A0A087XQT0_POEFO Loading...

Diacylglycerol kinase

AlphaFold DB , UniProt , Accession A0A087XQT0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,102 aa.

						>A0A087XQT0_POEFO|A0A087XQT0
MEEWMAALRSVQNRQNYESTQYSMDHFSGMHNWYACSHARPTYCNVCREALSGVTSHGLSCEVCKFKAHKRCAVRATNNCKWTTLASIGKDIIEDEDGVSMPHQWLEGNLPVSAKCSVCDKTCGSVLRLQDWRCLWCKAMVHSGCKEQLSSKCPLGQCKVSVIPPTALNSIDSDGFWKASCPPSCTSPLLVFVNSKSGDNQGVKFLRRFKQLLNPAQVFDLMNGGPHLGLRLFQKFDTFRILVCGGDGSVGWVLSEIDALTLHKQCQMGVLPLGTGNDLARVLGWGSACDDDTQLPQILEKLERASTKMLDRWSIMVYETKFPRQHSASTVTEDCSDDSEVQQILTYEDSVAAHLTKILTSDQHSVVISSAKVLCETVKDFVARVGKAYEKNTENLEESEAMAKKCGVLKEKLDSLLKTLNEESQALTVLPPAPPPTIAEEQEELEVVSLAPLLHPAPPPHPPCSPRATPPPSAAAAIFKPREQLMLRANSLKKAIRQIIEHTEKAVDEQNAQTQQHVFSVGRSEQQVGLVEEEEEEDGEEDKSSLQSSFSSKQRSSRRLSKTPCEKLIHKGGLLPGSSASLPVHTGSRDNMPMLNTKILYPGTLTSSSVITRLLVNADPFSCDADNMDCYTEKCVMNNYFGIGLDAKITLDFNNKRDEHPEKCRSRTKNLMWYGVLGTKELLHRTYKNLEQRVLLECDGRPIPLPSLQGIAVLNIPSYAGGTNFWGGTKEDDTFTAPSFDDKILEVVAVFGSMQMAVSRVINLQHHRIAQCRTVKITVLGDEGVPVQVDGEAWIQPPGYIKIIHKNRTQTLTRDRAFESTLKSWEDKQKCEFPQPSLPPQPETVSEDEALLVSEFGQAAGALIHSIREVAQFHHSMEQELAHAVNASSKAMDVVYAKSPEALSCSSVVHMVSDVKALLSETELLLAGKMSMQLDPPQQDQLNAALGSVAQELRRLSDVPWLCPVIDPLDQEGPLADFSKRSQSGKFRLVSKFKKDKNNKNKEMCATLSLPGPRGDEGWTHEADPAGRQGADEEQQRQRGLAACRNRCPLSYYLCCLSLPRPARNHRTRPGPEPEPALRNTGQNLLQEPPGSNPEKNQSDDP
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.7	Very low	33.9	Very low	182 Å²	182	106.4 Å²	106.4	90%	0.897	54%	0.536	S	S	*	.				0	-41.4	0	-167.2	-178.2	-68.1	0	0	111	E3 W4 M5	M1-E3 PolarHBondContact O-N 2.89Å; M1-W4 WeakPolarHBondContact O-CB 3.25Å; M1-W4 PolarHBondContact O-N 2.79Å; M1-M5 PolarHBondContact O-N 3.04Å; M1-M5 VanDerWaalsContact O-N 3.16Å
2	E	28.5	Very low	33.7	Very low	158 Å²	158	108.2 Å²	108.2	74%	0.738	54%	0.541	S	S	*	.	H	α-helix	trans	-60	-39.1	-179	-69.6	157.6	133.9	0	0	113.5	W4 M5 A6	E2-W4 PolarHBondContact O-N 3.21Å; E2-M5 CarbonylContact O-C 3.59Å; E2-M5 WeakPolarHBondContact O-CA 2.98Å; E2-M5 PolarHBondContact O-N 3.31Å; E2-A6 WeakPolarHBondContact O-CB 3.48Å; E2-A6 PolarHBondContact O-N 3.4Å
3	E	32.8	Very low	33.5	Very low	168 Å²	168	108.2 Å²	108.2	79%	0.785	54%	0.544	S	S	*	.	H	α-helix	trans	-55.1	-36.5	171.2	-62.3	175.7	117.8	0	0	113.3	M1 A6 A7	M1-E3 PolarHBondContact O-N 2.89Å; E3-A6 PolarHBondContact O-N 3.14Å; E3-A7 WeakPolarHBondContact O-CB 3.32Å; E3-A7 PolarHBondContact O-N 3.41Å
4	W	35.7	Very low	34	Very low	153 Å²	153	106.1 Å²	106.1	58%	0.58	53%	0.526	S	S	*	.	H	α-helix	trans	-72.9	-33.5	177.7	-165.5	82	0	0	0	111.4	M1 E2 L8	M1-W4 WeakPolarHBondContact O-CB 3.25Å; M1-W4 PolarHBondContact O-N 2.79Å; E2-W4 PolarHBondContact O-N 3.21Å; W4-L8 HydrophobicContact CD2-CD1 4.09Å; W4-L8 HydrophobicContact CE3-CD1 3.63Å; W4-L8 HydrophobicContact CH2-CD1 3.9Å; W4-L8 HydrophobicContact CZ2-CD1 4.3Å; W4-L8 HydrophobicContact CZ3-CD1 3.53Å; W4-L8 WeakPolarHBondContact O-CB 3.33Å; W4-L8 PolarHBondContact O-N 3.04Å
5	M	31.6	Very low	33.8	Very low	77 Å²	77	109.9 Å²	109.9	38%	0.379	54%	0.542	S	S	.	.	H	α-helix	trans	-74.4	-28.6	169.1	-74.4	-149.8	-77.5	0	0	113.1	M1 E2 R9	M1-M5 PolarHBondContact O-N 3.04Å; M1-M5 VanDerWaalsContact O-N 3.16Å; E2-M5 CarbonylContact O-C 3.59Å; E2-M5 WeakPolarHBondContact O-CA 2.98Å; E2-M5 PolarHBondContact O-N 3.31Å; M5-R9 WeakPolarHBondContact O-CB 3.15Å; M5-R9 WeakPolarHBondContact O-CG 3.21Å; M5-R9 PolarHBondContact O-N 3.22Å
6	A	33.1	Very low	33.6	Very low	56 Å²	56	112.2 Å²	112.2	46%	0.463	56%	0.557	S	S	.	*	H	α-helix	trans	-73.7	-42.5	175.1	0	0	0	0	0	110.7	E2 E3 L8 R9 S10	E2-A6 WeakPolarHBondContact O-CB 3.48Å; E2-A6 PolarHBondContact O-N 3.4Å; E3-A6 PolarHBondContact O-N 3.14Å; A6-L8 VanDerWaalsContact C-N 3.31Å; A6-L8 PolarHBondContact O-N 3.1Å; A6-R9 CarbonylContact O-C 3.59Å; A6-R9 PolarHBondContact O-N 3.5Å; A6-S10 PolarHBondContact O-N 2.84Å; A6-S10 PolarHBondContact O-OG 3.21Å
7	A	34.3	Very low	33.3	Very low	28 Å²	28	115.4 Å²	115.4	23%	0.231	56%	0.563	C	S	.	*	H	α-helix	trans	-64.5	-33.1	170.8	0	0	0	0	0	112.6	E3 S10 V11 V74	E3-A7 WeakPolarHBondContact O-CB 3.32Å; E3-A7 PolarHBondContact O-N 3.41Å; A7-S10 PolarHBondContact O-OG 2.95Å; A7-S10 VanDerWaalsContact O-OG 3.13Å; A7-V11 VanDerWaalsContact O-CG2 3.3Å; A7-V11 WeakPolarHBondContact O-CG2 3.22Å; A7-V11 PolarHBondContact O-N 3.06Å; A7-V74 HydrophobicContact CB-CG2 4.07Å
