContact CD2-CB 4.49Å; Y820-L828 HydrophobicContact CD2-CD2 3.65Å; Y820-L828 HydrophobicContact CD2-CG 4.21Å; Y820-L828 HydrophobicContact CE2-CB 4.23Å; Y820-L828 HydrophobicContact CE2-CD2 3.88Å; Y820-L828 HydrophobicContact CE2-CG 3.94Å; Y820-L828 WeakPolarHBondContact CE2-O 3.38Å; Y820-L830 HydrophobicContact CD1-CD1 4.42Å; Y820-L830 HydrophobicContact CD2-CD1 4.4Å; Y820-L830 HydrophobicContact CE1-CD1 4.04Å; Y820-L830 HydrophobicContact CE2-CD1 4.01Å; Y820-L830 HydrophobicContact CE2-CG 4.19Å; Y820-Q835 HydrophobicContact CE1-CG 3.9Å; Y820-Q835 PolarHBondContact OH-NE2 3.44Å; Y820-Q835 VanDerWaalsContact OH-NE2 3.11Å; Y820-L838 HydrophobicContact CD1-CD2 3.87Å; Y820-L838 HydrophobicContact CG-CD2 4.07Å
821	F	86.7	Confident	84.6	Confident	11 Å²	11	43 Å²	43	5%	0.048	25%	0.246	C	C	.	.	H	α-helix	trans	-74.9	-14.6	-175.4	-71.8	-65.6	0	0	0	114.1	R741 L745 L761 L764 A817 Q835 L838 L839 V843	R741-F821 PolarHBondContact NH2-O 2.99Å; L745-F821 HydrophobicContact CD1-CB 3.81Å; L745-F821 HydrophobicContact CD2-CB 3.69Å; L745-F821 HydrophobicContact CD2-CD2 4.38Å; L745-F821 HydrophobicContact CD2-CG 4.16Å; L745-F821 HydrophobicContact CG-CB 4.42Å; L761-F821 HydrophobicContact CD2-CE1 3.94Å; L761-F821 HydrophobicContact CD2-CZ 4.1Å; L764-F821 HydrophobicContact CD1-CB 4.45Å; L764-F821 HydrophobicContact CD1-CD1 3.8Å; L764-F821 HydrophobicContact CD1-CE1 4.24Å; L764-F821 HydrophobicContact CD1-CG 4.09Å; A817-F821 HydrophobicContact CB-CD2 4.4Å; A817-F821 HydrophobicContact CB-CE2 4.46Å; A817-F821 WeakPolarHBondContact O-CD2 3.15Å; A817-F821 PolarHBondContact O-N 3.45Å; F821-Q835 HydrophobicContact CZ-CB 4.47Å; F821-Q835 WeakPolarHBondContact CZ-O 3.45Å; F821-L838 HydrophobicContact CE2-CG 4.39Å; F821-L839 HydrophobicContact CD2-CD1 3.8Å; F821-L839 HydrophobicContact CE1-CD1 4.46Å; F821-L839 HydrophobicContact CE2-CB 3.72Å; F821-L839 HydrophobicContact CE2-CD1 3.53Å; F821-L839 HydrophobicContact CE2-CG 4.23Å; F821-L839 HydrophobicContact CG-CD1 4.41Å; F821-L839 HydrophobicContact CZ-CB 3.69Å; F821-L839 HydrophobicContact CZ-CD1 3.9Å; F821-L839 HydrophobicContact CZ-CG 4.3Å; F821-V843 HydrophobicContact CD2-CG2 4.48Å
822	Q	83.4	Confident	84.5	Confident	31 Å²	31	44.3 Å²	44.3	15%	0.145	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-8.3	166.9	-73.5	175.9	35	0	0	112.8	L745 Q818 Y820 R824	L745-Q822 HydrophobicContact CD1-CG 4.24Å; Q818-Q822 VanDerWaalsContact O-CB 3.26Å; Q818-Q822 WeakPolarHBondContact O-CB 3.23Å; Q818-Q822 WeakPolarHBondContact O-CG 3.15Å; Q818-Q822 PolarHBondContact O-N 3.24Å; Y820-Q822 VanDerWaalsContact C-N 3.27Å; Y820-Q822 PolarHBondContact O-N 2.93Å; Q822-R824 HydrophobicContact CB-CG 4.13Å; Q822-R824 VanDerWaalsContact OE1-CZ 3.26Å; Q822-R824 VanDerWaalsContact OE1-NE 3.13Å; Q822-R824 VanDerWaalsContact OE1-NH2 3.12Å
823	G	79.8	Confident	84.4	Confident	50 Å²	50	46.5 Å²	46.5	52%	0.515	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.1	26.3	-178.8	0	0	0	0	0	113.3	L819 Y820	L819-G823 PolarHBondContact O-N 3.31Å; Y820-G823 PolarHBondContact O-N 3.33Å
824	R	79.9	Confident	84.4	Confident	47 Å²	47	46.7 Å²	46.7	18%	0.177	27%	0.267	C	S	.	.			trans	-86.8	-23.5	177.9	-62.5	-171	-174.8	-175.3	2.5	113.2	L779 M783 Y787 L819 Q822 D826	L779-R824 WeakPolarHBondContact CB-O 3.13Å; L779-R824 PolarHBondContact N-O 3.2Å; L779-R824 VanDerWaalsContact N-O 3.08Å; M783-R824 PolarHBondContact SD-NH1 3.07Å; Y787-R824 PolarHBondContact OH-NH1 3.44Å; L819-R824 PolarHBondContact O-N 3.44Å; L819-R824 VanDerWaalsContact O-N 3.15Å; Q822-R824 HydrophobicContact CB-CG 4.13Å; Q822-R824 VanDerWaalsContact OE1-CZ 3.26Å; Q822-R824 VanDerWaalsContact OE1-NE 3.13Å; Q822-R824 VanDerWaalsContact OE1-NH2 3.12Å; R824-D826 PolarHBondContact O-N 3.42Å
825	I	79.3	Confident	84.4	Confident	12 Å²	12	44.4 Å²	44.4	6%	0.062	25%	0.252	C	S	.	.	S	Bend	trans	-86.5	101.6	176.8	-54	-177.8	0	0	0	107.5	L779 L819 L828 C876 F877	L779-I825 HydrophobicContact CD2-CG1 4.47Å; L819-I825 HydrophobicContact CB-CD1 3.96Å; L819-I825 HydrophobicContact CB-CG1 3.99Å; I825-L828 HydrophobicContact CD1-CD2 4.41Å; I825-L828 HydrophobicContact CG2-CB 3.64Å; I825-L828 HydrophobicContact CG2-CD2 3.91Å; I825-L828 HydrophobicContact CG2-CG 4.4Å; I825-C876 HydrophobicContact CG2-CB 4.18Å; I825-C876 WeakPolarHBondContact CG2-SG 3.4Å; I825-F877 HydrophobicContact CD1-CE1 4.02Å; I825-F877 HydrophobicContact CD1-CZ 4.32Å
826	D	66.3	Low	84.4	Confident	122 Å²	122	42.3 Å²	42.3	65%	0.652	24%	0.242	S	C	*	.			trans	-75.3	150.3	178.6	-163.1	12.1	0	0	0	111.5	V778 R824 L828	V778-D826 HydrophobicContact CG1-CB 4.07Å; R824-D826 PolarHBondContact O-N 3.42Å; D826-L828 PolarHBondContact O-N 2.91Å
827	G	68.9	Low	84.5	Confident	69 Å²	69	42.4 Å²	42.4	71%	0.711	24%	0.242	S	C	*	.	S	Bend	trans	71	-10.2	176.7	0	0	0	0	0	117.3	Q829	G827-Q829 PolarHBondContact O-N 3.29Å
828	L	80	Confident	84.6	Confident	20 Å²	20	42.5 Å²	42.5	11%	0.105	24%	0.243	C	C	.	.			trans	-77.8	96.3	-177.5	-176.6	62.4	0	0	0	112.6	Y820 I825 D826 L830 R872 C873	Y820-L828 HydrophobicContact CD2-CB 4.49Å; Y820-L828 HydrophobicContact CD2-CD2 3.65Å; Y820-L828 HydrophobicContact CD2-CG 4.21Å; Y820-L828 HydrophobicContact CE2-CB 4.23Å; Y820-L828 HydrophobicContact CE2-CD2 3.88Å; Y820-L828 HydrophobicContact CE2-CG 3.94Å; Y820-L828 WeakPolarHBondContact CE2-O 3.38Å; I825-L828 HydrophobicContact CD1-CD2 4.41Å; I825-L828 HydrophobicContact CG2-CB 3.64Å; I825-L828 HydrophobicContact CG2-CD2 3.91Å; I825-L828 HydrophobicContact CG2-CG 4.4Å; D826-L828 PolarHBondContact O-N 2.91Å; L828-L830 HydrophobicContact CD1-CD2 4.03Å; L828-L830 HydrophobicContact CD1-CG 4.36Å; L828-L830 HydrophobicContact CD2-CD1 4.39Å; L828-L830 HydrophobicContact CD2-CG 4.38Å; L828-L830 HydrophobicContact CG-CD2 4.32Å; L828-L830 HydrophobicContact CG-CG 4.1Å; L828-R872 HydrophobicContact CD1-CB 3.58Å; L828-C873 VanDerWaalsContact CD2-SG 3.6Å
829	Q	81.3	Confident	84.7	Confident	165 Å²	165	40.3 Å²	40.3	77%	0.771	23%	0.232	S	C	*	.			trans	-92	104.9	173.1	-62.9	-168.6	-0	0	0	111.6	G827 R872	G827-Q829 PolarHBondContact O-N 3.29Å; Q829-R872 PolarHBondContact O-NH1 3.31Å
830	L	85.3	Confident	84.9	Confident	11 Å²	11	40.2 Å²	40.2	6%	0.058	23%	0.232	C	C	.	.			trans	-98.8	142.8	170.8	-62.6	-179.7	0	0	0	110.4	Y820 L828 Q834 Q835 L838 A869 R872	Y820-L830 HydrophobicContact CD1-CD1 4.42Å; Y820-L830 HydrophobicContact CD2-CD1 4.4Å; Y820-L830 HydrophobicContact CE1-CD1 4.04Å; Y820-L830 HydrophobicContact CE2-CD1 4.01Å; Y820-L830 HydrophobicContact CE2-CG 4.19Å; L828-L830 HydrophobicContact CD1-CD2 4.03Å; L828-L830 HydrophobicContact CD1-CG 4.36Å; L828-L830 HydrophobicContact CD2-CD1 4.39Å; L828-L830 HydrophobicContact CD2-CG 4.38Å; L828-L830 HydrophobicContact CG-CD2 4.32Å; L828-L830 HydrophobicContact CG-CG 4.1Å; L830-Q834 HydrophobicContact CB-CB 4.15Å; L830-Q835 HydrophobicContact CB-CG 3.61Å; L830-Q835 PolarHBondContact O-NE2 3.13Å; L830-L838 HydrophobicContact CD1-CD2 3.83Å; L830-A869 HydrophobicContact CD2-CB 4.02Å; L830-R872 HydrophobicContact CD2-CB 4.43Å
831	D	88.6	Confident	85	Confident	84 Å²	84	39.8 Å²	39.8	45%	0.449	23%	0.232	S	C	.	.			trans	-63.9	154.9	172.3	-178.7	29.1	0	0	0	111.2	V833 Q834 Q835	D831-V833 PolarHBondContact O-N 3.16Å; D831-V833 VanDerWaalsContact O-N 3.16Å; D831-Q834 HydrophobicContact CB-CB 4.43Å; D831-Q834 HydrophobicContact CB-CG 4.22Å; D831-Q834 VanDerWaalsContact N-OE1 3.1Å; D831-Q834 WeakPolarHBondContact O-CA 3.47Å; D831-Q834 WeakPolarHBondContact O-CB 3.46Å; D831-Q834 PolarHBondContact O-N 3.25Å; D831-Q835 WeakPolarHBondContact O-CG 3.38Å; D831-Q835 PolarHBondContact O-N 3Å
832	L	87	Confident	85.1	Confident	111 Å²	111	39.5 Å²	39.5	58%	0.581	23%	0.232	S	C	*	.	H	α-helix	trans	-54.5	-38.2	-178.5	-70.9	173.8	0	0	0	112.5	G836	L832-G836 PolarHBondContact O-N 3.14Å
833	V	89.3	Confident	85.4	Confident	55 Å²	55	38.7 Å²	38.7	33%	0.333	23%	0.229	S	C	.	.	H	α-helix	trans	-68.5	-44.6	176.6	-179.3	0	0	0	0	110.7	D831 Q835 G836 I837 M857	D831-V833 PolarHBondContact O-N 3.16Å; D831-V833 VanDerWaalsContact O-N 3.16Å; V833-Q835 VanDerWaalsContact C-N 3.35Å; V833-Q835 PolarHBondContact O-N 3.43Å; V833-G836 PolarHBondContact O-N 3.08Å; V833-G836 VanDerWaalsContact O-N 3.13Å; V833-I837 HydrophobicContact CG1-CD1 3.93Å; V833-I837 HydrophobicContact CG1-CG1 4.46Å; V833-I837 VanDerWaalsContact O-CG1 3.28Å; V833-I837 WeakPolarHBondContact O-CG1 3.49Å; V833-I837 PolarHBondContact O-N 3.39Å; V833-M857 HydrophobicContact CG1-CE 3.67Å
834	Q	90.8	Very high	86	Confident	6 Å²	6	36.4 Å²	36.4	3%	0.028	21%	0.205	C	C	.	.	H	α-helix	trans	-62	-41.9	177.2	-69.6	177.4	-30.6	0	0	111.9	L830 D831 G836 I837 L838 A869	L830-Q834 HydrophobicContact CB-CB 4.15Å; D831-Q834 HydrophobicContact CB-CB 4.43Å; D831-Q834 HydrophobicContact CB-CG 4.22Å; D831-Q834 VanDerWaalsContact N-OE1 3.1Å; D831-Q834 WeakPolarHBondContact O-CA 3.47Å; D831-Q834 WeakPolarHBondContact O-CB 3.46Å; D831-Q834 PolarHBondContact O-N 3.25Å; Q834-G836 VanDerWaalsContact C-N 3.31Å; Q834-G836 PolarHBondContact O-N 2.92Å; Q834-I837 PolarHBondContact O-N 3.42Å; Q834-L838 WeakPolarHBondContact O-CB 3.28Å; Q834-L838 PolarHBondContact O-N 3.01Å; Q834-A869 HydrophobicContact CB-CB 4.19Å; Q834-A869 HydrophobicContact CG-CB 4.39Å