8	L	34.7	Very low	33	Very low	42 Å²	42	117.1 Å²	117.1	22%	0.22	57%	0.569	C	S	.	*	H	α-helix	trans	-70	-45.1	169.7	-90.6	162.1	0	0	0	111.8	W4 A6 S10 V11 Q12	W4-L8 HydrophobicContact CD2-CD1 4.09Å; W4-L8 HydrophobicContact CE3-CD1 3.63Å; W4-L8 HydrophobicContact CH2-CD1 3.9Å; W4-L8 HydrophobicContact CZ2-CD1 4.3Å; W4-L8 HydrophobicContact CZ3-CD1 3.53Å; W4-L8 WeakPolarHBondContact O-CB 3.33Å; W4-L8 PolarHBondContact O-N 3.04Å; A6-L8 VanDerWaalsContact C-N 3.31Å; A6-L8 PolarHBondContact O-N 3.1Å; L8-S10 VanDerWaalsContact C-N 3.35Å; L8-S10 PolarHBondContact O-N 3.41Å; L8-V11 CarbonylContact O-C 3.4Å; L8-V11 PolarHBondContact O-N 2.97Å; L8-Q12 WeakPolarHBondContact O-CB 3.45Å; L8-Q12 PolarHBondContact O-N 2.9Å
9	R	35.5	Very low	32.8	Very low	142 Å²	142	116.7 Å²	116.7	54%	0.536	58%	0.58	S	S	.	*	H	α-helix	trans	-64.1	-34.1	176.5	-72.8	168.6	-150.1	-129.9	6.1	112.5	M5 A6 V11 Q12 N13	M5-R9 WeakPolarHBondContact O-CB 3.15Å; M5-R9 WeakPolarHBondContact O-CG 3.21Å; M5-R9 PolarHBondContact O-N 3.22Å; A6-R9 CarbonylContact O-C 3.59Å; A6-R9 PolarHBondContact O-N 3.5Å; R9-V11 VanDerWaalsContact C-N 3.34Å; R9-Q12 PolarHBondContact O-N 3.27Å; R9-N13 WeakPolarHBondContact O-CA 3.23Å; R9-N13 WeakPolarHBondContact O-CB 3.45Å; R9-N13 PolarHBondContact O-N 3.29Å
10	S	36.2	Very low	32.7	Very low	76 Å²	76	117 Å²	117	53%	0.531	59%	0.588	S	S	.	*	H	α-helix	trans	-70.1	-31	174.6	66.4	0	0	0	0	112.8	A6 A7 L8	A6-S10 PolarHBondContact O-N 2.84Å; A6-S10 PolarHBondContact O-OG 3.21Å; A7-S10 PolarHBondContact O-OG 2.95Å; A7-S10 VanDerWaalsContact O-OG 3.13Å; L8-S10 VanDerWaalsContact C-N 3.35Å; L8-S10 PolarHBondContact O-N 3.41Å
11	V	38	Very low	32.6	Very low	88 Å²	88	117.7 Å²	117.7	53%	0.533	59%	0.59	S	S	.	*	H	α-helix	trans	-78.5	-24.8	172.7	172.6	0	0	0	0	112.5	A7 L8 R9	A7-V11 VanDerWaalsContact O-CG2 3.3Å; A7-V11 WeakPolarHBondContact O-CG2 3.22Å; A7-V11 PolarHBondContact O-N 3.06Å; L8-V11 CarbonylContact O-C 3.4Å; L8-V11 PolarHBondContact O-N 2.97Å; R9-V11 VanDerWaalsContact C-N 3.34Å
12	Q	31.8	Very low	32.9	Very low	128 Å²	128	112.5 Å²	112.5	60%	0.598	56%	0.561	S	S	*	*	H	α-helix	trans	-110.8	-29.3	-168.5	-162	166.1	-3.9	0	0	114.4	L8 R9 R14	L8-Q12 WeakPolarHBondContact O-CB 3.45Å; L8-Q12 PolarHBondContact O-N 2.9Å; R9-Q12 PolarHBondContact O-N 3.27Å; Q12-R14 VanDerWaalsContact C-N 3.28Å
13	N	30.6	Very low	33.6	Very low	109 Å²	109	106.6 Å²	106.6	58%	0.583	54%	0.537	S	S	*	.	S	Bend	trans	-76	-14.3	171.5	-70.8	12.7	0	0	0	112.6	R9 Q15 N16	R9-N13 WeakPolarHBondContact O-CA 3.23Å; R9-N13 WeakPolarHBondContact O-CB 3.45Å; R9-N13 PolarHBondContact O-N 3.29Å; N13-Q15 PolarHBondContact O-N 2.92Å; N13-N16 PolarHBondContact O-N 3.41Å; N13-N16 VanDerWaalsContact O-N 3.08Å
14	R	40.9	Very low	34.1	Very low	78 Å²	78	105.9 Å²	105.9	29%	0.294	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	23	175.8	-120.6	-174.4	-173.5	-166.5	11	113.9	Q12 Y22 D25 M30	Q12-R14 VanDerWaalsContact C-N 3.28Å; R14-Y22 WeakPolarHBondContact O-CE2 3.32Å; R14-Y22 PolarHBondContact O-OH 2.86Å; R14-D25 IonicContact CZ-OD2 2.76Å; R14-D25 IonicContact NE-OD2 3.96Å; R14-D25 IonicContact NH2-OD1 3.88Å; R14-D25 PolarHBondContact NH2-OD1 3.22Å; R14-D25 IonicContact NH2-OD2 2.88Å; R14-D25 PolarHBondContact NH2-OD2 3.17Å; R14-M30 PolarHBondContact NH2-SD 2.76Å
15	Q	30.4	Very low	34.5	Very low	164 Å²	164	102 Å²	102	77%	0.766	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108	-23.4	170.4	-62.3	-169.3	-41.8	0	0	112.4	N13	N13-Q15 PolarHBondContact O-N 2.92Å
16	N	31.1	Very low	35.3	Very low	146 Å²	146	101.9 Å²	101.9	78%	0.781	52%	0.524	S	S	*	.	S	Bend	trans	-128.3	78.8	-177.1	-67.7	6	0	0	0	110.2	N13	N13-N16 PolarHBondContact O-N 3.41Å; N13-N16 VanDerWaalsContact O-N 3.08Å
17	Y	28.4	Very low	36.5	Very low	166 Å²	166	100.4 Å²	100.4	65%	0.651	51%	0.507	S	S	*	.	S	Bend	trans	-147.8	155.5	169.8	-141.5	-100.9	0	0	0	110.2
18	E	28.1	Very low	37.5	Very low	146 Å²	146	101.8 Å²	101.8	68%	0.682	52%	0.515	S	S	*	.			trans	-63.6	140.8	-164.2	-63	179.6	131.6	0	0	114	T20 Q21 Y22	E18-T20 PolarHBondContact O-N 3.38Å; E18-Q21 PolarHBondContact O-N 2.75Å; E18-Y22 PolarHBondContact O-N 2.71Å
19	S	29.7	Very low	39.1	Very low	110 Å²	110	100.5 Å²	100.5	77%	0.769	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-29.6	-170.8	-49.9	0	0	0	0	114.4
20	T	29.2	Very low	41.2	Very low	122 Å²	122	97 Å²	97	75%	0.748	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-43.8	-176.2	-31.6	0	0	0	0	112.5	E18 S23	E18-T20 PolarHBondContact O-N 3.38Å; T20-S23 WeakPolarHBondContact O-CB 3.22Å
21	Q	31.1	Very low	43.5	Very low	132 Å²	132	93.9 Å²	93.9	62%	0.617	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-26.2	179.8	-80.1	-168.6	-2.2	0	0	113.1	E18 S23	E18-Q21 PolarHBondContact O-N 2.75Å; Q21-S23 PolarHBondContact O-N 3.31Å; Q21-S23 VanDerWaalsContact O-N 3.1Å