835	Q	90.5	Very high	86.4	Confident	13 Å²	13	35.9 Å²	35.9	6%	0.061	21%	0.214	C	C	.	.	H	α-helix	trans	-61.5	-41.4	173.5	-64.8	-175.2	19.9	0	0	111.4	L761 K765 Y820 F821 L830 D831 V833 L838 L839	L761-Q835 HydrophobicContact CD2-CB 3.93Å; K765-Q835 VanDerWaalsContact NZ-CD 3.32Å; K765-Q835 VanDerWaalsContact NZ-NE2 3.16Å; Y820-Q835 HydrophobicContact CE1-CG 3.9Å; Y820-Q835 PolarHBondContact OH-NE2 3.44Å; Y820-Q835 VanDerWaalsContact OH-NE2 3.11Å; F821-Q835 HydrophobicContact CZ-CB 4.47Å; F821-Q835 WeakPolarHBondContact CZ-O 3.45Å; L830-Q835 HydrophobicContact CB-CG 3.61Å; L830-Q835 PolarHBondContact O-NE2 3.13Å; D831-Q835 WeakPolarHBondContact O-CG 3.38Å; D831-Q835 PolarHBondContact O-N 3Å; V833-Q835 VanDerWaalsContact C-N 3.35Å; V833-Q835 PolarHBondContact O-N 3.43Å; Q835-L838 PolarHBondContact O-N 3.39Å; Q835-L839 WeakPolarHBondContact O-CB 3.37Å; Q835-L839 PolarHBondContact O-N 2.92Å
836	G	90.3	Very high	86.9	Confident	4 Å²	4	36.6 Å²	36.6	4%	0.041	22%	0.217	C	C	.	.	H	α-helix	trans	-61.7	-45.3	176.6	0	0	0	0	0	112	T757 L761 L832 V833 Q834 L839 A840	T757-G836 WeakPolarHBondContact CG2-O 3.32Å; L761-G836 VanDerWaalsContact CD1-CA 3.48Å; L832-G836 PolarHBondContact O-N 3.14Å; V833-G836 PolarHBondContact O-N 3.08Å; V833-G836 VanDerWaalsContact O-N 3.13Å; Q834-G836 VanDerWaalsContact C-N 3.31Å; Q834-G836 PolarHBondContact O-N 2.92Å; G836-L839 PolarHBondContact O-N 3.21Å; G836-A840 VanDerWaalsContact O-CB 3.29Å; G836-A840 WeakPolarHBondContact O-CB 3.45Å; G836-A840 PolarHBondContact O-N 3.33Å
837	I	91.9	Very high	88.1	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-63.4	-45.8	177.8	-62.6	164.5	0	0	0	110.8	V833 Q834 L839 A840 L841 L851 L855 L862 K865 F866	V833-I837 HydrophobicContact CG1-CD1 3.93Å; V833-I837 HydrophobicContact CG1-CG1 4.46Å; V833-I837 VanDerWaalsContact O-CG1 3.28Å; V833-I837 WeakPolarHBondContact O-CG1 3.49Å; V833-I837 PolarHBondContact O-N 3.39Å; Q834-I837 PolarHBondContact O-N 3.42Å; I837-L839 VanDerWaalsContact C-N 3.32Å; I837-L839 PolarHBondContact O-N 3.31Å; I837-A840 PolarHBondContact O-N 3.46Å; I837-L841 HydrophobicContact CG2-CD1 3.61Å; I837-L841 HydrophobicContact CG2-CG 4.19Å; I837-L841 WeakPolarHBondContact O-CB 3.44Å; I837-L841 WeakPolarHBondContact O-CG 3.17Å; I837-L841 PolarHBondContact O-N 3.08Å; I837-L851 HydrophobicContact CB-CD2 4.4Å; I837-L851 HydrophobicContact CG1-CD2 4.17Å; I837-L851 HydrophobicContact CG2-CD2 4.19Å; I837-L855 HydrophobicContact CG1-CD1 4.39Å; I837-L862 HydrophobicContact CD1-CD2 3.81Å; I837-L862 HydrophobicContact CG1-CD2 3.87Å; I837-K865 HydrophobicContact CD1-CB 3.66Å; I837-F866 HydrophobicContact CG2-CB 3.96Å; I837-F866 HydrophobicContact CG2-CD2 4Å; I837-F866 HydrophobicContact CG2-CG 4.43Å
838	L	92	Very high	89.1	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-60.1	-42	177	-177.2	59.4	0	0	0	111.9	A817 Y820 F821 L830 Q834 Q835 G842 M870	A817-L838 HydrophobicContact CB-CD1 3.92Å; A817-L838 HydrophobicContact CB-CG 3.87Å; Y820-L838 HydrophobicContact CD1-CD2 3.87Å; Y820-L838 HydrophobicContact CG-CD2 4.07Å; F821-L838 HydrophobicContact CE2-CG 4.39Å; L830-L838 HydrophobicContact CD1-CD2 3.83Å; Q834-L838 WeakPolarHBondContact O-CB 3.28Å; Q834-L838 PolarHBondContact O-N 3.01Å; Q835-L838 PolarHBondContact O-N 3.39Å; L838-G842 WeakPolarHBondContact O-CA 3.3Å; L838-G842 PolarHBondContact O-N 3.15Å; L838-M870 HydrophobicContact CD1-CE 3.6Å
839	L	91.9	Very high	89.5	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.211	C	C	.	.	I	π-helix	trans	-66.2	-45.4	176.9	-171.6	70.8	0	0	0	112	L745 C760 L761 L764 F821 Q835 G836 I837 V843 Q844	L745-L839 HydrophobicContact CD2-CD1 4.31Å; C760-L839 HydrophobicContact CB-CD2 3.52Å; L761-L839 HydrophobicContact CD2-CB 4.37Å; L761-L839 HydrophobicContact CD2-CD2 3.88Å; L761-L839 HydrophobicContact CG-CD2 3.89Å; L764-L839 HydrophobicContact CD1-CD1 3.77Å; L764-L839 HydrophobicContact CD1-CD2 4.27Å; F821-L839 HydrophobicContact CD2-CD1 3.8Å; F821-L839 HydrophobicContact CE1-CD1 4.46Å; F821-L839 HydrophobicContact CE2-CB 3.72Å; F821-L839 HydrophobicContact CE2-CD1 3.53Å; F821-L839 HydrophobicContact CE2-CG 4.23Å; F821-L839 HydrophobicContact CG-CD1 4.41Å; F821-L839 HydrophobicContact CZ-CB 3.69Å; F821-L839 HydrophobicContact CZ-CD1 3.9Å; F821-L839 HydrophobicContact CZ-CG 4.3Å; Q835-L839 WeakPolarHBondContact O-CB 3.37Å; Q835-L839 PolarHBondContact O-N 2.92Å; G836-L839 PolarHBondContact O-N 3.21Å; I837-L839 VanDerWaalsContact C-N 3.32Å; I837-L839 PolarHBondContact O-N 3.31Å; L839-V843 HydrophobicContact CD1-CB 4.02Å; L839-V843 HydrophobicContact CD1-CG1 4.4Å; L839-V843 HydrophobicContact CD1-CG2 4.14Å; L839-V843 WeakPolarHBondContact O-CA 3.38Å; L839-V843 WeakPolarHBondContact O-CB 3.48Å; L839-V843 PolarHBondContact O-N 2.97Å; L839-Q844 PolarHBondContact O-N 3.3Å
840	A	91.6	Very high	89.8	Confident	0 Å²	0	32 Å²	32	0%	0	19%	0.191	C	C	.	.	I	π-helix	trans	-67.5	-47	-176.4	0	0	0	0	0	112.4	T757 G836 I837 G845 K846 L851	T757-A840 HydrophobicContact CG2-CB 3.96Å; G836-A840 VanDerWaalsContact O-CB 3.29Å; G836-A840 WeakPolarHBondContact O-CB 3.45Å; G836-A840 PolarHBondContact O-N 3.33Å; I837-A840 PolarHBondContact O-N 3.46Å; A840-G845 PolarHBondContact O-N 3.48Å; A840-G845 VanDerWaalsContact O-N 3.08Å; A840-K846 HydrophobicContact CB-CD 4.35Å; A840-K846 PolarHBondContact O-N 2.88Å; A840-L851 HydrophobicContact CB-CD1 3.62Å; A840-L851 HydrophobicContact CB-CD2 3.89Å; A840-L851 HydrophobicContact CB-CG 4.32Å
841	L	90.8	Very high	89.9	Confident	22 Å²	22	31.5 Å²	31.5	12%	0.115	19%	0.189	C	C	.	.	I	π-helix	trans	-77.5	-46	-178.7	-63.8	178.9	0	0	0	111.6	F806 L813 I837 K846 V848 L851 F866	F806-L841 HydrophobicContact CE2-CD1 4.27Å; F806-L841 HydrophobicContact CZ-CD1 4.21Å; L813-L841 HydrophobicContact CD1-CB 4.47Å; I837-L841 HydrophobicContact CG2-CD1 3.61Å; I837-L841 HydrophobicContact CG2-CG 4.19Å; I837-L841 WeakPolarHBondContact O-CB 3.44Å; I837-L841 WeakPolarHBondContact O-CG 3.17Å; I837-L841 PolarHBondContact O-N 3.08Å; L841-K846 WeakPolarHBondContact CD2-O 3.39Å; L841-V848 HydrophobicContact CD2-CG2 4.1Å; L841-L851 HydrophobicContact CD2-CD2 4.42Å; L841-L851 HydrophobicContact CG-CD2 4.32Å; L841-F866 HydrophobicContact CD1-CD2 3.8Å; L841-F866 HydrophobicContact CD1-CE2 4.14Å; L841-F866 HydrophobicContact CD1-CG 4.32Å
842	G	89	Confident	89.9	Confident	4 Å²	4	28 Å²	28	4%	0.041	17%	0.173	C	C	.	.	I	π-helix	trans	-80.8	-42.9	-174.1	0	0	0	0	0	114.3	T814 L838	T814-G842 WeakPolarHBondContact CA-O 3.34Å; T814-G842 PolarHBondContact OG1-O 3.37Å; L838-G842 WeakPolarHBondContact O-CA 3.3Å; L838-G842 PolarHBondContact O-N 3.15Å
843	V	89.8	Confident	89.9	Confident	15 Å²	15	29.5 Å²	29.5	9%	0.091	18%	0.18	C	C	.	.	I	π-helix	trans	-104.1	-45	-172.2	-177.1	0	0	0	0	112.5	L745 M748 G749 A817 F821 L839	L745-V843 VanDerWaalsContact O-CG1 3.23Å; L745-V843 WeakPolarHBondContact O-CG1 3.24Å; M748-V843 HydrophobicContact CB-CG1 3.61Å; M748-V843 HydrophobicContact CG-CG1 4.41Å; G749-V843 WeakPolarHBondContact CA-O 3.34Å; G749-V843 PolarHBondContact N-O 2.82Å; A817-V843 HydrophobicContact CB-CG2 3.54Å; F821-V843 HydrophobicContact CD2-CG2 4.48Å; L839-V843 HydrophobicContact CD1-CB 4.02Å; L839-V843 HydrophobicContact CD1-CG1 4.4Å; L839-V843 HydrophobicContact CD1-CG2 4.14Å; L839-V843 WeakPolarHBondContact O-CA 3.38Å; L839-V843 WeakPolarHBondContact O-CB 3.48Å; L839-V843 PolarHBondContact O-N 2.97Å
844	Q	91.4	Very high	89.8	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.005	18%	0.176	C	C	.	.	S	Bend	trans	-77.8	-21.1	179.6	-60.8	-172.9	-76.3	0	0	112.7	M748 R753 F755 T757 C760 L839 K846	M748-Q844 HydrophobicContact CB-CG 4.47Å; R753-Q844 WeakPolarHBondContact CG-O 3.4Å; F755-Q844 PolarHBondContact O-NE2 3.39Å; T757-Q844 PolarHBondContact OG1-OE1 3.46Å; C760-Q844 PolarHBondContact SG-NE2 2.93Å; L839-Q844 PolarHBondContact O-N 3.3Å; Q844-K846 VanDerWaalsContact C-N 3.33Å; Q844-K846 HydrophobicContact CB-CD 4.43Å; Q844-K846 HydrophobicContact CB-CG 4.05Å; Q844-K846 PolarHBondContact O-N 3.01Å
845	G	88.8	Confident	89.6	Confident	37 Å²	37	30.6 Å²	30.6	38%	0.381	18%	0.183	S	C	.	.			trans	63.5	37.7	-176.3	0	0	0	0	0	112.9	R753 A840	R753-G845 PolarHBondContact NE-O 3.35Å; R753-G845 PolarHBondContact NH2-O 3.16Å; A840-G845 PolarHBondContact O-N 3.48Å; A840-G845 VanDerWaalsContact O-N 3.08Å
846	K	90.4	Very high	89.4	Confident	27 Å²	27	37.1 Å²	37.1	12%	0.117	22%	0.218	C	C	.	.			trans	-79.7	150.8	173.9	-70.2	-178.1	177.4	176.6	0	110.6	R753 F755 T757 A840 L841 Q844 E854	R753-K846 WeakPolarHBondContact O-CE 3.49Å; F755-K846 WeakPolarHBondContact O-CE 3.05Å; F755-K846 PolarHBondContact O-NZ 3.31Å; T757-K846 PolarHBondContact OG1-NZ 2.92Å; T757-K846 VanDerWaalsContact OG1-NZ 3.09Å; A840-K846 HydrophobicContact CB-CD 4.35Å; A840-K846 PolarHBondContact O-N 2.88Å; L841-K846 WeakPolarHBondContact CD2-O 3.39Å; Q844-K846 VanDerWaalsContact C-N 3.33Å; Q844-K846 HydrophobicContact CB-CD 4.43Å; Q844-K846 HydrophobicContact CB-CG 4.05Å; Q844-K846 PolarHBondContact O-N 3.01Å; K846-E854 IonicContact NZ-OE1 2.77Å; K846-E854 IonicContact NZ-OE2 2.96Å; K846-E854 PolarHBondContact NZ-OE2 3.19Å
847	T	90.4	Very high	89.3	Confident	79 Å²	79	39.1 Å²	39.1	49%	0.485	23%	0.227	S	C	.	.			trans	-77.6	158	171.9	60.3	0	0	0	0	110.7	D849 A850 L851	T847-D849 VanDerWaalsContact C-N 3.26Å; T847-D849 PolarHBondContact O-N 3.2Å; T847-A850 PolarHBondContact O-N 2.9Å; T847-A850 WeakPolarHBondContact OG1-CB 3.29Å; T847-A850 PolarHBondContact OG1-N 3.06Å; T847-L851 PolarHBondContact O-N 2.93Å
848	V	89.4	Confident	89.3	Confident	30 Å²	30	42.4 Å²	42.4	18%	0.182	25%	0.249	C	C	.	.	H	α-helix	trans	-60.5	-38.6	177.8	-178.9	0	0	0	0	110.9	F806 L841 L851 G852 L862 L863	F806-V848 HydrophobicContact CE1-CG2 4.46Å; L841-V848 HydrophobicContact CD2-CG2 4.1Å; V848-L851 PolarHBondContact O-N 3.38Å; V848-G852 PolarHBondContact O-N 3.46Å; V848-L862 HydrophobicContact CG1-CB 4.47Å; V848-L862 HydrophobicContact CG1-CD1 4.23Å; V848-L863 HydrophobicContact CG2-CD2 4.33Å