22	Y	38.9	Very low	45.7	Very low	74 Å²	74	92.5 Å²	92.5	29%	0.29	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-21.7	175.2	-145.7	-90.3	0	0	0	113.1	R14 E18	R14-Y22 WeakPolarHBondContact O-CE2 3.32Å; R14-Y22 PolarHBondContact O-OH 2.86Å; E18-Y22 PolarHBondContact O-N 2.71Å
23	S	44.3	Very low	48.4	Very low	34 Å²	34	88.7 Å²	88.7	24%	0.238	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-47.1	-176.2	-168.4	0	0	0	0	113.6	T20 Q21 F27	T20-S23 WeakPolarHBondContact O-CB 3.22Å; Q21-S23 PolarHBondContact O-N 3.31Å; Q21-S23 VanDerWaalsContact O-N 3.1Å; S23-F27 WeakPolarHBondContact O-CD2 3.41Å; S23-F27 WeakPolarHBondContact O-CE2 3.48Å
24	M	41.7	Very low	51	Low	152 Å²	152	85.8 Å²	85.8	75%	0.749	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-75.2	-34.6	-176.6	-58.7	-167	84.7	0	0	112.4	H26 F27 S28	M24-H26 PolarHBondContact O-N 3.19Å; M24-F27 PolarHBondContact O-N 2.86Å; M24-F27 VanDerWaalsContact O-N 3.12Å; M24-S28 PolarHBondContact O-N 3.2Å
25	D	44.1	Very low	53.2	Low	71 Å²	71	86.1 Å²	86.1	38%	0.38	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-70.6	-10.7	-175.4	-129.6	-7.5	0	0	0	113.6	R14 S28	R14-D25 IonicContact CZ-OD2 2.76Å; R14-D25 IonicContact NE-OD2 3.96Å; R14-D25 IonicContact NH2-OD1 3.88Å; R14-D25 PolarHBondContact NH2-OD1 3.22Å; R14-D25 IonicContact NH2-OD2 2.88Å; R14-D25 PolarHBondContact NH2-OD2 3.17Å; D25-S28 PolarHBondContact O-OG 2.99Å
26	H	49.9	Very low	55.6	Low	75 Å²	75	79.2 Å²	79.2	35%	0.347	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-85.1	-16.3	175	-150	-135	0	0	0	113.2	M24 K210	M24-H26 PolarHBondContact O-N 3.19Å; H26-K210 VanDerWaalsContact CE1-CE 3.43Å; H26-K210 WeakPolarHBondContact CE1-CE 3.11Å; H26-K210 PolarHBondContact CE1-NZ 3.32Å; H26-K210 PolarHBondContact NE2-NZ 3.16Å
27	F	57.1	Low	57.9	Low	25 Å²	25	75.6 Å²	75.6	11%	0.11	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-6.8	-177.7	-52.5	-53.3	0	0	0	113.8	S23 M24 G29 T83 I171 W177 A216	S23-F27 WeakPolarHBondContact O-CD2 3.41Å; S23-F27 WeakPolarHBondContact O-CE2 3.48Å; M24-F27 PolarHBondContact O-N 2.86Å; M24-F27 VanDerWaalsContact O-N 3.12Å; F27-G29 PolarHBondContact O-N 2.74Å; F27-T83 HydrophobicContact CD1-CG2 4.24Å; F27-T83 PolarHBondContact O-OG1 3.02Å; F27-T83 VanDerWaalsContact O-OG1 3.11Å; F27-I171 HydrophobicContact CD2-CD1 4.37Å; F27-I171 HydrophobicContact CE2-CD1 4.14Å; F27-W177 HydrophobicContact CD2-CH2 4.4Å; F27-W177 HydrophobicContact CE1-CZ2 4.37Å; F27-W177 HydrophobicContact CE2-CH2 4.48Å; F27-W177 HydrophobicContact CE2-CZ2 4.33Å; F27-W177 HydrophobicContact CG-CH2 4.5Å; F27-W177 HydrophobicContact CZ-CZ2 4.18Å; F27-A216 HydrophobicContact CD1-CB 4.37Å; F27-A216 HydrophobicContact CE1-CB 3.95Å
28	S	56.7	Low	60.1	Low	57 Å²	57	69.2 Å²	69.2	40%	0.399	38%	0.382	S	S	.	.	S	Bend	trans	-72.5	18	-171.3	60.6	0	0	0	0	116.6	M24 D25 M30	M24-S28 PolarHBondContact O-N 3.2Å; D25-S28 PolarHBondContact O-OG 2.99Å; S28-M30 PolarHBondContact O-N 2.88Å; S28-M30 VanDerWaalsContact O-N 3.11Å; S28-M30 WeakPolarHBondContact OG-CG 3.31Å
29	G	67.1	Low	62	Low	15 Å²	15	67.4 Å²	67.4	16%	0.155	39%	0.392	C	S	.	.	S	Bend	trans	67.3	5.9	-177.2	0	0	0	0	0	115.3	F27 N78 C80	F27-G29 PolarHBondContact O-N 2.74Å; G29-N78 CarbonylContact O-C 3.55Å; G29-C80 WeakPolarHBondContact O-CB 3.39Å; G29-C80 PolarHBondContact O-N 2.66Å
30	M	79.9	Confident	64.2	Low	69 Å²	69	69.7 Å²	69.7	34%	0.34	38%	0.384	S	S	.	.			trans	-71.7	151.7	178.3	-70.1	-179.2	72.2	0	0	113.2	R14 S28 C80	R14-M30 PolarHBondContact NH2-SD 2.76Å; S28-M30 PolarHBondContact O-N 2.88Å; S28-M30 VanDerWaalsContact O-N 3.11Å; S28-M30 WeakPolarHBondContact OG-CG 3.31Å; M30-C80 VanDerWaalsContact O-CB 3.27Å; M30-C80 WeakPolarHBondContact O-CB 3.24Å; M30-C80 PolarHBondContact O-SG 2.98Å
31	H	83.8	Confident	66.5	Low	10 Å²	10	67.9 Å²	67.9	5%	0.046	37%	0.374	C	S	.	.			trans	-86.1	113.4	173.3	-63.7	-84.8	0	0	0	110.8	W33 C61 C64 F66 T77 N79	H31-W33 HydrophobicContact CB-CD2 4.26Å; H31-W33 HydrophobicContact CB-CH2 4.08Å; H31-W33 HydrophobicContact CB-CZ2 3.51Å; H31-W33 AromaticContact CG-CZ2 3.93Å; H31-W33 PolarHBondContact O-N 2.96Å; H31-W33 PolarHBondContact O-NE1 3.21Å; H31-C61 HydrophobicContact CB-CB 4.13Å; H31-C64 PolarHBondContact ND1-SG 2.95Å; H31-F66 AromaticContact CE1-CD2 3.93Å; H31-F66 AromaticContact CE1-CG 3.95Å; H31-T77 PolarHBondContact CD2-O 3.2Å; H31-T77 PolarHBondContact NE2-O 2.89Å; H31-N79 PolarHBondContact NE2-OD1 2.93Å
32	N	85.8	Confident	69.2	Low	60 Å²	60	61.8 Å²	61.8	32%	0.321	35%	0.346	S	S	.	.			trans	-77.8	120.7	166.9	-165.9	30.7	0	0	0	110.2	C61 E62	N32-C61 CarbonylContact O-C 3.55Å; N32-C61 VanDerWaalsContact O-CA 3.23Å; N32-C61 WeakPolarHBondContact O-CA 3.43Å; N32-C61 PolarHBondContact O-SG 3.4Å; N32-E62 VanDerWaalsContact ND2-CD 3.29Å; N32-E62 PolarHBondContact ND2-OE2 3.44Å; N32-E62 PolarHBondContact O-N 3.14Å