849	D	89.3	Confident	89.1	Confident	125 Å²	125	43.6 Å²	43.6	67%	0.668	26%	0.261	S	S	*	.	H	α-helix	trans	-65.9	-44.5	179.3	-55.4	-38.4	0	0	0	112.1	T847 L851 G852 L853	T847-D849 VanDerWaalsContact C-N 3.26Å; T847-D849 PolarHBondContact O-N 3.2Å; D849-L851 VanDerWaalsContact C-N 3.31Å; D849-L851 PolarHBondContact O-N 3.34Å; D849-G852 PolarHBondContact O-N 3.26Å; D849-L853 WeakPolarHBondContact O-CG 3.38Å; D849-L853 PolarHBondContact O-N 3.43Å
850	A	87	Confident	89	Confident	44 Å²	44	50.3 Å²	50.3	36%	0.364	30%	0.297	S	S	.	.	H	α-helix	trans	-62.6	-40.8	176.9	0	0	0	0	0	111.3	T847 G852 L853 E854	T847-A850 PolarHBondContact O-N 2.9Å; T847-A850 WeakPolarHBondContact OG1-CB 3.29Å; T847-A850 PolarHBondContact OG1-N 3.06Å; A850-G852 VanDerWaalsContact C-N 3.34Å; A850-L853 PolarHBondContact O-N 3.02Å; A850-E854 PolarHBondContact O-N 3.49Å; A850-E854 VanDerWaalsContact O-N 3.1Å
851	L	88.5	Confident	88.9	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-67.6	-35.3	175.3	-174.2	61.8	0	0	0	112.2	I837 A840 L841 T847 V848 D849 E854 L855 L862	I837-L851 HydrophobicContact CB-CD2 4.4Å; I837-L851 HydrophobicContact CG1-CD2 4.17Å; I837-L851 HydrophobicContact CG2-CD2 4.19Å; A840-L851 HydrophobicContact CB-CD1 3.62Å; A840-L851 HydrophobicContact CB-CD2 3.89Å; A840-L851 HydrophobicContact CB-CG 4.32Å; L841-L851 HydrophobicContact CD2-CD2 4.42Å; L841-L851 HydrophobicContact CG-CD2 4.32Å; T847-L851 PolarHBondContact O-N 2.93Å; V848-L851 PolarHBondContact O-N 3.38Å; D849-L851 VanDerWaalsContact C-N 3.31Å; D849-L851 PolarHBondContact O-N 3.34Å; L851-E854 PolarHBondContact O-N 3.37Å; L851-L855 HydrophobicContact CD1-CD1 3.62Å; L851-L855 HydrophobicContact CD1-CG 3.92Å; L851-L855 HydrophobicContact CD2-CD1 4.43Å; L851-L855 HydrophobicContact CG-CD1 3.87Å; L851-L855 HydrophobicContact CG-CG 4.39Å; L851-L855 WeakPolarHBondContact O-CB 3.4Å; L851-L855 PolarHBondContact O-N 3.07Å; L851-L862 HydrophobicContact CB-CD1 4.35Å; L851-L862 HydrophobicContact CD2-CD1 4.45Å; L851-L862 HydrophobicContact CD2-CD2 4.19Å; L851-L862 HydrophobicContact CG-CD1 4.23Å; L851-L862 HydrophobicContact CG-CD2 4.29Å
852	G	88.6	Confident	88.9	Confident	11 Å²	11	54.8 Å²	54.8	11%	0.113	32%	0.317	C	S	.	.	H	α-helix	trans	-61.9	-44.3	175.4	0	0	0	0	0	112.6	V848 D849 A850 N856 M857	V848-G852 PolarHBondContact O-N 3.46Å; D849-G852 PolarHBondContact O-N 3.26Å; A850-G852 VanDerWaalsContact C-N 3.34Å; G852-N856 VanDerWaalsContact O-CA 3.31Å; G852-N856 WeakPolarHBondContact O-CA 3.49Å; G852-N856 PolarHBondContact O-N 3.11Å; G852-M857 CarbonylContact C-O 3.53Å; G852-M857 WeakPolarHBondContact CA-O 3.42Å; G852-M857 PolarHBondContact O-N 3.12Å
853	L	86.9	Confident	88.9	Confident	142 Å²	142	57.4 Å²	57.4	74%	0.743	33%	0.33	S	S	*	.	H	α-helix	trans	-64.4	-38.7	173.4	-67.5	173.4	0	0	0	112.2	D849 A850 N856	D849-L853 WeakPolarHBondContact O-CG 3.38Å; D849-L853 PolarHBondContact O-N 3.43Å; A850-L853 PolarHBondContact O-N 3.02Å; L853-N856 PolarHBondContact O-OD1 3.28Å
854	E	86.5	Confident	88.9	Confident	50 Å²	50	59.2 Å²	59.2	23%	0.234	35%	0.347	C	S	.	.	H	α-helix	trans	-73.3	-40.7	-177.9	-167.7	-173.1	147.9	0	0	113.1	E756 T757 K846 A850 L851 N856	E756-E854 VanDerWaalsContact C-OE1 3.32Å; E756-E854 WeakPolarHBondContact CA-OE1 3.49Å; T757-E854 PolarHBondContact N-OE1 2.66Å; K846-E854 IonicContact NZ-OE1 2.77Å; K846-E854 IonicContact NZ-OE2 2.96Å; K846-E854 PolarHBondContact NZ-OE2 3.19Å; A850-E854 PolarHBondContact O-N 3.49Å; A850-E854 VanDerWaalsContact O-N 3.1Å; L851-E854 PolarHBondContact O-N 3.37Å; E854-N856 VanDerWaalsContact C-N 3.34Å
855	L	85.9	Confident	88.9	Confident	34 Å²	34	63.6 Å²	63.6	18%	0.178	37%	0.366	C	S	.	.	H	α-helix	trans	-87.9	-4	179.8	-66	179	0	0	0	113	I837 L851 M857 L862	I837-L855 HydrophobicContact CG1-CD1 4.39Å; L851-L855 HydrophobicContact CD1-CD1 3.62Å; L851-L855 HydrophobicContact CD1-CG 3.92Å; L851-L855 HydrophobicContact CD2-CD1 4.43Å; L851-L855 HydrophobicContact CG-CD1 3.87Å; L851-L855 HydrophobicContact CG-CG 4.39Å; L851-L855 WeakPolarHBondContact O-CB 3.4Å; L851-L855 PolarHBondContact O-N 3.07Å; L855-M857 VanDerWaalsContact C-N 3.25Å; L855-M857 HydrophobicContact CB-CE 3.65Å; L855-M857 HydrophobicContact CB-CG 4.4Å; L855-M857 HydrophobicContact CD1-CE 3.6Å; L855-M857 HydrophobicContact CG-CE 4.2Å; L855-M857 PolarHBondContact O-N 3.33Å; L855-L862 HydrophobicContact CD1-CD2 3.9Å
856	N	87.3	Confident	89	Confident	150 Å²	150	61.9 Å²	61.9	80%	0.802	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	44.9	-171	-68.4	-32.8	0	0	0	111.9	G852 L853 E854	G852-N856 VanDerWaalsContact O-CA 3.31Å; G852-N856 WeakPolarHBondContact O-CA 3.49Å; G852-N856 PolarHBondContact O-N 3.11Å; L853-N856 PolarHBondContact O-OD1 3.28Å; E854-N856 VanDerWaalsContact C-N 3.34Å
857	M	88.4	Confident	89	Confident	47 Å²	47	62.1 Å²	62.1	23%	0.232	35%	0.349	C	S	.	.			trans	-127.6	141.3	179.3	-71.4	-166.5	-72.5	0	0	110.9	V833 G852 L855 L862	V833-M857 HydrophobicContact CG1-CE 3.67Å; G852-M857 CarbonylContact C-O 3.53Å; G852-M857 WeakPolarHBondContact CA-O 3.42Å; G852-M857 PolarHBondContact O-N 3.12Å; L855-M857 VanDerWaalsContact C-N 3.25Å; L855-M857 HydrophobicContact CB-CE 3.65Å; L855-M857 HydrophobicContact CB-CG 4.4Å; L855-M857 HydrophobicContact CD1-CE 3.6Å; L855-M857 HydrophobicContact CG-CE 4.2Å; L855-M857 PolarHBondContact O-N 3.33Å; M857-L862 HydrophobicContact CB-CD2 4.42Å; M857-L862 HydrophobicContact CB-CG 4.27Å; M857-L862 HydrophobicContact CE-CD2 3.54Å
858	P	91.1	Very high	89.1	Confident	71 Å²	71	61.5 Å²	61.5	46%	0.461	34%	0.342	S	S	.	.			trans	-68.6	146.3	176.3	29.9	-34.2	0	0	0	111	N860 Q861 L862	P858-N860 PolarHBondContact O-N 3.2Å; P858-N860 VanDerWaalsContact O-N 3.13Å; P858-Q861 HydrophobicContact CG-CB 4.11Å; P858-Q861 VanDerWaalsContact CG-CD 3.43Å; P858-Q861 HydrophobicContact CG-CG 3.75Å; P858-Q861 PolarHBondContact O-N 3.35Å; P858-L862 PolarHBondContact O-N 3.09Å
859	G	88.1	Confident	89.1	Confident	26 Å²	26	60.1 Å²	60.1	27%	0.268	34%	0.335	S	S	.	.	H	α-helix	trans	-54.1	-35.9	-175.4	0	0	0	0	0	114.6	Q861 L862 L863	G859-Q861 PolarHBondContact O-N 3.2Å; G859-L862 WeakPolarHBondContact O-CB 3.39Å; G859-L862 PolarHBondContact O-N 3.32Å; G859-L863 WeakPolarHBondContact O-CG 3.5Å; G859-L863 PolarHBondContact O-N 3.44Å
860	N	89.6	Confident	89.2	Confident	140 Å²	140	54.2 Å²	54.2	75%	0.749	30%	0.303	S	S	*	.	H	α-helix	trans	-63.8	-39.1	179.2	-64.8	-9.7	0	0	0	112.6	P858 L863 A864	P858-N860 PolarHBondContact O-N 3.2Å; P858-N860 VanDerWaalsContact O-N 3.13Å; N860-L863 PolarHBondContact O-N 3.01Å; N860-A864 PolarHBondContact O-N 3.37Å; N860-A864 VanDerWaalsContact O-N 3.1Å
861	Q	90.3	Very high	89.4	Confident	113 Å²	113	56.7 Å²	56.7	53%	0.528	31%	0.306	S	S	.	.	H	α-helix	trans	-71	-35.8	177.7	-69.8	177.8	8.7	0	0	111.4	P858 G859 A864 K865	P858-Q861 HydrophobicContact CG-CB 4.11Å; P858-Q861 VanDerWaalsContact CG-CD 3.43Å; P858-Q861 HydrophobicContact CG-CG 3.75Å; P858-Q861 PolarHBondContact O-N 3.35Å; G859-Q861 PolarHBondContact O-N 3.2Å; Q861-A864 PolarHBondContact O-N 3.03Å; Q861-K865 WeakPolarHBondContact O-CG 3.43Å; Q861-K865 PolarHBondContact O-N 3.42Å
862	L	89.8	Confident	89.5	Confident	3 Å²	3	61.8 Å²	61.8	2%	0.016	33%	0.325	C	S	.	.	H	α-helix	trans	-60.7	-46.7	174.1	-74.9	171.7	0	0	0	111.5	I837 V848 L851 L855 M857 P858 G859 A864 K865 F866	I837-L862 HydrophobicContact CD1-CD2 3.81Å; I837-L862 HydrophobicContact CG1-CD2 3.87Å; V848-L862 HydrophobicContact CG1-CB 4.47Å; V848-L862 HydrophobicContact CG1-CD1 4.23Å; L851-L862 HydrophobicContact CB-CD1 4.35Å; L851-L862 HydrophobicContact CD2-CD1 4.45Å; L851-L862 HydrophobicContact CD2-CD2 4.19Å; L851-L862 HydrophobicContact CG-CD1 4.23Å; L851-L862 HydrophobicContact CG-CD2 4.29Å; L855-L862 HydrophobicContact CD1-CD2 3.9Å; M857-L862 HydrophobicContact CB-CD2 4.42Å; M857-L862 HydrophobicContact CB-CG 4.27Å; M857-L862 HydrophobicContact CE-CD2 3.54Å; P858-L862 PolarHBondContact O-N 3.09Å; G859-L862 WeakPolarHBondContact O-CB 3.39Å; G859-L862 PolarHBondContact O-N 3.32Å; L862-A864 VanDerWaalsContact C-N 3.34Å; L862-A864 PolarHBondContact O-N 2.91Å; L862-K865 PolarHBondContact O-N 3.02Å; L862-F866 VanDerWaalsContact O-CB 3.31Å; L862-F866 WeakPolarHBondContact O-CB 3.28Å; L862-F866 PolarHBondContact O-N 3.27Å
863	L	89.8	Confident	89.5	Confident	59 Å²	59	61.2 Å²	61.2	31%	0.309	32%	0.319	S	S	.	.	H	α-helix	trans	-64.8	-37.2	178.4	-69.6	175.7	0	0	0	112.3	F806 V848 G859 N860 F866 F867	F806-L863 HydrophobicContact CD1-CD2 4.39Å; F806-L863 HydrophobicContact CD2-CD2 4.35Å; F806-L863 HydrophobicContact CG-CD2 4.19Å; V848-L863 HydrophobicContact CG2-CD2 4.33Å; G859-L863 WeakPolarHBondContact O-CG 3.5Å; G859-L863 PolarHBondContact O-N 3.44Å; N860-L863 PolarHBondContact O-N 3.01Å; L863-F866 PolarHBondContact O-N 3.47Å; L863-F867 WeakPolarHBondContact O-CB 3.48Å; L863-F867 PolarHBondContact O-N 2.87Å
864	A	90.1	Very high	89.6	Confident	53 Å²	53	55 Å²	55	44%	0.438	29%	0.286	S	S	.	.	H	α-helix	trans	-62.5	-46.6	174.3	0	0	0	0	0	112	N860 Q861 L862 F866 F867 D868	N860-A864 PolarHBondContact O-N 3.37Å; N860-A864 VanDerWaalsContact O-N 3.1Å; Q861-A864 PolarHBondContact O-N 3.03Å; L862-A864 VanDerWaalsContact C-N 3.34Å; L862-A864 PolarHBondContact O-N 2.91Å; A864-F866 VanDerWaalsContact C-N 3.31Å; A864-F866 PolarHBondContact O-N 2.77Å; A864-F867 WeakPolarHBondContact O-CB 3.48Å; A864-F867 PolarHBondContact O-N 2.81Å; A864-D868 PolarHBondContact O-N 3.41Å; A864-D868 VanDerWaalsContact O-N 3.14Å
865	K	90.5	Very high	89.8	Confident	93 Å²	93	57.8 Å²	57.8	40%	0.404	30%	0.3	S	S	.	.	H	α-helix	trans	-66	-34.7	177	-70.4	-64.6	-176.3	-174.5	0	112.9	I837 Q861 L862 A869	I837-K865 HydrophobicContact CD1-CB 3.66Å; Q861-K865 WeakPolarHBondContact O-CG 3.43Å; Q861-K865 PolarHBondContact O-N 3.42Å; L862-K865 PolarHBondContact O-N 3.02Å; K865-A869 PolarHBondContact O-N 3.32Å
866	F	91.1	Very high	89.8	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.009	30%	0.299	C	S	.	.	H	α-helix	trans	-65.5	-43.8	173.7	173.5	-94.8	0	0	0	111.9	Y799 F806 I809 L813 I837 L841 L862 L863 A864 D868 A869 M870	Y799-F866 HydrophobicContact CE1-CD1 4.37Å; Y799-F866 AromaticContact CE1-CE1 3.93Å; Y799-F866 HydrophobicContact CE1-CE1 3.93Å; Y799-F866 AromaticContact CZ-CE1 3.91Å; Y799-F866 WeakPolarHBondContact OH-CD1 3.37Å; Y799-F866 WeakPolarHBondContact OH-CE1 3.39Å; F806-F866 AromaticContact CD2-CD1 3.89Å; F806-F866 HydrophobicContact CD2-CD1 3.89Å; F806-F866 AromaticContact CD2-CE1 3.37Å; F806-F866 HydrophobicContact CD2-CE1 3.37Å; F806-F866 AromaticContact CD2-CZ 3.88Å; F806-F866 HydrophobicContact CD2-CZ 3.88Å; F806-F866 HydrophobicContact CE2-CD1 4.06Å; F806-F866 AromaticContact CE2-CE1 3.52Å; F806-F866 HydrophobicContact CE2-CE1 3.52Å; F806-F866 HydrophobicContact CE2-CE2 4.17Å; F806-F866 AromaticContact CE2-CZ 3.56Å; F806-F866 HydrophobicContact CE2-CZ 3.56Å; I809-F866 HydrophobicContact CD1-CE1 3.74Å; I809-F866 HydrophobicContact CD1-CZ 3.92Å; L813-F866 HydrophobicContact CD1-CE2 3.89Å; L813-F866 HydrophobicContact CD1-CZ 3.72Å; L813-F866 HydrophobicContact CD2-CE2 3.81Å; L813-F866 HydrophobicContact CD2-CZ 3.48Å; L813-F866 VanDerWaalsContact CD2-CZ 3.48Å; L813-F866 HydrophobicContact CG-CZ 4.24Å; I837-F866 HydrophobicContact CG2-CB 3.96Å; I837-F866 HydrophobicContact CG2-CD2 4Å; I837-F866 HydrophobicContact CG2-CG 4.43Å; L841-F866 HydrophobicContact CD1-CD2 3.8Å; L841-F866 HydrophobicContact CD1-CE2 4.14Å; L841-F866 HydrophobicContact CD1-CG 4.32Å; L862-F866 VanDerWaalsContact O-CB 3.31Å; L862-F866 WeakPolarHBondContact O-CB 3.28Å; L862-F866 PolarHBondContact O-N 3.27Å; L863-F866 PolarHBondContact O-N 3.47Å; A864-F866 VanDerWaalsContact C-N 3.31Å; A864-F866 PolarHBondContact O-N 2.77Å; F866-D868 VanDerWaalsContact C-N 3.34Å; F866-D868 PolarHBondContact O-N 2.86Å; F866-A869 WeakPolarHBondContact O-CB 3.46Å; F866-A869 PolarHBondContact O-N 2.96Å; F866-A869 VanDerWaalsContact O-N 3.11Å; F866-M870 HydrophobicContact CD1-CG 4.18Å; F866-M870 HydrophobicContact CD2-CG 4.49Å; F866-M870 HydrophobicContact CE1-CG 3.56Å; F866-M870 HydrophobicContact CE2-CE 4Å; F866-M870 HydrophobicContact CE2-CG 3.96Å; F866-M870 HydrophobicContact CE2-SD 4.17Å; F866-M870 HydrophobicContact CZ-CE 4.33Å; F866-M870 HydrophobicContact CZ-CG 3.46Å; F866-M870 VanDerWaalsContact CZ-CG 3.46Å; F866-M870 HydrophobicContact CZ-SD 3.88Å; F866-M870 PolarHBondContact O-N 2.7Å
867	F	91.4	Very high	89.9	Confident	31 Å²	31	50.3 Å²	50.3	14%	0.136	26%	0.261	C	S	.	.	H	α-helix	trans	-57.2	-46.8	175.7	171.7	-94.1	0	0	0	111.7	Y799 A800 Q802 L863 A864 A869 M870 K871	Y799-F867 HydrophobicContact CD1-CD2 4.48Å; Y799-F867 AromaticContact CE1-CD2 3.94Å; Y799-F867 HydrophobicContact CE1-CD2 3.94Å; Y799-F867 VanDerWaalsContact O-CE2 3.28Å; Y799-F867 WeakPolarHBondContact O-CE2 3.35Å; A800-F867 WeakPolarHBondContact O-CZ 3.4Å; Q802-F867 HydrophobicContact CG-CD2 4.36Å; Q802-F867 HydrophobicContact CG-CE1 4.28Å; Q802-F867 HydrophobicContact CG-CE2 3.38Å; Q802-F867 HydrophobicContact CG-CZ 3.35Å; L863-F867 WeakPolarHBondContact O-CB 3.48Å; L863-F867 PolarHBondContact O-N 2.87Å; A864-F867 WeakPolarHBondContact O-CB 3.48Å; A864-F867 PolarHBondContact O-N 2.81Å; F867-A869 VanDerWaalsContact C-N 3.26Å; F867-A869 PolarHBondContact O-N 3.32Å; F867-M870 PolarHBondContact O-N 2.79Å; F867-K871 HydrophobicContact CE1-CD 4.48Å; F867-K871 WeakPolarHBondContact O-CB 3.42Å; F867-K871 PolarHBondContact O-N 2.79Å
868	D	90.6	Very high	89.9	Confident	66 Å²	66	51.9 Å²	51.9	35%	0.353	27%	0.265	S	S	.	.	H	α-helix	trans	-58.6	-38.7	176	-71.5	-24.3	0	0	0	112.3	A864 F866 R872	A864-D868 PolarHBondContact O-N 3.41Å; A864-D868 VanDerWaalsContact O-N 3.14Å; F866-D868 VanDerWaalsContact C-N 3.34Å; F866-D868 PolarHBondContact O-N 2.86Å; D868-R872 WeakPolarHBondContact O-CG 3.42Å; D868-R872 PolarHBondContact O-N 3.47Å
869	A	90.3	Very high	89.7	Confident	2 Å²	2	50.8 Å²	50.8	2%	0.017	26%	0.259	C	S	.	.	H	α-helix	trans	-67.1	-46.7	177.6	0	0	0	0	0	111.5	L830 Q834 K865 F866 F867 K871 R872 C873	L830-A869 HydrophobicContact CD2-CB 4.02Å; Q834-A869 HydrophobicContact CB-CB 4.19Å; Q834-A869 HydrophobicContact CG-CB 4.39Å; K865-A869 PolarHBondContact O-N 3.32Å; F866-A869 WeakPolarHBondContact O-CB 3.46Å; F866-A869 PolarHBondContact O-N 2.96Å; F866-A869 VanDerWaalsContact O-N 3.11Å; F867-A869 VanDerWaalsContact C-N 3.26Å; F867-A869 PolarHBondContact O-N 3.32Å; A869-K871 VanDerWaalsContact C-N 3.31Å; A869-K871 PolarHBondContact O-N 3.24Å; A869-R872 PolarHBondContact O-N 3.07Å; A869-C873 PolarHBondContact O-N 2.94Å; A869-C873 PolarHBondContact O-SG 3.28Å
870	M	91.3	Very high	89.6	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.6	-36.8	178.1	-69.2	-58	100.4	0	0	112.4	L796 Y799 I809 L813 I816 L838 F866 F867 R872 C873 N874	L796-M870 HydrophobicContact CD1-SD 4.37Å; Y799-M870 HydrophobicContact CD1-CB 4Å; Y799-M870 HydrophobicContact CD1-CG 4.37Å; Y799-M870 HydrophobicContact CE1-CB 3.85Å; Y799-M870 HydrophobicContact CE1-CG 3.97Å; I809-M870 HydrophobicContact CD1-CG 4.11Å; L813-M870 HydrophobicContact CD2-CE 4.27Å; L813-M870 HydrophobicContact CD2-SD 3.58Å; L813-M870 VanDerWaalsContact CD2-SD 3.58Å; I816-M870 HydrophobicContact CD1-SD 4.3Å; I816-M870 HydrophobicContact CG2-CE 4.39Å; L838-M870 HydrophobicContact CD1-CE 3.6Å; F866-M870 HydrophobicContact CD1-CG 4.18Å; F866-M870 HydrophobicContact CD2-CG 4.49Å; F866-M870 HydrophobicContact CE1-CG 3.56Å; F866-M870 HydrophobicContact CE2-CE 4Å; F866-M870 HydrophobicContact CE2-CG 3.96Å; F866-M870 HydrophobicContact CE2-SD 4.17Å; F866-M870 HydrophobicContact CZ-CE 4.33Å; F866-M870 HydrophobicContact CZ-CG 3.46Å; F866-M870 VanDerWaalsContact CZ-CG 3.46Å; F866-M870 HydrophobicContact CZ-SD 3.88Å; F866-M870 PolarHBondContact O-N 2.7Å; F867-M870 PolarHBondContact O-N 2.79Å; M870-R872 VanDerWaalsContact C-N 3.32Å; M870-R872 PolarHBondContact O-N 3.12Å; M870-C873 PolarHBondContact O-N 2.83Å; M870-N874 WeakPolarHBondContact O-CB 3.31Å; M870-N874 PolarHBondContact O-N 3.44Å
871	K	90.9	Very high	89.4	Confident	97 Å²	97	45.7 Å²	45.7	42%	0.422	23%	0.226	S	C	.	.	H	α-helix	trans	-59.1	-43.4	174.5	-175.7	177.4	178.4	179.3	0	111.7	F867 A869 N874 Q875	F867-K871 HydrophobicContact CE1-CD 4.48Å; F867-K871 WeakPolarHBondContact O-CB 3.42Å; F867-K871 PolarHBondContact O-N 2.79Å; A869-K871 VanDerWaalsContact C-N 3.31Å; A869-K871 PolarHBondContact O-N 3.24Å; K871-N874 PolarHBondContact O-N 2.8Å; K871-Q875 WeakPolarHBondContact O-CG 3.34Å; K871-Q875 PolarHBondContact O-N 3.07Å; K871-Q875 VanDerWaalsContact O-N 3.07Å
872	R	90.1	Very high	89.3	Confident	107 Å²	107	45.6 Å²	45.6	40%	0.404	23%	0.225	S	C	.	.	H	α-helix	trans	-68.4	-40.7	176.2	-66.4	178.2	-172.5	-172	2.8	112.3	L828 Q829 L830 D868 A869 M870 N874 Q875 C876	L828-R872 HydrophobicContact CD1-CB 3.58Å; Q829-R872 PolarHBondContact O-NH1 3.31Å; L830-R872 HydrophobicContact CD2-CB 4.43Å; D868-R872 WeakPolarHBondContact O-CG 3.42Å; D868-R872 PolarHBondContact O-N 3.47Å; A869-R872 PolarHBondContact O-N 3.07Å; M870-R872 VanDerWaalsContact C-N 3.32Å; M870-R872 PolarHBondContact O-N 3.12Å; R872-N874 VanDerWaalsContact C-N 3.3Å; R872-N874 PolarHBondContact O-N 3.31Å; R872-Q875 WeakPolarHBondContact O-CB 3.29Å; R872-Q875 PolarHBondContact O-N 2.91Å; R872-C876 PolarHBondContact O-N 3.41Å; R872-C876 VanDerWaalsContact O-N 3.08Å
873	C	88.8	Confident	89	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-58.1	-44.9	173.6	-64.6	0	0	0	0	111.3	I816 L828 A869 M870 Q875 C876 F877	I816-C873 HydrophobicContact CG2-CB 4.3Å; L828-C873 VanDerWaalsContact CD2-SG 3.6Å; A869-C873 PolarHBondContact O-N 2.94Å; A869-C873 PolarHBondContact O-SG 3.28Å; M870-C873 PolarHBondContact O-N 2.83Å; C873-Q875 PolarHBondContact O-N 3.13Å; C873-C876 WeakPolarHBondContact O-CB 3.38Å; C873-C876 PolarHBondContact O-N 2.9Å; C873-F877 WeakPolarHBondContact O-CG 3.39Å; C873-F877 PolarHBondContact O-N 2.87Å
874	N	90.4	Very high	88.7	Confident	10 Å²	10	53.2 Å²	53.2	5%	0.053	26%	0.259	C	S	.	.	H	α-helix	trans	-64	-38.2	178.3	-171.2	51.3	0	0	0	112.6	L796 A800 M870 K871 R872 C876 F877 R878	L796-N874 HydrophobicContact CD2-CB 4.2Å; L796-N874 HydrophobicContact CG-CB 4.24Å; A800-N874 HydrophobicContact CB-CB 4.21Å; M870-N874 WeakPolarHBondContact O-CB 3.31Å; M870-N874 PolarHBondContact O-N 3.44Å; K871-N874 PolarHBondContact O-N 2.8Å; R872-N874 VanDerWaalsContact C-N 3.3Å; R872-N874 PolarHBondContact O-N 3.31Å; N874-C876 VanDerWaalsContact C-N 3.33Å; N874-C876 PolarHBondContact O-N 3.3Å; N874-F877 PolarHBondContact O-N 3.03Å; N874-R878 WeakPolarHBondContact O-CG 3.43Å; N874-R878 PolarHBondContact O-N 2.83Å
875	Q	89.7	Confident	88.4	Confident	110 Å²	110	55.2 Å²	55.2	51%	0.514	26%	0.261	S	S	.	.	H	α-helix	trans	-60.9	-41.9	173.3	-74.5	171.7	-25.7	0	0	111.8	K871 R872 C873 R878 S879	K871-Q875 WeakPolarHBondContact O-CG 3.34Å; K871-Q875 PolarHBondContact O-N 3.07Å; K871-Q875 VanDerWaalsContact O-N 3.07Å; R872-Q875 WeakPolarHBondContact O-CB 3.29Å; R872-Q875 PolarHBondContact O-N 2.91Å; C873-Q875 PolarHBondContact O-N 3.13Å; Q875-R878 PolarHBondContact O-N 3.42Å; Q875-S879 PolarHBondContact O-N 3.44Å