33	W	87.4	Confident	71.6	Confident	47 Å²	47	59.9 Å²	59.9	18%	0.178	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	137.8	-170.7	-60.5	104.2	0	0	0	112.9	H31 L59 C61 F66 A68 A73 A76	H31-W33 HydrophobicContact CB-CD2 4.26Å; H31-W33 HydrophobicContact CB-CH2 4.08Å; H31-W33 HydrophobicContact CB-CZ2 3.51Å; H31-W33 AromaticContact CG-CZ2 3.93Å; H31-W33 PolarHBondContact O-N 2.96Å; H31-W33 PolarHBondContact O-NE1 3.21Å; W33-L59 HydrophobicContact CB-CB 4.42Å; W33-L59 HydrophobicContact CB-CD1 4.41Å; W33-L59 HydrophobicContact CD2-CB 4.34Å; W33-L59 HydrophobicContact CE3-CB 3.79Å; W33-L59 HydrophobicContact CZ3-CB 4.5Å; W33-C61 HydrophobicContact CE3-CB 4.46Å; W33-C61 HydrophobicContact CZ3-CB 4.38Å; W33-F66 AromaticContact CH2-CD1 3.64Å; W33-F66 HydrophobicContact CH2-CD1 3.64Å; W33-F66 HydrophobicContact CH2-CE1 4.08Å; W33-F66 HydrophobicContact CZ3-CD1 4.14Å; W33-A68 HydrophobicContact CH2-CB 4.01Å; W33-A68 HydrophobicContact CZ3-CB 4.04Å; W33-A73 HydrophobicContact CD2-CB 4.02Å; W33-A73 HydrophobicContact CE3-CB 4.48Å; W33-A73 HydrophobicContact CG-CB 4.48Å; W33-A73 HydrophobicContact CH2-CB 4.38Å; W33-A73 HydrophobicContact CZ2-CB 3.91Å; W33-A76 HydrophobicContact CH2-CB 4.1Å; W33-A76 HydrophobicContact CZ2-CB 3.71Å
34	Y	86.4	Confident	73.8	Confident	48 Å²	48	58.3 Å²	58.3	19%	0.188	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	147.4	165.5	75	-77	0	0	0	111.1	C36 L59 S60 E62 K65	Y34-C36 HydrophobicContact CD2-CB 4.25Å; Y34-C36 HydrophobicContact CE2-CB 3.8Å; Y34-L59 WeakPolarHBondContact O-CA 3.29Å; Y34-S60 WeakPolarHBondContact CD1-O 3.36Å; Y34-S60 WeakPolarHBondContact CE1-O 3.38Å; Y34-S60 PolarHBondContact N-O 3.34Å; Y34-S60 PolarHBondContact O-N 2.85Å; Y34-E62 HydrophobicContact CD1-CB 4.41Å; Y34-E62 HydrophobicContact CD1-CG 3.57Å; Y34-E62 HydrophobicContact CE1-CG 4.28Å; Y34-E62 HydrophobicContact CG-CG 4.31Å; Y34-K65 PolarHBondContact OH-NZ 2.96Å
35	A	85.9	Confident	76.2	Confident	85 Å²	85	52 Å²	52	70%	0.702	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	134.7	174.3	0	0	0	0	0	110.7	L59	A35-L59 HydrophobicContact CB-CD2 4.28Å
36	C	81.2	Confident	78.4	Confident	19 Å²	19	50.6 Å²	50.6	13%	0.128	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	143.1	178.9	54.3	0	0	0	0	111.7	Y34 H38 G58 S60	Y34-C36 HydrophobicContact CD2-CB 4.25Å; Y34-C36 HydrophobicContact CE2-CB 3.8Å; C36-H38 PolarHBondContact SG-CE1 2.81Å; C36-G58 PolarHBondContact N-O 2.83Å; C36-G58 PolarHBondContact O-N 2.85Å; C36-S60 VanDerWaalsContact SG-CB 3.52Å
37	S	78.7	Confident	80.4	Confident	71 Å²	71	49.3 Å²	49.3	50%	0.497	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	148.7	158.6	46.5	0	0	0	0	109.7	T55 S56	S37-T55 WeakPolarHBondContact CB-OG1 3.46Å; S37-S56 WeakPolarHBondContact CA-O 3.49Å
38	H	75.3	Confident	81.9	Confident	32 Å²	32	54.7 Å²	54.7	15%	0.148	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	134.7	163.3	-37.8	-73.4	0	0	0	111.5	C36 R40 S56 K67	C36-H38 PolarHBondContact SG-CE1 2.81Å; H38-R40 PolarHBondContact O-N 2.81Å; H38-S56 WeakPolarHBondContact CA-OG 3.41Å; H38-S56 VanDerWaalsContact CB-OG 3.26Å; H38-S56 WeakPolarHBondContact CB-OG 3.38Å; H38-S56 PolarHBondContact N-O 2.81Å; H38-S56 PolarHBondContact N-OG 3.19Å; H38-S56 PolarHBondContact O-N 3.18Å; H38-S56 PolarHBondContact O-OG 3.26Å; H38-K67 PolarHBondContact CE1-NZ 3.25Å; H38-K67 VanDerWaalsContact CE1-NZ 3.34Å; H38-K67 PolarHBondContact ND1-NZ 3.32Å; H38-K67 PolarHBondContact NE2-NZ 2.79Å
39	A	69.1	Low	83.5	Confident	108 Å²	108	56.4 Å²	56.4	89%	0.893	31%	0.311	S	S	*	.	S	Bend	trans	-79.8	14.3	176.5	0	0	0	0	0	113.7
40	R	75.2	Confident	84.4	Confident	158 Å²	158	57.9 Å²	57.9	60%	0.596	32%	0.322	S	S	*	.	S	Bend	trans	-142.8	147.5	179.3	-66.8	-175.6	179.7	167.9	-0.3	109.7	H38 T42	H38-R40 PolarHBondContact O-N 2.81Å; R40-T42 PolarHBondContact O-N 3.13Å; R40-T42 PolarHBondContact O-OG1 2.78Å
41	P	77.7	Confident	84.7	Confident	83 Å²	83	55 Å²	55	54%	0.539	31%	0.307	S	S	.	.			trans	-45.9	127.6	170.7	-28.9	36.3	0	0	0	110.8	Y43 V126	P41-Y43 HydrophobicContact CB-CE2 4.4Å; P41-V126 HydrophobicContact CB-CG1 4.02Å; P41-V126 HydrophobicContact CG-CG1 3.9Å
42	T	87.1	Confident	83.8	Confident	5 Å²	5	59.2 Å²	59.2	3%	0.031	34%	0.338	C	S	.	.			trans	-143.7	141.6	-170.6	-69.7	0	0	0	0	108.3	R40 L51 K67	R40-T42 PolarHBondContact O-N 3.13Å; R40-T42 PolarHBondContact O-OG1 2.78Å; T42-L51 HydrophobicContact CG2-CD1 3.58Å; T42-L51 HydrophobicContact CG2-CG 4.24Å; T42-L51 PolarHBondContact O-N 2.99Å; T42-K67 HydrophobicContact CG2-CD 3.22Å; T42-K67 PolarHBondContact OG1-NZ 3.02Å