876	C	87.2	Confident	87.9	Confident	24 Å²	24	57 Å²	57	16%	0.162	27%	0.271	C	S	.	.	H	α-helix	trans	-65.4	-44.6	177.3	-173	0	0	0	0	112.3	I825 R872 C873 N874 R878 S879 V880	I825-C876 HydrophobicContact CG2-CB 4.18Å; I825-C876 WeakPolarHBondContact CG2-SG 3.4Å; R872-C876 PolarHBondContact O-N 3.41Å; R872-C876 VanDerWaalsContact O-N 3.08Å; C873-C876 WeakPolarHBondContact O-CB 3.38Å; C873-C876 PolarHBondContact O-N 2.9Å; N874-C876 VanDerWaalsContact C-N 3.33Å; N874-C876 PolarHBondContact O-N 3.3Å; C876-R878 VanDerWaalsContact C-N 3.26Å; C876-R878 PolarHBondContact O-N 2.99Å; C876-S879 WeakPolarHBondContact O-CB 3.32Å; C876-S879 PolarHBondContact O-N 3.15Å; C876-V880 PolarHBondContact O-N 3.2Å; C876-V880 VanDerWaalsContact O-N 3.12Å
877	F	88.9	Confident	87.2	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.009	31%	0.305	C	S	.	.	H	α-helix	trans	-62.7	-35.1	176.8	-64.9	-20.8	0	0	0	112.2	L779 L784 F788 L793 L796 I816 I825 C873 N874 V880 L881	L779-F877 HydrophobicContact CD2-CD1 3.79Å; L779-F877 HydrophobicContact CD2-CE1 3.69Å; L784-F877 HydrophobicContact CD1-CB 4.11Å; L784-F877 HydrophobicContact CD1-CD1 4Å; L784-F877 HydrophobicContact CD1-CG 4.14Å; F788-F877 HydrophobicContact CE2-CE2 4.11Å; F788-F877 AromaticContact CE2-CZ 3.99Å; F788-F877 HydrophobicContact CE2-CZ 3.99Å; F788-F877 HydrophobicContact CZ-CE2 4.4Å; F788-F877 HydrophobicContact CZ-CZ 4.4Å; L793-F877 HydrophobicContact CD2-CD2 4.27Å; L796-F877 HydrophobicContact CD2-CD2 3.72Å; L796-F877 HydrophobicContact CD2-CE2 3.86Å; I816-F877 HydrophobicContact CD1-CE2 4.45Å; I816-F877 HydrophobicContact CG1-CE2 4.09Å; I816-F877 HydrophobicContact CG1-CZ 4.23Å; I825-F877 HydrophobicContact CD1-CE1 4.02Å; I825-F877 HydrophobicContact CD1-CZ 4.32Å; C873-F877 WeakPolarHBondContact O-CG 3.39Å; C873-F877 PolarHBondContact O-N 2.87Å; N874-F877 PolarHBondContact O-N 3.03Å; F877-V880 PolarHBondContact O-N 3.37Å; F877-L881 VanDerWaalsContact O-CG 3.29Å; F877-L881 WeakPolarHBondContact O-CG 3.33Å; F877-L881 PolarHBondContact O-N 3.16Å; F877-L881 VanDerWaalsContact O-N 3.07Å
878	R	87.9	Confident	86.3	Confident	81 Å²	81	61.9 Å²	61.9	31%	0.306	33%	0.33	S	S	.	.	H	α-helix	trans	-64.9	-44.5	172.4	-77.5	175.6	162	-167.8	-14.2	112.9	E797 N874 Q875 C876 V880 L881 E882	E797-R878 IonicContact OE1-NH2 3.03Å; E797-R878 PolarHBondContact OE1-NH2 3.21Å; E797-R878 IonicContact OE2-CZ 2.82Å; E797-R878 IonicContact OE2-NE 2.71Å; E797-R878 IonicContact OE2-NH2 3.65Å; E797-R878 PolarHBondContact OE2-NH2 2.98Å; N874-R878 WeakPolarHBondContact O-CG 3.43Å; N874-R878 PolarHBondContact O-N 2.83Å; Q875-R878 PolarHBondContact O-N 3.42Å; C876-R878 VanDerWaalsContact C-N 3.26Å; C876-R878 PolarHBondContact O-N 2.99Å; R878-V880 VanDerWaalsContact C-N 3.27Å; R878-V880 PolarHBondContact O-N 2.79Å; R878-L881 CarbonylContact O-C 3.53Å; R878-L881 WeakPolarHBondContact O-CB 3.41Å; R878-L881 PolarHBondContact O-N 3.01Å; R878-L881 VanDerWaalsContact O-N 3.07Å; R878-E882 WeakPolarHBondContact O-CB 3.48Å; R878-E882 VanDerWaalsContact O-CG 3.31Å; R878-E882 WeakPolarHBondContact O-CG 3.39Å; R878-E882 PolarHBondContact O-N 2.95Å
879	S	87.6	Confident	85.4	Confident	48 Å²	48	64.5 Å²	64.5	34%	0.336	34%	0.342	S	S	.	.	H	α-helix	trans	-54.7	-45	174.6	-163.1	0	0	0	0	111.4	Q875 C876 L881 E882 E883	Q875-S879 PolarHBondContact O-N 3.44Å; C876-S879 WeakPolarHBondContact O-CB 3.32Å; C876-S879 PolarHBondContact O-N 3.15Å; S879-L881 VanDerWaalsContact C-N 3.35Å; S879-L881 PolarHBondContact O-N 3.27Å; S879-E882 PolarHBondContact O-N 3Å; S879-E883 WeakPolarHBondContact O-CB 3.4Å; S879-E883 WeakPolarHBondContact O-CG 3.46Å; S879-E883 PolarHBondContact O-N 3.15Å; S879-E883 PolarHBondContact OG-OE1 3.49Å
880	V	86.3	Confident	84	Confident	17 Å²	17	69.6 Å²	69.6	10%	0.103	37%	0.368	C	S	.	.	H	α-helix	trans	-64.8	-38.1	177.9	174.8	0	0	0	0	112.1	L779 L784 C876 F877 R878 H884	L779-V880 HydrophobicContact CD2-CG2 4.49Å; L779-V880 WeakPolarHBondContact O-CG1 3.49Å; L784-V880 HydrophobicContact CD1-CG1 4.48Å; C876-V880 PolarHBondContact O-N 3.2Å; C876-V880 VanDerWaalsContact O-N 3.12Å; F877-V880 PolarHBondContact O-N 3.37Å; R878-V880 VanDerWaalsContact C-N 3.27Å; R878-V880 PolarHBondContact O-N 2.79Å; V880-H884 WeakPolarHBondContact O-CB 3.44Å; V880-H884 PolarHBondContact O-N 3.43Å; V880-H884 VanDerWaalsContact O-N 3.13Å
881	L	85.3	Confident	82.6	Confident	42 Å²	42	79.1 Å²	79.1	22%	0.22	40%	0.404	C	S	.	.	H	α-helix	trans	-65.9	-44.3	174.1	-68	169.6	0	0	0	111	K781 L793 F877 R878 S879 H884 I885	K781-L881 HydrophobicContact CD-CD2 3.35Å; L793-L881 HydrophobicContact CD1-CD1 4.34Å; F877-L881 VanDerWaalsContact O-CG 3.29Å; F877-L881 WeakPolarHBondContact O-CG 3.33Å; F877-L881 PolarHBondContact O-N 3.16Å; F877-L881 VanDerWaalsContact O-N 3.07Å; R878-L881 CarbonylContact O-C 3.53Å; R878-L881 WeakPolarHBondContact O-CB 3.41Å; R878-L881 PolarHBondContact O-N 3.01Å; R878-L881 VanDerWaalsContact O-N 3.07Å; S879-L881 VanDerWaalsContact C-N 3.35Å; S879-L881 PolarHBondContact O-N 3.27Å; L881-H884 PolarHBondContact O-N 3.09Å; L881-I885 WeakPolarHBondContact O-CD1 3.18Å; L881-I885 WeakPolarHBondContact O-CG1 3.44Å; L881-I885 PolarHBondContact O-N 3.32Å
882	E	86.6	Confident	81	Confident	110 Å²	110	83 Å²	83	51%	0.514	42%	0.424	S	S	.	.	H	α-helix	trans	-62.3	-50.6	179.1	-73.5	166.7	-170.5	0	0	110.7	R878 S879 H884 I885 E886	R878-E882 WeakPolarHBondContact O-CB 3.48Å; R878-E882 VanDerWaalsContact O-CG 3.31Å; R878-E882 WeakPolarHBondContact O-CG 3.39Å; R878-E882 PolarHBondContact O-N 2.95Å; S879-E882 PolarHBondContact O-N 3Å; E882-H884 VanDerWaalsContact C-N 3.29Å; E882-H884 PolarHBondContact O-N 3.39Å; E882-I885 PolarHBondContact O-N 3.46Å; E882-I885 VanDerWaalsContact O-N 3.09Å; E882-E886 WeakPolarHBondContact O-CB 3.42Å; E882-E886 WeakPolarHBondContact O-CG 3.38Å; E882-E886 PolarHBondContact O-N 2.91Å
883	E	84.9	Confident	79.4	Confident	119 Å²	119	82.1 Å²	82.1	56%	0.556	44%	0.44	S	S	*	.	H	α-helix	trans	-57.9	-39.4	175.8	-75.1	170.3	-153	0	0	112.5	S879 G887	S879-E883 WeakPolarHBondContact O-CB 3.4Å; S879-E883 WeakPolarHBondContact O-CG 3.46Å; S879-E883 PolarHBondContact O-N 3.15Å; S879-E883 PolarHBondContact OG-OE1 3.49Å; E883-G887 PolarHBondContact O-N 3.39Å
884	H	83.7	Confident	77.9	Confident	103 Å²	103	87.1 Å²	87.1	48%	0.477	47%	0.466	S	S	.	.	H	α-helix	trans	-68	-41	175.8	-177.9	74.4	0	0	0	112.3	K781 V880 L881 E882 G887 G888	K781-H884 HydrophobicContact CB-CB 3.78Å; K781-H884 HydrophobicContact CG-CB 4.23Å; V880-H884 WeakPolarHBondContact O-CB 3.44Å; V880-H884 PolarHBondContact O-N 3.43Å; V880-H884 VanDerWaalsContact O-N 3.13Å; L881-H884 PolarHBondContact O-N 3.09Å; E882-H884 VanDerWaalsContact C-N 3.29Å; E882-H884 PolarHBondContact O-N 3.39Å; H884-G887 PolarHBondContact O-N 3.01Å; H884-G888 PolarHBondContact O-N 2.64Å
885	I	82.7	Confident	76.3	Confident	95 Å²	95	91.2 Å²	91.2	49%	0.487	49%	0.488	S	S	.	.	H	α-helix	trans	-65.1	-46.5	176.2	-65.5	163	0	0	0	109.2	L881 E882 G887 G888 M889	L881-I885 WeakPolarHBondContact O-CD1 3.18Å; L881-I885 WeakPolarHBondContact O-CG1 3.44Å; L881-I885 PolarHBondContact O-N 3.32Å; E882-I885 PolarHBondContact O-N 3.46Å; E882-I885 VanDerWaalsContact O-N 3.09Å; I885-G887 VanDerWaalsContact C-N 3.31Å; I885-G887 PolarHBondContact O-N 2.86Å; I885-G888 CarbonylContact O-C 3.51Å; I885-G888 WeakPolarHBondContact O-CA 3.48Å; I885-G888 PolarHBondContact O-N 3.36Å; I885-M889 HydrophobicContact CG2-CE 3.48Å; I885-M889 VanDerWaalsContact CG2-CE 3.48Å; I885-M889 HydrophobicContact CG2-CG 4.41Å; I885-M889 VanDerWaalsContact O-CG 3.31Å; I885-M889 WeakPolarHBondContact O-CG 3.31Å; I885-M889 PolarHBondContact O-N 3.24Å
886	E	80.1	Confident	74.7	Confident	132 Å²	132	91.5 Å²	91.5	62%	0.617	50%	0.502	S	S	*	.	H	α-helix	trans	-56.5	-43.4	175.1	-74.7	-179.4	-179.8	0	0	112	E882 G888 M889	E882-E886 WeakPolarHBondContact O-CB 3.42Å; E882-E886 WeakPolarHBondContact O-CG 3.38Å; E882-E886 PolarHBondContact O-N 2.91Å; E886-G888 VanDerWaalsContact C-N 3.26Å; E886-G888 PolarHBondContact O-N 3.39Å; E886-M889 PolarHBondContact O-N 3.01Å
887	G	77.3	Confident	73.1	Confident	69 Å²	69	98.7 Å²	98.7	71%	0.711	53%	0.53	S	S	*	.	H	α-helix	trans	-67.1	-25.3	175.1	0	0	0	0	0	114.1	E883 H884 I885	E883-G887 PolarHBondContact O-N 3.39Å; H884-G887 PolarHBondContact O-N 3.01Å; I885-G887 VanDerWaalsContact C-N 3.31Å; I885-G887 PolarHBondContact O-N 2.86Å
888	G	71.2	Confident	71.3	Confident	66 Å²	66	100.2 Å²	100.2	68%	0.68	55%	0.547	S	S	*	.	H	α-helix	trans	-88.8	-13.5	173.9	0	0	0	0	0	114.3	H884 I885 E886	H884-G888 PolarHBondContact O-N 2.64Å; I885-G888 CarbonylContact O-C 3.51Å; I885-G888 WeakPolarHBondContact O-CA 3.48Å; I885-G888 PolarHBondContact O-N 3.36Å; E886-G888 VanDerWaalsContact C-N 3.26Å; E886-G888 PolarHBondContact O-N 3.39Å
889	M	71.9	Confident	69.7	Low	120 Å²	120	105.8 Å²	105.8	59%	0.591	58%	0.576	S	S	*	*	S	Bend	trans	-74	135.8	170.8	-66.8	-165.4	-157.3	0	0	109.2	I885 E886 R891	I885-M889 HydrophobicContact CG2-CE 3.48Å; I885-M889 VanDerWaalsContact CG2-CE 3.48Å; I885-M889 HydrophobicContact CG2-CG 4.41Å; I885-M889 VanDerWaalsContact O-CG 3.31Å; I885-M889 WeakPolarHBondContact O-CG 3.31Å; I885-M889 PolarHBondContact O-N 3.24Å; E886-M889 PolarHBondContact O-N 3.01Å; M889-R891 PolarHBondContact O-N 2.87Å
890	L	61.6	Low	68	Low	110 Å²	110	112.6 Å²	112.6	58%	0.576	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-58	131.6	169.9	-73.9	157.4	0	0	0	108.5	D894 L895	L890-D894 HydrophobicContact CB-CB 4.49Å; L890-D894 HydrophobicContact CD2-CB 3.84Å; L890-L895 HydrophobicContact CB-CD2 4.24Å; L890-L895 HydrophobicContact CB-CG 4.26Å; L890-L895 HydrophobicContact CD1-CD2 4.36Å
891	R	60.8	Low	66.5	Low	200 Å²	200	118.4 Å²	118.4	76%	0.755	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-56.6	148.3	169.2	-67	177.5	178.3	172.4	0.1	107.8	M889 A893 D894 L895	M889-R891 PolarHBondContact O-N 2.87Å; R891-A893 PolarHBondContact O-N 3.33Å; R891-D894 PolarHBondContact O-N 3.33Å; R891-L895 PolarHBondContact O-N 2.8Å
892	E	57.1	Low	65	Low	177 Å²	177	124.5 Å²	124.5	83%	0.827	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53	-21.8	179.6	-81.2	-173.2	151.3	0	0	114.1
893	A	57.7	Low	63.4	Low	90 Å²	90	124.7 Å²	124.7	74%	0.744	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-25	175.1	0	0	0	0	0	114.7	R891	R891-A893 PolarHBondContact O-N 3.33Å
894	D	56.4	Low	62	Low	104 Å²	104	124 Å²	124	56%	0.556	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.6	-3.3	-174.5	-60	-39.5	0	0	0	112.8	L890 R891 S896	L890-D894 HydrophobicContact CB-CB 4.49Å; L890-D894 HydrophobicContact CD2-CB 3.84Å; R891-D894 PolarHBondContact O-N 3.33Å; D894-S896 PolarHBondContact O-N 3.29Å
895	L	57.9	Low	60.8	Low	96 Å²	96	125.9 Å²	125.9	50%	0.503	69%	0.689	S	S	.	*	S	Bend	trans	-60.8	124.4	164.7	-76.2	164.9	0	0	0	108	L890 R891 K897	L890-L895 HydrophobicContact CB-CD2 4.24Å; L890-L895 HydrophobicContact CB-CG 4.26Å; L890-L895 HydrophobicContact CD1-CD2 4.36Å; R891-L895 PolarHBondContact O-N 2.8Å; L895-K897 PolarHBondContact O-N 3.02Å
896	S	55.8	Low	59.6	Low	116 Å²	116	123.9 Å²	123.9	81%	0.811	68%	0.679	S	S	*	*			trans	-63.1	89.3	165.9	53	0	0	0	0	108.4	D894 G898	D894-S896 PolarHBondContact O-N 3.29Å; S896-G898 PolarHBondContact O-N 2.81Å
897	K	54.1	Low	59	Low	175 Å²	175	120.8 Å²	120.8	76%	0.761	67%	0.672	S	S	*	*			trans	-59.8	93.4	149	-65.4	-175.3	-176.4	179.9	0	103.6	L895 E899	L895-K897 PolarHBondContact O-N 3.02Å; K897-E899 PolarHBondContact O-N 3.04Å
898	G	50.4	Low	58.5	Low	34 Å²	34	122.9 Å²	122.9	35%	0.351	67%	0.666	S	S	.	*			trans	-45	143.4	-172.6	0	0	0	0	0	110	S896 E900 L901	S896-G898 PolarHBondContact O-N 2.81Å; G898-E900 PolarHBondContact O-N 3.16Å; G898-L901 PolarHBondContact O-N 3.04Å
899	E	54.3	Low	58.4	Low	199 Å²	199	125.1 Å²	125.1	93%	0.93	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.2	-6.3	-177.6	-65.9	179.5	149.7	0	0	113.5	K897	K897-E899 PolarHBondContact O-N 3.04Å
900	E	51.4	Low	58.4	Low	191 Å²	191	125.4 Å²	125.4	89%	0.893	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	-6.9	173.1	-62.5	-172.7	162.7	0	0	115.2	G898	G898-E900 PolarHBondContact O-N 3.16Å
901	L	55.4	Low	58.9	Low	138 Å²	138	123.9 Å²	123.9	72%	0.723	65%	0.65	S	S	*	*			trans	-104.6	76.3	174.6	-78.1	166.1	0	0	0	110.4	G898	G898-L901 PolarHBondContact O-N 3.04Å
902	Q	54.1	Low	59.6	Low	171 Å²	171	119.2 Å²	119.2	80%	0.799	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-64.9	129.2	163.9	-66.4	-176.8	0.2	0	0	108.8	L904	Q902-L904 PolarHBondContact O-N 2.81Å
903	P	53.2	Low	60.5	Low	114 Å²	114	115.8 Å²	115.8	74%	0.74	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-61.3	125.4	170	25.4	-30.4	0	0	0	107.9	T905	P903-T905 PolarHBondContact O-N 3.2Å
904	L	55.5	Low	61.4	Low	104 Å²	104	115.6 Å²	115.6	55%	0.545	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-52.9	117.3	175.6	-82.1	162.3	0	0	0	108.9	Q902 L906 E911	Q902-L904 PolarHBondContact O-N 2.81Å; L904-L906 WeakPolarHBondContact CB-O 3.41Å; L904-L906 PolarHBondContact O-N 2.75Å; L904-L906 VanDerWaalsContact O-N 3.16Å; L904-E911 WeakPolarHBondContact CD2-OE1 3.47Å; L904-E911 WeakPolarHBondContact CD2-OE2 3.3Å
905	T	58.3	Low	62.3	Low	142 Å²	142	114.1 Å²	114.1	87%	0.871	61%	0.606	S	S	*	*	S	Bend	trans	-68.5	-9.5	-179.8	49.5	0	0	0	0	112.5	P903	P903-T905 PolarHBondContact O-N 3.2Å
906	L	58	Low	63.3	Low	54 Å²	54	112.3 Å²	112.3	28%	0.283	61%	0.605	S	S	.	*	S	Bend	trans	-123.2	142.4	171.9	-79	115.7	0	0	0	110	L904 K910	L904-L906 WeakPolarHBondContact CB-O 3.41Å; L904-L906 PolarHBondContact O-N 2.75Å; L904-L906 VanDerWaalsContact O-N 3.16Å; L906-K910 HydrophobicContact CB-CB 4.25Å; L906-K910 HydrophobicContact CD2-CB 3.57Å; L906-K910 HydrophobicContact CD2-CD 4.06Å; L906-K910 HydrophobicContact CD2-CG 4.44Å
907	S	67.2	Low	64.3	Low	66 Å²	66	112.5 Å²	112.5	46%	0.462	59%	0.593	S	S	.	*			trans	-59.1	145.6	169.8	58	0	0	0	0	110.2	D909 K910 E911	S907-D909 PolarHBondContact O-N 3.45Å; S907-K910 WeakPolarHBondContact O-CA 3.47Å; S907-K910 PolarHBondContact O-N 3.46Å; S907-E911 PolarHBondContact O-N 2.94Å
908	L	67.1	Low	65.5	Low	113 Å²	113	110.9 Å²	110.9	59%	0.592	59%	0.586	S	S	*	*	H	α-helix	trans	-46.8	-39.3	-177.9	-162.2	83.4	0	0	0	112.5	E911 L912	L908-E911 PolarHBondContact O-N 3.48Å; L908-L912 HydrophobicContact CG-CD1 4.37Å; L908-L912 WeakPolarHBondContact O-CB 3.45Å; L908-L912 VanDerWaalsContact O-CG 3.29Å; L908-L912 WeakPolarHBondContact O-CG 3.16Å; L908-L912 PolarHBondContact O-N 2.9Å
909	D	69.3	Low	66.9	Low	114 Å²	114	113.6 Å²	113.6	61%	0.61	59%	0.592	S	S	*	*	H	α-helix	trans	-64.9	-40	177.1	-59	-35.7	0	0	0	113.4	S907 E911 L912 D913	S907-D909 PolarHBondContact O-N 3.45Å; D909-E911 VanDerWaalsContact C-N 3.34Å; D909-L912 PolarHBondContact O-N 3.33Å; D909-D913 WeakPolarHBondContact O-CB 3.42Å; D909-D913 PolarHBondContact O-N 2.9Å
910	K	71.3	Confident	67.9	Low	125 Å²	125	106.6 Å²	106.6	54%	0.543	57%	0.565	S	S	.	*	H	α-helix	trans	-73.5	-30.2	177.4	-73.5	-178.2	178.3	175.8	0	111.8	L906 S907 Q914	L906-K910 HydrophobicContact CB-CB 4.25Å; L906-K910 HydrophobicContact CD2-CB 3.57Å; L906-K910 HydrophobicContact CD2-CD 4.06Å; L906-K910 HydrophobicContact CD2-CG 4.44Å; S907-K910 WeakPolarHBondContact O-CA 3.47Å; S907-K910 PolarHBondContact O-N 3.46Å; K910-Q914 WeakPolarHBondContact O-CB 3.29Å; K910-Q914 VanDerWaalsContact O-CG 3.3Å; K910-Q914 WeakPolarHBondContact O-CG 3.42Å; K910-Q914 PolarHBondContact O-N 3Å
911	E	71.9	Confident	69.3	Low	78 Å²	78	104.2 Å²	104.2	36%	0.364	55%	0.552	S	S	.	*	H	α-helix	trans	-70	-45	173.9	-161.6	175.5	-159.1	0	0	110.5	L904 S907 L908 D909 D913 Q914 T915	L904-E911 WeakPolarHBondContact CD2-OE1 3.47Å; L904-E911 WeakPolarHBondContact CD2-OE2 3.3Å; S907-E911 PolarHBondContact O-N 2.94Å; L908-E911 PolarHBondContact O-N 3.48Å; D909-E911 VanDerWaalsContact C-N 3.34Å; E911-D913 VanDerWaalsContact C-N 3.35Å; E911-D913 PolarHBondContact O-N 3.38Å; E911-Q914 PolarHBondContact O-N 3.46Å; E911-T915 PolarHBondContact O-N 2.8Å; E911-T915 PolarHBondContact O-OG1 3.33Å
912	L	75.6	Confident	70.4	Confident	103 Å²	103	103.8 Å²	103.8	54%	0.539	55%	0.546	S	S	.	.	H	α-helix	trans	-58.2	-43.3	172.7	-75.4	167.7	0	0	0	111.9	L908 D909 T915 A916	L908-L912 HydrophobicContact CG-CD1 4.37Å; L908-L912 WeakPolarHBondContact O-CB 3.45Å; L908-L912 VanDerWaalsContact O-CG 3.29Å; L908-L912 WeakPolarHBondContact O-CG 3.16Å; L908-L912 PolarHBondContact O-N 2.9Å; D909-L912 PolarHBondContact O-N 3.33Å; L912-T915 WeakPolarHBondContact CA-OG1 3.41Å; L912-T915 PolarHBondContact O-N 2.83Å; L912-T915 PolarHBondContact O-OG1 2.8Å; L912-A916 VanDerWaalsContact O-CB 3.28Å; L912-A916 WeakPolarHBondContact O-CB 3.28Å; L912-A916 PolarHBondContact O-N 3.46Å
913	D	76.4	Confident	71.4	Confident	105 Å²	105	100.7 Å²	100.7	56%	0.561	53%	0.532	S	S	*	.	H	α-helix	trans	-65.3	-40.8	175.5	-83.3	-21.8	0	0	0	112.6	D909 E911 A916 Q917	D909-D913 WeakPolarHBondContact O-CB 3.42Å; D909-D913 PolarHBondContact O-N 2.9Å; E911-D913 VanDerWaalsContact C-N 3.35Å; E911-D913 PolarHBondContact O-N 3.38Å; D913-A916 PolarHBondContact O-N 2.78Å; D913-Q917 WeakPolarHBondContact O-CB 3.37Å; D913-Q917 WeakPolarHBondContact O-CG 3.35Å; D913-Q917 PolarHBondContact O-N 2.91Å
914	Q	76	Confident	72.5	Confident	86 Å²	86	104.2 Å²	104.2	40%	0.402	53%	0.53	S	S	.	.	H	α-helix	trans	-68.6	-36.3	175.3	-77.3	-175.1	10.8	0	0	112.1	K910 E911 Q917 K918	K910-Q914 WeakPolarHBondContact O-CB 3.29Å; K910-Q914 VanDerWaalsContact O-CG 3.3Å; K910-Q914 WeakPolarHBondContact O-CG 3.42Å; K910-Q914 PolarHBondContact O-N 3Å; E911-Q914 PolarHBondContact O-N 3.46Å; Q914-Q917 PolarHBondContact O-N 3.21Å; Q914-K918 WeakPolarHBondContact O-CB 3.32Å; Q914-K918 WeakPolarHBondContact O-CG 3.44Å; Q914-K918 PolarHBondContact O-N 3.44Å
915	T	75.4	Confident	73.6	Confident	73 Å²	73	107 Å²	107	45%	0.448	54%	0.538	S	S	.	.	H	α-helix	trans	-67.5	-43.9	174.1	1.8	0	0	0	0	110.2	E911 L912 Q917 K918 L919	E911-T915 PolarHBondContact O-N 2.8Å; E911-T915 PolarHBondContact O-OG1 3.33Å; L912-T915 WeakPolarHBondContact CA-OG1 3.41Å; L912-T915 PolarHBondContact O-N 2.83Å; L912-T915 PolarHBondContact O-OG1 2.8Å; T915-Q917 VanDerWaalsContact C-N 3.32Å; T915-Q917 PolarHBondContact O-N 2.59Å; T915-K918 PolarHBondContact O-N 3.07Å; T915-L919 WeakPolarHBondContact O-CB 3.41Å; T915-L919 PolarHBondContact O-N 3.48Å
916	A	77.9	Confident	74.4	Confident	58 Å²	58	105.8 Å²	105.8	48%	0.479	52%	0.522	S	S	.	.	H	α-helix	trans	-59.8	-39.4	174.7	0	0	0	0	0	112.3	L912 D913 S920	L912-A916 VanDerWaalsContact O-CB 3.28Å; L912-A916 WeakPolarHBondContact O-CB 3.28Å; L912-A916 PolarHBondContact O-N 3.46Å; D913-A916 PolarHBondContact O-N 2.78Å; A916-S920 WeakPolarHBondContact O-CB 3.22Å; A916-S920 PolarHBondContact O-N 3.27Å
917	Q	77.8	Confident	75	Confident	120 Å²	120	107.6 Å²	107.6	56%	0.561	53%	0.532	S	S	*	.	H	α-helix	trans	-71	-35.9	174.6	-74.6	-178	14.2	0	0	113.5	D913 Q914 T915 S920 K921	D913-Q917 WeakPolarHBondContact O-CB 3.37Å; D913-Q917 WeakPolarHBondContact O-CG 3.35Å; D913-Q917 PolarHBondContact O-N 2.91Å; Q914-Q917 PolarHBondContact O-N 3.21Å; T915-Q917 VanDerWaalsContact C-N 3.32Å; T915-Q917 PolarHBondContact O-N 2.59Å; Q917-S920 PolarHBondContact O-OG 3.19Å; Q917-K921 WeakPolarHBondContact O-CB 3.44Å; Q917-K921 WeakPolarHBondContact O-CG 3.38Å; Q917-K921 PolarHBondContact O-N 2.87Å; Q917-K921 VanDerWaalsContact O-N 3.07Å