43	Y	90	Very high	82.7	Confident	34 Å²	34	59 Å²	59	13%	0.133	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-118.6	146.2	-172.1	-64.1	-96.2	0	0	0	111.7	P41 R48 E49 A50 N109 V126 L127	P41-Y43 HydrophobicContact CB-CE2 4.4Å; Y43-R48 WeakPolarHBondContact CD1-O 3.39Å; Y43-E49 WeakPolarHBondContact CA-O 3.45Å; Y43-A50 HydrophobicContact CD1-CB 4.13Å; Y43-A50 HydrophobicContact CE1-CB 3.87Å; Y43-N109 PolarHBondContact N-OD1 3.13Å; Y43-N109 VanDerWaalsContact N-OD1 3.1Å; Y43-N109 PolarHBondContact O-ND2 3.38Å; Y43-V126 WeakPolarHBondContact CE2-O 3.32Å; Y43-V126 PolarHBondContact OH-O 2.81Å; Y43-L127 WeakPolarHBondContact CE1-O 3.18Å; Y43-L127 VanDerWaalsContact CZ-O 3.24Å; Y43-L127 WeakPolarHBondContact OH-CA 3.35Å; Y43-L127 PolarHBondContact OH-O 2.92Å
44	C	90.9	Very high	80.9	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	39%	0.389	C	S	.	.			trans	-75.1	120.2	178.2	177.5	0	0	0	0	110.2	V46 C47 R48 E49 L51 H69	C44-V46 PolarHBondContact O-N 2.98Å; C44-C47 VanDerWaalsContact CB-SG 3.54Å; C44-C47 PolarHBondContact SG-SG 2.6Å; C44-R48 WeakPolarHBondContact O-CA 3.45Å; C44-R48 PolarHBondContact O-N 2.77Å; C44-E49 PolarHBondContact N-O 2.91Å; C44-L51 HydrophobicContact CB-CD2 4Å; C44-H69 VanDerWaalsContact CB-CE1 3.45Å; C44-H69 WeakPolarHBondContact CB-CE1 3.37Å; C44-H69 WeakPolarHBondContact CB-ND1 3.48Å; C44-H69 PolarHBondContact SG-ND1 3.36Å; C44-H69 VanDerWaalsContact SG-ND1 3.38Å
45	N	91.1	Very high	79.4	Confident	21 Å²	21	64.9 Å²	64.9	11%	0.112	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-6.3	178.5	-76.3	105.2	0	0	0	114.1	F66 K67 E107 N109	N45-F66 HydrophobicContact CB-CD1 3.79Å; N45-F66 HydrophobicContact CB-CD2 3.99Å; N45-F66 HydrophobicContact CB-CE1 3.49Å; N45-F66 VanDerWaalsContact CB-CE1 3.49Å; N45-F66 HydrophobicContact CB-CE2 3.69Å; N45-F66 HydrophobicContact CB-CG 4.03Å; N45-F66 HydrophobicContact CB-CZ 3.43Å; N45-F66 VanDerWaalsContact CB-CZ 3.43Å; N45-K67 WeakPolarHBondContact CB-O 3.45Å; N45-K67 PolarHBondContact N-O 2.85Å; N45-K67 PolarHBondContact OD1-N 2.92Å; N45-K67 VanDerWaalsContact OD1-N 3.08Å; N45-E107 PolarHBondContact ND2-O 3.34Å; N45-N109 PolarHBondContact OD1-ND2 2.97Å
46	V	90.9	Very high	78.3	Confident	41 Å²	41	61.2 Å²	61.2	25%	0.248	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-57.3	177	-172.4	0	0	0	0	112.1	C44 F66 A68 C72 R75 A76	C44-V46 PolarHBondContact O-N 2.98Å; V46-F66 HydrophobicContact CG2-CE1 3.76Å; V46-F66 HydrophobicContact CG2-CZ 3.95Å; V46-A68 HydrophobicContact CG2-CB 4.33Å; V46-C72 HydrophobicContact CB-CB 3.94Å; V46-C72 HydrophobicContact CG1-CB 4.34Å; V46-C72 HydrophobicContact CG2-CB 4.05Å; V46-R75 HydrophobicContact CG1-CB 4.33Å; V46-A76 HydrophobicContact CG2-CB 4.31Å
47	C	90.5	Very high	77.9	Confident	47 Å²	47	66.3 Å²	66.3	32%	0.318	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-3.2	-177.2	60	0	0	0	0	114.4	C44 E49 H69	C44-C47 VanDerWaalsContact CB-SG 3.54Å; C44-C47 PolarHBondContact SG-SG 2.6Å; C47-E49 HydrophobicContact CB-CG 4.21Å; C47-E49 PolarHBondContact O-N 2.79Å; C47-E49 PolarHBondContact SG-OE2 2.86Å; C47-H69 PolarHBondContact SG-CE1 2.75Å; C47-H69 PolarHBondContact SG-ND1 2.86Å
48	R	90.3	Very high	78.3	Confident	139 Å²	139	63.5 Å²	63.5	53%	0.525	37%	0.369	S	S	.	.			trans	63.4	-5.7	-177.7	-53.8	178.6	169.7	-100.7	-13.2	115.7	Y43 C44 E107 L129	Y43-R48 WeakPolarHBondContact CD1-O 3.39Å; C44-R48 WeakPolarHBondContact O-CA 3.45Å; C44-R48 PolarHBondContact O-N 2.77Å; R48-E107 IonicContact CZ-OE1 3.03Å; R48-E107 IonicContact CZ-OE2 3.36Å; R48-E107 IonicContact NH1-OE1 2.7Å; R48-E107 PolarHBondContact NH1-OE1 3.06Å; R48-E107 IonicContact NH1-OE2 2.69Å; R48-E107 PolarHBondContact NH1-OE2 2.94Å; R48-E107 VanDerWaalsContact NH2-CD 3.34Å; R48-E107 IonicContact NH2-OE1 3.14Å; R48-E107 PolarHBondContact NH2-OE1 3.25Å; R48-E107 IonicContact NH2-OE2 2.74Å; R48-E107 PolarHBondContact NH2-OE2 3.44Å; R48-L129 HydrophobicContact CG-CD1 4.28Å
49	E	89.3	Confident	78.9	Confident	93 Å²	93	63.5 Å²	63.5	44%	0.435	37%	0.37	S	S	.	.			trans	-66	160.2	171.7	-53.3	168.6	132.1	0	0	112.3	Y43 C44 C47 H69 R71	Y43-E49 WeakPolarHBondContact CA-O 3.45Å; C44-E49 PolarHBondContact N-O 2.91Å; C47-E49 HydrophobicContact CB-CG 4.21Å; C47-E49 PolarHBondContact O-N 2.79Å; C47-E49 PolarHBondContact SG-OE2 2.86Å; E49-H69 IonicContact OE2-CE1 2.69Å; E49-R71 IonicContact OE1-NH2 3.95Å; E49-R71 PolarHBondContact OE1-NH2 3.3Å; E49-R71 IonicContact OE2-CZ 2.71Å; E49-R71 IonicContact OE2-NH2 3.32Å; E49-R71 PolarHBondContact OE2-NH2 2.81Å