918	K	79.6	Confident	75.4	Confident	140 Å²	140	112 Å²	112	61%	0.609	54%	0.543	S	S	*	.	H	α-helix	trans	-67.8	-42.2	173.6	-79.2	176.8	-179.2	173	0	111	Q914 T915 K921 Q922	Q914-K918 WeakPolarHBondContact O-CB 3.32Å; Q914-K918 WeakPolarHBondContact O-CG 3.44Å; Q914-K918 PolarHBondContact O-N 3.44Å; T915-K918 PolarHBondContact O-N 3.07Å; K918-K921 PolarHBondContact O-N 2.8Å; K918-Q922 PolarHBondContact O-N 2.84Å
919	L	79.6	Confident	75.7	Confident	91 Å²	91	114.4 Å²	114.4	48%	0.476	54%	0.544	S	S	.	.	H	α-helix	trans	-68.7	-39	179.5	-149.9	148.3	0	0	0	110.7	T915 K921 Q922 Q923	T915-L919 WeakPolarHBondContact O-CB 3.41Å; T915-L919 PolarHBondContact O-N 3.48Å; L919-K921 PolarHBondContact O-N 3.18Å; L919-Q922 PolarHBondContact O-N 3.33Å; L919-Q923 HydrophobicContact CD2-CG 4.07Å; L919-Q923 VanDerWaalsContact CD2-NE2 3.32Å; L919-Q923 VanDerWaalsContact O-CB 3.28Å; L919-Q923 WeakPolarHBondContact O-CB 3.28Å; L919-Q923 VanDerWaalsContact O-CG 3.28Å; L919-Q923 WeakPolarHBondContact O-CG 3.29Å; L919-Q923 PolarHBondContact O-N 2.85Å
920	S	76	Confident	75.5	Confident	53 Å²	53	113 Å²	113	37%	0.371	54%	0.536	S	S	.	.	H	α-helix	trans	-68.6	-32	172.3	81.4	0	0	0	0	113.3	A916 Q917 R924	A916-S920 WeakPolarHBondContact O-CB 3.22Å; A916-S920 PolarHBondContact O-N 3.27Å; Q917-S920 PolarHBondContact O-OG 3.19Å; S920-R924 VanDerWaalsContact O-CB 3.29Å; S920-R924 WeakPolarHBondContact O-CB 3.49Å; S920-R924 WeakPolarHBondContact O-CG 3.5Å; S920-R924 PolarHBondContact O-N 2.95Å
921	K	80	Confident	75.2	Confident	140 Å²	140	115.2 Å²	115.2	61%	0.609	55%	0.545	S	S	*	.	H	α-helix	trans	-70.9	-39.3	172.4	-81	177.4	179.9	173.9	0	112.2	Q917 K918 L919 R924 K925	Q917-K921 WeakPolarHBondContact O-CB 3.44Å; Q917-K921 WeakPolarHBondContact O-CG 3.38Å; Q917-K921 PolarHBondContact O-N 2.87Å; Q917-K921 VanDerWaalsContact O-N 3.07Å; K918-K921 PolarHBondContact O-N 2.8Å; L919-K921 PolarHBondContact O-N 3.18Å; K921-R924 PolarHBondContact O-N 2.77Å; K921-K925 WeakPolarHBondContact O-CB 3.47Å; K921-K925 WeakPolarHBondContact O-CG 3.28Å; K921-K925 PolarHBondContact O-N 3.49Å
922	Q	77.7	Confident	74.8	Confident	129 Å²	129	115.3 Å²	115.3	60%	0.603	56%	0.56	S	S	*	*	H	α-helix	trans	-66	-48.7	172.3	-87.4	-179.6	-27.4	0	0	110.8	K918 L919 R924 K925 E926	K918-Q922 PolarHBondContact O-N 2.84Å; L919-Q922 PolarHBondContact O-N 3.33Å; Q922-R924 VanDerWaalsContact C-N 3.3Å; Q922-R924 PolarHBondContact O-N 3.2Å; Q922-K925 CarbonylContact O-C 3.54Å; Q922-K925 WeakPolarHBondContact O-CA 3.41Å; Q922-K925 WeakPolarHBondContact O-CB 3.49Å; Q922-K925 PolarHBondContact O-N 3.06Å; Q922-E926 PolarHBondContact O-N 3.07Å
923	Q	76.3	Confident	74.2	Confident	107 Å²	107	114.6 Å²	114.6	50%	0.5	55%	0.554	S	S	.	*	H	α-helix	trans	-57	-41.5	173.3	-77.3	177.8	-12.9	0	0	111.4	L919 E926 L927	L919-Q923 HydrophobicContact CD2-CG 4.07Å; L919-Q923 VanDerWaalsContact CD2-NE2 3.32Å; L919-Q923 VanDerWaalsContact O-CB 3.28Å; L919-Q923 WeakPolarHBondContact O-CB 3.28Å; L919-Q923 VanDerWaalsContact O-CG 3.28Å; L919-Q923 WeakPolarHBondContact O-CG 3.29Å; L919-Q923 PolarHBondContact O-N 2.85Å; Q923-E926 PolarHBondContact O-N 3.35Å; Q923-L927 VanDerWaalsContact O-CB 3.23Å; Q923-L927 WeakPolarHBondContact O-CB 3.47Å; Q923-L927 PolarHBondContact O-N 3.29Å
924	R	76.3	Confident	73.2	Confident	188 Å²	188	117.9 Å²	117.9	71%	0.709	57%	0.566	S	S	*	*	H	α-helix	trans	-66.7	-33.4	173.6	-88.8	-179.3	168.5	179.3	-1.8	113.5	S920 K921 Q922 K928	S920-R924 VanDerWaalsContact O-CB 3.29Å; S920-R924 WeakPolarHBondContact O-CB 3.49Å; S920-R924 WeakPolarHBondContact O-CG 3.5Å; S920-R924 PolarHBondContact O-N 2.95Å; K921-R924 PolarHBondContact O-N 2.77Å; Q922-R924 VanDerWaalsContact C-N 3.3Å; Q922-R924 PolarHBondContact O-N 3.2Å; R924-K928 WeakPolarHBondContact O-CB 3.16Å; R924-K928 VanDerWaalsContact O-CG 3.29Å; R924-K928 WeakPolarHBondContact O-CG 3.23Å; R924-K928 PolarHBondContact O-N 3.41Å
925	K	78.3	Confident	72.4	Confident	162 Å²	162	117.6 Å²	117.6	70%	0.704	57%	0.567	S	S	*	*	H	α-helix	trans	-71.6	-42.6	174.4	-83.9	-175.3	175.5	-175.5	0	111.3	K921 Q922 K928 R929	K921-K925 WeakPolarHBondContact O-CB 3.47Å; K921-K925 WeakPolarHBondContact O-CG 3.28Å; K921-K925 PolarHBondContact O-N 3.49Å; Q922-K925 CarbonylContact O-C 3.54Å; Q922-K925 WeakPolarHBondContact O-CA 3.41Å; Q922-K925 WeakPolarHBondContact O-CB 3.49Å; Q922-K925 PolarHBondContact O-N 3.06Å; K925-K928 PolarHBondContact O-N 3.39Å; K925-R929 WeakPolarHBondContact O-CB 3.41Å; K925-R929 PolarHBondContact O-N 3.29Å
926	E	74.4	Confident	71.5	Confident	117 Å²	117	120 Å²	120	55%	0.547	58%	0.577	S	S	.	*	H	α-helix	trans	-65	-41.6	171.7	-82.8	-176.4	152.2	0	0	111.6	Q922 Q923 K928 R929 L930	Q922-E926 PolarHBondContact O-N 3.07Å; Q923-E926 PolarHBondContact O-N 3.35Å; E926-K928 VanDerWaalsContact C-N 3.29Å; E926-K928 PolarHBondContact O-N 3.32Å; E926-R929 CarbonylContact O-C 3.59Å; E926-R929 WeakPolarHBondContact O-CB 3.46Å; E926-R929 PolarHBondContact O-N 3.04Å; E926-R929 VanDerWaalsContact O-N 3.11Å; E926-L930 VanDerWaalsContact O-CB 3.28Å; E926-L930 WeakPolarHBondContact O-CB 3.29Å; E926-L930 VanDerWaalsContact O-CG 3.27Å; E926-L930 WeakPolarHBondContact O-CG 3.36Å; E926-L930 PolarHBondContact O-N 2.87Å
927	L	71.7	Confident	70.3	Confident	91 Å²	91	123.7 Å²	123.7	48%	0.476	58%	0.584	S	S	.	*	H	α-helix	trans	-63.2	-35.8	173.6	-120.6	148	0	0	0	111.7	Q923 K931	Q923-L927 VanDerWaalsContact O-CB 3.23Å; Q923-L927 WeakPolarHBondContact O-CB 3.47Å; Q923-L927 PolarHBondContact O-N 3.29Å; L927-K931 HydrophobicContact CD2-CD 4.09Å; L927-K931 HydrophobicContact CD2-CG 4.3Å; L927-K931 WeakPolarHBondContact O-CB 3.43Å; L927-K931 WeakPolarHBondContact O-CG 3.18Å; L927-K931 PolarHBondContact O-N 2.92Å
928	K	74.3	Confident	69.2	Low	160 Å²	160	125.1 Å²	125.1	70%	0.696	59%	0.588	S	S	*	*	H	α-helix	trans	-71.1	-34.6	172.8	-80.5	-176.2	178.4	-169.9	0	112.2	R924 K925 E926 A932	R924-K928 WeakPolarHBondContact O-CB 3.16Å; R924-K928 VanDerWaalsContact O-CG 3.29Å; R924-K928 WeakPolarHBondContact O-CG 3.23Å; R924-K928 PolarHBondContact O-N 3.41Å; K925-K928 PolarHBondContact O-N 3.39Å; E926-K928 VanDerWaalsContact C-N 3.29Å; E926-K928 PolarHBondContact O-N 3.32Å; K928-A932 VanDerWaalsContact O-CB 3.23Å; K928-A932 WeakPolarHBondContact O-CB 3.42Å; K928-A932 PolarHBondContact O-N 3.45Å; K928-A932 VanDerWaalsContact O-N 3.09Å
929	R	74.8	Confident	67.8	Low	163 Å²	163	124.9 Å²	124.9	62%	0.615	59%	0.59	S	S	*	*	H	α-helix	trans	-68.8	-47.1	173.6	-177.2	-176.3	166	178.9	-0.4	111.2	K925 E926 K931 A932 E933	K925-R929 WeakPolarHBondContact O-CB 3.41Å; K925-R929 PolarHBondContact O-N 3.29Å; E926-R929 CarbonylContact O-C 3.59Å; E926-R929 WeakPolarHBondContact O-CB 3.46Å; E926-R929 PolarHBondContact O-N 3.04Å; E926-R929 VanDerWaalsContact O-N 3.11Å; R929-K931 VanDerWaalsContact C-N 3.33Å; R929-K931 PolarHBondContact O-N 2.73Å; R929-A932 CarbonylContact O-C 3.51Å; R929-A932 WeakPolarHBondContact O-CA 3.46Å; R929-A932 PolarHBondContact O-N 3.11Å; R929-E933 IonicContact CZ-OE1 3.83Å; R929-E933 IonicContact NE-OE1 2.73Å; R929-E933 PolarHBondContact NE-OE1 2.97Å; R929-E933 VanDerWaalsContact NE-OE1 3.12Å; R929-E933 IonicContact NH2-OE1 3.63Å; R929-E933 PolarHBondContact O-N 2.77Å
930	L	64	Low	66.6	Low	85 Å²	85	125.4 Å²	125.4	45%	0.445	59%	0.592	S	S	.	*	H	α-helix	trans	-67.1	-29	175.7	-71.2	164.6	0	0	0	112.7	E926 L935	E926-L930 VanDerWaalsContact O-CB 3.28Å; E926-L930 WeakPolarHBondContact O-CB 3.29Å; E926-L930 VanDerWaalsContact O-CG 3.27Å; E926-L930 WeakPolarHBondContact O-CG 3.36Å; E926-L930 PolarHBondContact O-N 2.87Å; L930-L935 HydrophobicContact CB-CD1 4.14Å; L930-L935 HydrophobicContact CD2-CD1 3.87Å; L930-L935 WeakPolarHBondContact O-CD1 3.47Å
931	K	64.9	Low	65.6	Low	170 Å²	170	131.9 Å²	131.9	74%	0.739	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-17.9	169.5	-78.7	-179.7	173.7	-171.2	0	113.5	L927 R929	L927-K931 HydrophobicContact CD2-CD 4.09Å; L927-K931 HydrophobicContact CD2-CG 4.3Å; L927-K931 WeakPolarHBondContact O-CB 3.43Å; L927-K931 WeakPolarHBondContact O-CG 3.18Å; L927-K931 PolarHBondContact O-N 2.92Å; R929-K931 VanDerWaalsContact C-N 3.33Å; R929-K931 PolarHBondContact O-N 2.73Å
932	A	64	Low	64.5	Low	81 Å²	81	126.8 Å²	126.8	67%	0.669	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	-24.9	176.7	0	0	0	0	0	112.3	K928 R929	K928-A932 VanDerWaalsContact O-CB 3.23Å; K928-A932 WeakPolarHBondContact O-CB 3.42Å; K928-A932 PolarHBondContact O-N 3.45Å; K928-A932 VanDerWaalsContact O-N 3.09Å; R929-A932 CarbonylContact O-C 3.51Å; R929-A932 WeakPolarHBondContact O-CA 3.46Å; R929-A932 PolarHBondContact O-N 3.11Å
933	E	61.8	Low	63.9	Low	87 Å²	87	124.5 Å²	124.5	41%	0.407	60%	0.596	S	S	.	*	S	Bend	trans	-73.2	121.7	161	-72.1	170	-168.7	0	0	107.6	R929 L935	R929-E933 IonicContact CZ-OE1 3.83Å; R929-E933 IonicContact NE-OE1 2.73Å; R929-E933 PolarHBondContact NE-OE1 2.97Å; R929-E933 VanDerWaalsContact NE-OE1 3.12Å; R929-E933 IonicContact NH2-OE1 3.63Å; R929-E933 PolarHBondContact O-N 2.77Å; E933-L935 VanDerWaalsContact C-N 3.33Å; E933-L935 PolarHBondContact O-N 2.85Å
934	Q	56.5	Low	63.2	Low	175 Å²	175	128.2 Å²	128.2	82%	0.818	61%	0.613	S	S	*	*			trans	-68	89	177.7	-78.7	178.7	-39.5	0	0	109.8	D936	Q934-D936 PolarHBondContact O-N 3.17Å
935	L	58.3	Low	62.4	Low	80 Å²	80	126 Å²	126	42%	0.419	61%	0.61	S	S	.	*	G	3₁₀ helix	trans	-86.3	15.2	176.8	-70.4	168.3	0	0	0	113.5	L930 E933 E937 F938	L930-L935 HydrophobicContact CB-CD1 4.14Å; L930-L935 HydrophobicContact CD2-CD1 3.87Å; L930-L935 WeakPolarHBondContact O-CD1 3.47Å; E933-L935 VanDerWaalsContact C-N 3.33Å; E933-L935 PolarHBondContact O-N 2.85Å; L935-E937 PolarHBondContact O-N 2.99Å; L935-F938 HydrophobicContact CD2-CD2 4.23Å; L935-F938 PolarHBondContact O-N 2.69Å; L935-F938 VanDerWaalsContact O-N 3.16Å