50	A	86.8	Confident	79.9	Confident	46 Å²	46	58.4 Å²	58.4	38%	0.38	33%	0.328	S	S	.	.	B	Isolated β-bridge	trans	-68.4	147.5	172.5	0	0	0	0	0	112.6	Y43 S52 H69	Y43-A50 HydrophobicContact CD1-CB 4.13Å; Y43-A50 HydrophobicContact CE1-CB 3.87Å; A50-S52 PolarHBondContact O-N 3.29Å; A50-H69 PolarHBondContact O-NE2 2.87Å
51	L	84.7	Confident	80.6	Confident	7 Å²	7	50.9 Å²	50.9	4%	0.037	30%	0.3	C	S	.	.			trans	-79.1	103.3	163.8	-58.5	-177.6	0	0	0	107.9	T42 C44 S56 H69	T42-L51 HydrophobicContact CG2-CD1 3.58Å; T42-L51 HydrophobicContact CG2-CG 4.24Å; T42-L51 PolarHBondContact O-N 2.99Å; C44-L51 HydrophobicContact CB-CD2 4Å; L51-S56 WeakPolarHBondContact O-CB 3.41Å; L51-H69 HydrophobicContact CD2-CB 4.49Å
52	S	65.4	Low	81	Confident	99 Å²	99	47.8 Å²	47.8	69%	0.692	28%	0.278	S	S	*	.			trans	-86.9	153.4	-173.7	48.8	0	0	0	0	113.6	A50	A50-S52 PolarHBondContact O-N 3.29Å
53	G	62.3	Low	81.1	Confident	56 Å²	56	48.4 Å²	48.4	58%	0.577	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	141.8	162.7	176.6	0	0	0	0	0	113	T55	G53-T55 CarbonylContact C-O 3.57Å; G53-T55 VanDerWaalsContact CA-O 3.31Å; G53-T55 WeakPolarHBondContact CA-O 3.35Å; G53-T55 CarbonylContact O-C 3.18Å; G53-T55 PolarHBondContact O-N 2.8Å
54	V	50.2	Low	81.1	Confident	164 Å²	164	46.9 Å²	46.9	99%	0.994	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-29.5	176.6	179.2	0	0	0	0	111.5
55	T	55.8	Low	81	Confident	55 Å²	55	49.6 Å²	49.6	34%	0.337	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	150.2	144.1	78.9	0	0	0	0	108	S37 G53 H57	S37-T55 WeakPolarHBondContact CB-OG1 3.46Å; G53-T55 CarbonylContact C-O 3.57Å; G53-T55 VanDerWaalsContact CA-O 3.31Å; G53-T55 WeakPolarHBondContact CA-O 3.35Å; G53-T55 CarbonylContact O-C 3.18Å; G53-T55 PolarHBondContact O-N 2.8Å; T55-H57 PolarHBondContact O-CD2 3.35Å; T55-H57 PolarHBondContact O-N 3.32Å; T55-H57 PolarHBondContact OG1-CE1 2.89Å; T55-H57 PolarHBondContact OG1-NE2 2.87Å
56	S	61.3	Low	80.9	Confident	7 Å²	7	49.3 Å²	49.3	5%	0.049	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	93	-178.8	55.7	0	0	0	0	110.6	S37 H38 L51	S37-S56 WeakPolarHBondContact CA-O 3.49Å; H38-S56 WeakPolarHBondContact CA-OG 3.41Å; H38-S56 VanDerWaalsContact CB-OG 3.26Å; H38-S56 WeakPolarHBondContact CB-OG 3.38Å; H38-S56 PolarHBondContact N-O 2.81Å; H38-S56 PolarHBondContact N-OG 3.19Å; H38-S56 PolarHBondContact O-N 3.18Å; H38-S56 PolarHBondContact O-OG 3.26Å; L51-S56 WeakPolarHBondContact O-CB 3.41Å
57	H	74.4	Confident	80.9	Confident	127 Å²	127	48.7 Å²	48.7	59%	0.588	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	120.3	-177.5	-66.7	-80.3	0	0	0	110.8	T55	T55-H57 PolarHBondContact O-CD2 3.35Å; T55-H57 PolarHBondContact O-N 3.32Å; T55-H57 PolarHBondContact OG1-CE1 2.89Å; T55-H57 PolarHBondContact OG1-NE2 2.87Å
58	G	85.1	Confident	81	Confident	11 Å²	11	46.5 Å²	46.5	11%	0.113	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	-178	176.2	0	0	0	0	0	113	C36	C36-G58 PolarHBondContact N-O 2.83Å; C36-G58 PolarHBondContact O-N 2.85Å
59	L	88.4	Confident	80.9	Confident	32 Å²	32	41 Å²	41	17%	0.168	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	136.4	166	-61.7	178.5	0	0	0	108.4	W33 Y34 A35 K67 A68 A73	W33-L59 HydrophobicContact CB-CB 4.42Å; W33-L59 HydrophobicContact CB-CD1 4.41Å; W33-L59 HydrophobicContact CD2-CB 4.34Å; W33-L59 HydrophobicContact CE3-CB 3.79Å; W33-L59 HydrophobicContact CZ3-CB 4.5Å; Y34-L59 WeakPolarHBondContact O-CA 3.29Å; A35-L59 HydrophobicContact CB-CD2 4.28Å; L59-K67 WeakPolarHBondContact O-CA 3.5Å; L59-A68 PolarHBondContact N-O 3.33Å; L59-A68 PolarHBondContact O-N 2.92Å; L59-A73 HydrophobicContact CD1-CB 3.65Å
60	S	89.6	Confident	80.8	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.014	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	145.5	167.7	-170.4	0	0	0	0	109.7	Y34 C36 F66	Y34-S60 WeakPolarHBondContact CD1-O 3.36Å; Y34-S60 WeakPolarHBondContact CE1-O 3.38Å; Y34-S60 PolarHBondContact N-O 3.34Å; Y34-S60 PolarHBondContact O-N 2.85Å; C36-S60 VanDerWaalsContact SG-CB 3.52Å; S60-F66 CarbonylContact C-O 3.6Å; S60-F66 VanDerWaalsContact CA-O 3.32Å; S60-F66 WeakPolarHBondContact CA-O 3.32Å; S60-F66 PolarHBondContact OG-O 3.32Å
61	C	90.5	Very high	80.8	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	133.9	171.6	-178.7	0	0	0	0	110.2	H31 N32 W33 V63 C64 K65 F66 C80	H31-C61 HydrophobicContact CB-CB 4.13Å; N32-C61 CarbonylContact O-C 3.55Å; N32-C61 VanDerWaalsContact O-CA 3.23Å; N32-C61 WeakPolarHBondContact O-CA 3.43Å; N32-C61 PolarHBondContact O-SG 3.4Å; W33-C61 HydrophobicContact CE3-CB 4.46Å; W33-C61 HydrophobicContact CZ3-CB 4.38Å; C61-V63 PolarHBondContact O-N 2.89Å; C61-V63 PolarHBondContact SG-N 2.8Å; C61-C64 WeakPolarHBondContact CB-SG 3.37Å; C61-K65 WeakPolarHBondContact O-CA 3.48Å; C61-K65 PolarHBondContact O-N 2.88Å; C61-F66 HydrophobicContact CB-CB 4.3Å; C61-F66 PolarHBondContact N-O 2.87Å; C61-C80 VanDerWaalsContact SG-SG 3.66Å
62	E	87.1	Confident	81	Confident	18 Å²	18	47.1 Å²	47.1	8%	0.084	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-35.3	177.5	-68.8	-165.1	146.9	0	0	113.6	N32 Y34 R207 Q211	N32-E62 VanDerWaalsContact ND2-CD 3.29Å; N32-E62 PolarHBondContact ND2-OE2 3.44Å; N32-E62 PolarHBondContact O-N 3.14Å; Y34-E62 HydrophobicContact CD1-CB 4.41Å; Y34-E62 HydrophobicContact CD1-CG 3.57Å; Y34-E62 HydrophobicContact CE1-CG 4.28Å; Y34-E62 HydrophobicContact CG-CG 4.31Å; E62-R207 HydrophobicContact CB-CG 4.05Å; E62-R207 HydrophobicContact CG-CG 4Å; E62-R207 IonicContact OE1-CZ 3.87Å; E62-R207 IonicContact OE1-NE 3.5Å; E62-R207 PolarHBondContact OE1-NE 2.78Å; E62-R207 IonicContact OE1-NH2 3.88Å; E62-R207 PolarHBondContact OE1-NH2 3.1Å; E62-Q211 WeakPolarHBondContact O-CG 3.29Å; E62-Q211 PolarHBondContact O-NE2 3.44Å
63	V	88.6	Confident	82	Confident	17 Å²	17	43 Å²	43	10%	0.103	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-58.7	-166.5	-175.7	0	0	0	0	112.4	C61 K81 K210 Q211 P215	C61-V63 PolarHBondContact O-N 2.89Å; C61-V63 PolarHBondContact SG-N 2.8Å; V63-K81 HydrophobicContact CG1-CB 3.66Å; V63-K81 HydrophobicContact CG1-CD 4.03Å; V63-K81 HydrophobicContact CG1-CG 4.46Å; V63-K210 HydrophobicContact CG1-CB 4.44Å; V63-K210 HydrophobicContact CG2-CB 4.18Å; V63-K210 HydrophobicContact CG2-CD 4.33Å; V63-Q211 WeakPolarHBondContact O-CA 3.35Å; V63-Q211 WeakPolarHBondContact O-CG 3.4Å; V63-P215 HydrophobicContact CG1-CG 3.53Å
64	C	89.1	Confident	83	Confident	3 Å²	3	45.5 Å²	45.5	2%	0.02	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-12.7	-174	63.7	0	0	0	0	113.8	H31 C61 F66 R133 L135	H31-C64 PolarHBondContact ND1-SG 2.95Å; C61-C64 WeakPolarHBondContact CB-SG 3.37Å; C64-F66 PolarHBondContact O-N 3.13Å; C64-F66 WeakPolarHBondContact SG-CB 3.42Å; C64-F66 PolarHBondContact SG-N 2.75Å; C64-F66 VanDerWaalsContact SG-N 3.39Å; C64-R133 PolarHBondContact O-NH2 2.98Å; C64-R133 VanDerWaalsContact O-NH2 3.13Å; C64-L135 HydrophobicContact CB-CD1 3.75Å; C64-L135 HydrophobicContact CB-CD2 4.06Å; C64-L135 WeakPolarHBondContact O-CD2 3.34Å
65	K	89	Confident	84.7	Confident	56 Å²	56	46.9 Å²	46.9	24%	0.243	22%	0.22	C	C	.	.			trans	59.2	23.8	-168.7	-59.1	-53.6	-150.3	-159.7	0	115.4	Y34 C61 K67 Q211	Y34-K65 PolarHBondContact OH-NZ 2.96Å; C61-K65 WeakPolarHBondContact O-CA 3.48Å; C61-K65 PolarHBondContact O-N 2.88Å; K65-K67 WeakPolarHBondContact O-CG 2.95Å; K65-Q211 HydrophobicContact CD-CG 4.49Å; K65-Q211 VanDerWaalsContact CE-CD 3.42Å; K65-Q211 HydrophobicContact CG-CG 4.31Å
66	F	90.2	Very high	86.2	Confident	16 Å²	16	45 Å²	45	7%	0.07	21%	0.21	C	C	.	.			trans	-54.3	144	160.7	-167.2	-74	0	0	0	109.2	H31 W33 N45 V46 S60 C61 C64 A76 L106	H31-F66 AromaticContact CE1-CD2 3.93Å; H31-F66 AromaticContact CE1-CG 3.95Å; W33-F66 AromaticContact CH2-CD1 3.64Å; W33-F66 HydrophobicContact CH2-CD1 3.64Å; W33-F66 HydrophobicContact CH2-CE1 4.08Å; W33-F66 HydrophobicContact CZ3-CD1 4.14Å; N45-F66 HydrophobicContact CB-CD1 3.79Å; N45-F66 HydrophobicContact CB-CD2 3.99Å; N45-F66 HydrophobicContact CB-CE1 3.49Å; N45-F66 VanDerWaalsContact CB-CE1 3.49Å; N45-F66 HydrophobicContact CB-CE2 3.69Å; N45-F66 HydrophobicContact CB-CG 4.03Å; N45-F66 HydrophobicContact CB-CZ 3.43Å; N45-F66 VanDerWaalsContact CB-CZ 3.43Å; V46-F66 HydrophobicContact CG2-CE1 3.76Å; V46-F66 HydrophobicContact CG2-CZ 3.95Å; S60-F66 CarbonylContact C-O 3.6Å; S60-F66 VanDerWaalsContact CA-O 3.32Å; S60-F66 WeakPolarHBondContact CA-O 3.32Å; S60-F66 PolarHBondContact OG-O 3.32Å; C61-F66 HydrophobicContact CB-CB 4.3Å; C61-F66 PolarHBondContact N-O 2.87Å; C64-F66 PolarHBondContact O-N 3.13Å; C64-F66 WeakPolarHBondContact SG-CB 3.42Å; C64-F66 PolarHBondContact SG-N 2.75Å; C64-F66 VanDerWaalsContact SG-N 3.39Å; F66-A76 HydrophobicContact CE1-CB 4.17Å; F66-A76 HydrophobicContact CZ-CB 4.42Å; F66-L106 HydrophobicContact CB-CD1 4.23Å; F66-L106 HydrophobicContact CD2-CD1 3.62Å; F66-L106 HydrophobicContact CE2-CD1 4.48Å; F66-L106 HydrophobicContact CG-CD1 4.31Å