936	D	57.3	Low	61.5	Low	123 Å²	123	122.3 Å²	122.3	66%	0.658	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-62	-22.8	174.7	-71.9	-25	0	0	0	112.1	Q934 F938	Q934-D936 PolarHBondContact O-N 3.17Å; D936-F938 VanDerWaalsContact C-N 3.28Å; D936-F938 PolarHBondContact O-N 3.42Å
937	E	53	Low	60.7	Low	136 Å²	136	121.9 Å²	121.9	64%	0.636	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-74.9	-9.8	177.5	-67.8	-176.8	167.2	0	0	113.9	L935	L935-E937 PolarHBondContact O-N 2.99Å
938	F	53.5	Low	60.2	Low	149 Å²	149	120 Å²	120	65%	0.654	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-120.1	13.6	177.6	-61.3	-76.4	0	0	0	113.7	L935 D936 I940	L935-F938 HydrophobicContact CD2-CD2 4.23Å; L935-F938 PolarHBondContact O-N 2.69Å; L935-F938 VanDerWaalsContact O-N 3.16Å; D936-F938 VanDerWaalsContact C-N 3.28Å; D936-F938 PolarHBondContact O-N 3.42Å; F938-I940 PolarHBondContact O-N 3.21Å; F938-I940 VanDerWaalsContact O-N 3.1Å
939	Q	51	Low	59.5	Low	136 Å²	136	118.6 Å²	118.6	64%	0.636	58%	0.58	S	S	*	*			trans	-76.9	98.9	179.9	-155.8	-179.7	46.9	0	0	110.6	K941	Q939-K941 PolarHBondContact O-N 2.85Å; Q939-K941 VanDerWaalsContact O-N 3.15Å
940	I	54.3	Low	58.8	Low	102 Å²	102	113 Å²	113	52%	0.523	57%	0.57	S	S	.	*			trans	-68.1	111.6	170.2	-55	171.5	0	0	0	107.7	F938 G942 W947	F938-I940 PolarHBondContact O-N 3.21Å; F938-I940 VanDerWaalsContact O-N 3.1Å; I940-G942 PolarHBondContact O-N 3.03Å; I940-W947 HydrophobicContact CB-CZ2 4.38Å; I940-W947 HydrophobicContact CG2-CH2 3.74Å; I940-W947 HydrophobicContact CG2-CZ2 3.68Å
941	K	54.4	Low	58.6	Low	188 Å²	188	115.3 Å²	115.3	82%	0.817	58%	0.582	S	S	*	*			trans	-74.5	121.8	173.8	-82.4	-173.5	175	-179.1	0	110.4	Q939	Q939-K941 PolarHBondContact O-N 2.85Å; Q939-K941 VanDerWaalsContact O-N 3.15Å
942	G	57.2	Low	58.3	Low	33 Å²	33	114.6 Å²	114.6	34%	0.34	58%	0.581	S	S	.	*			trans	-162.1	133.9	160.2	0	0	0	0	0	109.3	I940 W947	I940-G942 PolarHBondContact O-N 3.03Å; G942-W947 PolarHBondContact O-NE1 3.12Å
943	T	66.5	Low	57.8	Low	82 Å²	82	115.9 Å²	115.9	50%	0.503	58%	0.581	S	S	.	*			trans	-75.4	156.8	171.2	57.5	0	0	0	0	109.8	E945 D946 W947	T943-E945 PolarHBondContact O-N 3Å; T943-D946 PolarHBondContact N-OD2 3.09Å; T943-D946 WeakPolarHBondContact O-CB 3.49Å; T943-D946 PolarHBondContact O-N 3.47Å; T943-D946 PolarHBondContact OG1-OD2 3.06Å; T943-W947 PolarHBondContact O-N 3.45Å; T943-W947 VanDerWaalsContact O-N 3.12Å
944	E	59.9	Low	57.2	Low	184 Å²	184	118.5 Å²	118.5	86%	0.86	60%	0.597	S	S	*	*	H	α-helix	trans	-53.5	-30.1	179.4	-85	-175.5	160	0	0	112.5	S948	E944-S948 WeakPolarHBondContact O-CB 3.46Å; E944-S948 PolarHBondContact O-N 3.18Å; E944-S948 PolarHBondContact O-OG 3.07Å
945	E	59.3	Low	57.1	Low	141 Å²	141	113.2 Å²	113.2	66%	0.659	59%	0.59	S	S	*	*	H	α-helix	trans	-72.2	-29	174	-66.7	-175.7	168	0	0	114.3	T943 S948 K949	T943-E945 PolarHBondContact O-N 3Å; E945-S948 WeakPolarHBondContact CA-OG 3.36Å; E945-S948 PolarHBondContact O-OG 3.46Å; E945-K949 WeakPolarHBondContact O-CB 3.43Å; E945-K949 WeakPolarHBondContact O-CG 3.28Å; E945-K949 PolarHBondContact O-N 2.71Å
946	D	60.1	Low	56.4	Low	86 Å²	86	115.8 Å²	115.8	46%	0.46	61%	0.609	S	S	.	*	H	α-helix	trans	-77.4	-37	176.1	-65	-42.5	0	0	0	111.2	T943 A950	T943-D946 PolarHBondContact N-OD2 3.09Å; T943-D946 WeakPolarHBondContact O-CB 3.49Å; T943-D946 PolarHBondContact O-N 3.47Å; T943-D946 PolarHBondContact OG1-OD2 3.06Å; D946-A950 WeakPolarHBondContact O-CB 3.47Å; D946-A950 PolarHBondContact O-N 3.12Å
947	W	58.5	Low	55.8	Low	107 Å²	107	113.8 Å²	113.8	41%	0.405	62%	0.618	S	S	.	*	H	α-helix	trans	-69.9	-37.6	175.2	-68.6	107.6	0	0	0	112	I940 G942 T943 A950 L951 L963	I940-W947 HydrophobicContact CB-CZ2 4.38Å; I940-W947 HydrophobicContact CG2-CH2 3.74Å; I940-W947 HydrophobicContact CG2-CZ2 3.68Å; G942-W947 PolarHBondContact O-NE1 3.12Å; T943-W947 PolarHBondContact O-N 3.45Å; T943-W947 VanDerWaalsContact O-N 3.12Å; W947-A950 PolarHBondContact O-N 3.25Å; W947-L951 WeakPolarHBondContact O-CD1 3.23Å; W947-L951 WeakPolarHBondContact O-CG 3.27Å; W947-L951 PolarHBondContact O-N 3.46Å; W947-L951 VanDerWaalsContact O-N 3.09Å; W947-L963 HydrophobicContact CZ3-CD1 4.48Å
948	S	60.6	Low	55.7	Low	51 Å²	51	111.7 Å²	111.7	36%	0.357	63%	0.633	S	S	.	*	H	α-helix	trans	-68.1	-39.6	174.8	66.7	0	0	0	0	112	E944 E945 L951 E952	E944-S948 WeakPolarHBondContact O-CB 3.46Å; E944-S948 PolarHBondContact O-N 3.18Å; E944-S948 PolarHBondContact O-OG 3.07Å; E945-S948 WeakPolarHBondContact CA-OG 3.36Å; E945-S948 PolarHBondContact O-OG 3.46Å; S948-L951 PolarHBondContact O-N 3.09Å; S948-E952 WeakPolarHBondContact O-CB 3.33Å; S948-E952 WeakPolarHBondContact O-CG 3.5Å; S948-E952 PolarHBondContact O-N 3.05Å
949	K	59.7	Low	55.1	Low	131 Å²	131	108.1 Å²	108.1	57%	0.57	64%	0.637	S	S	*	*	H	α-helix	trans	-63.8	-40.1	173	-80.5	174.6	-177.4	165.4	0	113	E945 L951 E952 T953	E945-K949 WeakPolarHBondContact O-CB 3.43Å; E945-K949 WeakPolarHBondContact O-CG 3.28Å; E945-K949 PolarHBondContact O-N 2.71Å; K949-L951 VanDerWaalsContact C-N 3.3Å; K949-L951 PolarHBondContact O-N 3.46Å; K949-E952 PolarHBondContact O-N 3.15Å; K949-T953 PolarHBondContact O-N 3.43Å; K949-T953 VanDerWaalsContact O-N 3.17Å; K949-T953 PolarHBondContact O-OG1 3.23Å
950	A	59.7	Low	54.9	Low	47 Å²	47	106.9 Å²	106.9	39%	0.388	64%	0.644	S	S	.	*	H	α-helix	trans	-66	-32.1	176.1	0	0	0	0	0	112.8	D946 W947 T953	D946-A950 WeakPolarHBondContact O-CB 3.47Å; D946-A950 PolarHBondContact O-N 3.12Å; W947-A950 PolarHBondContact O-N 3.25Å; A950-T953 PolarHBondContact O-OG1 2.86Å; A950-T953 VanDerWaalsContact O-OG1 3.07Å
951	L	59.4	Low	54.7	Low	133 Å²	133	105.8 Å²	105.8	70%	0.696	66%	0.658	S	S	*	*	H	α-helix	trans	-77.5	-34.8	175.2	-77.8	161.2	0	0	0	112.8	W947 S948 K949	W947-L951 WeakPolarHBondContact O-CD1 3.23Å; W947-L951 WeakPolarHBondContact O-CG 3.27Å; W947-L951 PolarHBondContact O-N 3.46Å; W947-L951 VanDerWaalsContact O-N 3.09Å; S948-L951 PolarHBondContact O-N 3.09Å; K949-L951 VanDerWaalsContact C-N 3.3Å; K949-L951 PolarHBondContact O-N 3.46Å
952	E	58.3	Low	54.6	Low	154 Å²	154	104.3 Å²	104.3	72%	0.72	66%	0.658	S	S	*	*	H	α-helix	trans	-73.5	-27.1	177.8	-76.2	179.8	175	0	0	113.5	S948 K949 N954	S948-E952 WeakPolarHBondContact O-CB 3.33Å; S948-E952 WeakPolarHBondContact O-CG 3.5Å; S948-E952 PolarHBondContact O-N 3.05Å; K949-E952 PolarHBondContact O-N 3.15Å; E952-N954 PolarHBondContact O-N 3.1Å
953	T	54.7	Low	54.1	Low	109 Å²	109	108.7 Å²	108.7	67%	0.669	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-70.1	-6.3	176.8	37.1	0	0	0	0	115.6	K949 A950 G955	K949-T953 PolarHBondContact O-N 3.43Å; K949-T953 VanDerWaalsContact O-N 3.17Å; K949-T953 PolarHBondContact O-OG1 3.23Å; A950-T953 PolarHBondContact O-OG1 2.86Å; A950-T953 VanDerWaalsContact O-OG1 3.07Å; T953-G955 VanDerWaalsContact C-N 3.3Å; T953-G955 PolarHBondContact O-N 2.81Å
954	N	49.4	Very low	53.3	Low	142 Å²	142	109.9 Å²	109.9	76%	0.759	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-85.2	7.8	178.1	-85.7	-22.8	0	0	0	114.6	E952	E952-N954 PolarHBondContact O-N 3.1Å
955	G	54.3	Low	52.3	Low	64 Å²	64	105.9 Å²	105.9	66%	0.66	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-74.9	-25.6	-177.6	0	0	0	0	0	116.6	T953	T953-G955 VanDerWaalsContact C-N 3.3Å; T953-G955 PolarHBondContact O-N 2.81Å
956	T	43.3	Very low	51.4	Low	133 Å²	133	108 Å²	108	82%	0.816	68%	0.679	S	S	*	*	S	Bend	trans	-156.7	111.8	179.5	48	0	0	0	0	112.3
957	G	44.8	Very low	50.5	Low	82 Å²	82	117.4 Å²	117.4	85%	0.845	71%	0.708	S	S	*	*	S	Bend	trans	75.2	91.1	149.7	0	0	0	0	0	118.4
958	G	50.4	Low	50.1	Low	92 Å²	92	117.9 Å²	117.9	95%	0.948	72%	0.724	S	S	*	*			trans	52.9	76.3	137	0	0	0	0	0	119.1
959	G	41	Very low	49.5	Very low	73 Å²	73	121.4 Å²	121.4	75%	0.753	74%	0.743	S	S	*	*			trans	-158.1	119.7	162.3	0	0	0	0	0	111.2	G961	G959-G961 PolarHBondContact O-N 3.23Å
960	S	46.8	Very low	49	Very low	111 Å²	111	120.9 Å²	120.9	78%	0.776	75%	0.753	S	S	*	*			trans	-66.8	110.4	-175.4	56.9	0	0	0	0	112.9	L962	S960-L962 PolarHBondContact O-N 3.39Å
961	G	50.3	Low	48.3	Very low	79 Å²	79	125.2 Å²	125.2	81%	0.814	77%	0.774	S	S	*	*			trans	-77.8	95.2	166.3	0	0	0	0	0	110.9	G959 L963	G959-G961 PolarHBondContact O-N 3.23Å; G961-L963 PolarHBondContact O-N 3.16Å
962	L	51.7	Low	47.6	Very low	157 Å²	157	124.8 Å²	124.8	82%	0.822	78%	0.779	S	S	*	*			trans	-82.9	108.4	176	-123.7	127.2	0	0	0	109.5	S960	S960-L962 PolarHBondContact O-N 3.39Å
963	L	47.8	Very low	46.9	Very low	125 Å²	125	122.8 Å²	122.8	65%	0.654	78%	0.783	S	S	*	*			trans	-87.8	110.9	168.4	-80.5	157.6	0	0	0	109	W947 G961	W947-L963 HydrophobicContact CZ3-CD1 4.48Å; G961-L963 PolarHBondContact O-N 3.16Å
964	S	49	Very low	46.4	Very low	106 Å²	106	123.8 Å²	123.8	74%	0.741	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-77.8	117.4	176.1	164.5	0	0	0	0	110.2
965	V	40.2	Very low	46.1	Very low	101 Å²	101	122.4 Å²	122.4	61%	0.612	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-84.8	122.9	163.7	-175.4	0	0	0	0	107.1
966	K	38.9	Very low	45.5	Very low	184 Å²	184	127.3 Å²	127.3	80%	0.8	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-78.4	140.6	168.3	-100.3	-176.1	175.2	-179.6	0	108.6
967	R	41.3	Very low	45.7	Very low	284 Å²	284	126.7 Å²	126.7	100%	1.072	80%	0.804	S	S	*	*			trans	-47	0	177.3	-94.4	-175.3	178.9	174.1	-0.5	113.4

Retrieved 967 of 967 residues in 543.3 ms (Link to these results)

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