67	K	90.8	Very high	87.3	Confident	28 Å²	28	48.8 Å²	48.8	12%	0.122	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	139	-176.5	-56.2	-169.8	-179.2	-170.7	0	112	H38 T42 N45 L59 K65 N109	H38-K67 PolarHBondContact CE1-NZ 3.25Å; H38-K67 VanDerWaalsContact CE1-NZ 3.34Å; H38-K67 PolarHBondContact ND1-NZ 3.32Å; H38-K67 PolarHBondContact NE2-NZ 2.79Å; T42-K67 HydrophobicContact CG2-CD 3.22Å; T42-K67 PolarHBondContact OG1-NZ 3.02Å; N45-K67 WeakPolarHBondContact CB-O 3.45Å; N45-K67 PolarHBondContact N-O 2.85Å; N45-K67 PolarHBondContact OD1-N 2.92Å; N45-K67 VanDerWaalsContact OD1-N 3.08Å; L59-K67 WeakPolarHBondContact O-CA 3.5Å; K65-K67 WeakPolarHBondContact O-CG 2.95Å; K67-N109 HydrophobicContact CD-CB 4.42Å
68	A	91.5	Very high	87.6	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	152.3	-178.4	0	0	0	0	0	112.5	W33 V46 L59 C72 A73	W33-A68 HydrophobicContact CH2-CB 4.01Å; W33-A68 HydrophobicContact CZ3-CB 4.04Å; V46-A68 HydrophobicContact CG2-CB 4.33Å; L59-A68 PolarHBondContact N-O 3.33Å; L59-A68 PolarHBondContact O-N 2.92Å; A68-C72 HydrophobicContact CB-CB 4.08Å; A68-A73 HydrophobicContact CB-CB 4.26Å
69	H	89.5	Confident	87.6	Confident	25 Å²	25	51.6 Å²	51.6	12%	0.116	25%	0.25	C	C	.	.			trans	-64.1	157.3	160.5	-53.8	95.5	0	0	0	110	C44 C47 E49 A50 L51 R71 C72 A73	C44-H69 VanDerWaalsContact CB-CE1 3.45Å; C44-H69 WeakPolarHBondContact CB-CE1 3.37Å; C44-H69 WeakPolarHBondContact CB-ND1 3.48Å; C44-H69 PolarHBondContact SG-ND1 3.36Å; C44-H69 VanDerWaalsContact SG-ND1 3.38Å; C47-H69 PolarHBondContact SG-CE1 2.75Å; C47-H69 PolarHBondContact SG-ND1 2.86Å; E49-H69 IonicContact OE2-CE1 2.69Å; A50-H69 PolarHBondContact O-NE2 2.87Å; L51-H69 HydrophobicContact CD2-CB 4.49Å; H69-R71 HydrophobicContact CB-CG 3.9Å; H69-R71 PolarHBondContact O-N 2.78Å; H69-R71 VanDerWaalsContact O-N 3.14Å; H69-C72 HydrophobicContact CB-CB 4.26Å; H69-C72 WeakPolarHBondContact O-CA 2.75Å; H69-C72 PolarHBondContact O-N 2.95Å; H69-A73 PolarHBondContact O-N 2.8Å; H69-A73 VanDerWaalsContact O-N 3.13Å
70	K	85.9	Confident	87.6	Confident	106 Å²	106	50.3 Å²	50.3	46%	0.461	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-35.2	173.3	-168.4	179.4	-179.5	-175.7	0	112.9	C72	K70-C72 VanDerWaalsContact C-N 3.33Å
71	R	87.3	Confident	87.5	Confident	164 Å²	164	50.5 Å²	50.5	62%	0.619	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-18.5	174.7	70.3	179.6	-177.2	179.9	3.3	114.9	E49 H69	E49-R71 IonicContact OE1-NH2 3.95Å; E49-R71 PolarHBondContact OE1-NH2 3.3Å; E49-R71 IonicContact OE2-CZ 2.71Å; E49-R71 IonicContact OE2-NH2 3.32Å; E49-R71 PolarHBondContact OE2-NH2 2.81Å; H69-R71 HydrophobicContact CB-CG 3.9Å; H69-R71 PolarHBondContact O-N 2.78Å; H69-R71 VanDerWaalsContact O-N 3.14Å
72	C	89.3	Confident	87.4	Confident	4 Å²	4	51.8 Å²	51.8	3%	0.027	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103	-24.1	-172.8	-70	0	0	0	0	113.3	V46 A68 H69 K70 V74 R75 A76	V46-C72 HydrophobicContact CB-CB 3.94Å; V46-C72 HydrophobicContact CG1-CB 4.34Å; V46-C72 HydrophobicContact CG2-CB 4.05Å; A68-C72 HydrophobicContact CB-CB 4.08Å; H69-C72 HydrophobicContact CB-CB 4.26Å; H69-C72 WeakPolarHBondContact O-CA 2.75Å; H69-C72 PolarHBondContact O-N 2.95Å; K70-C72 VanDerWaalsContact C-N 3.33Å; C72-V74 VanDerWaalsContact C-N 3.28Å; C72-V74 PolarHBondContact O-N 2.95Å; C72-R75 CarbonylContact O-C 3.54Å; C72-R75 WeakPolarHBondContact O-CA 3.49Å; C72-R75 PolarHBondContact O-N 2.94Å; C72-A76 PolarHBondContact O-N 2.94Å
73	A	85.8	Confident	87.3	Confident	11 Å²	11	51.1 Å²	51.1	9%	0.091	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-59.6	-34.6	-177.9	0	0	0	0	0	113.7	W33 L59 A68 H69 R75 A76	W33-A73 HydrophobicContact CD2-CB 4.02Å; W33-A73 HydrophobicContact CE3-CB 4.48Å; W33-A73 HydrophobicContact CG-CB 4.48Å; W33-A73 HydrophobicContact CH2-CB 4.38Å; W33-A73 HydrophobicContact CZ2-CB 3.91Å; L59-A73 HydrophobicContact CD1-CB 3.65Å; A68-A73 HydrophobicContact CB-CB 4.26Å; H69-A73 PolarHBondContact O-N 2.8Å; H69-A73 VanDerWaalsContact O-N 3.13Å; A73-R75 PolarHBondContact O-N 3.2Å; A73-A76 WeakPolarHBondContact O-CB 3.2Å; A73-A76 PolarHBondContact O-N 3.37Å
74	V	83.9	Confident	87	Confident	110 Å²	110	51 Å²	51	67%	0.667	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-69.4	-20.3	175.1	-170.4	0	0	0	0	112.3	A7 C72	A7-V74 HydrophobicContact CB-CG2 4.07Å; C72-V74 VanDerWaalsContact C-N 3.28Å; C72-V74 PolarHBondContact O-N 2.95Å
75	R	86.3	Confident	86.5	Confident	192 Å²	192	52.9 Å²	52.9	73%	0.725	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-100.7	10.4	176.3	-68.6	179.6	57.5	-160.5	-4.9	112.8	V46 C72 A73	V46-R75 HydrophobicContact CG1-CB 4.33Å; C72-R75 CarbonylContact O-C 3.54Å; C72-R75 WeakPolarHBondContact O-CA 3.49Å; C72-R75 PolarHBondContact O-N 2.94Å; A73-R75 PolarHBondContact O-N 3.2Å
76	A	85.8	Confident	85.9	Confident	17 Å²	17	54.2 Å²	54.2	14%	0.14	28%	0.277	C	S	.	.	S	Bend	trans	-77.5	141	175.7	0	0	0	0	0	110.5	W33 V46 F66 C72 A73	W33-A76 HydrophobicContact CH2-CB 4.1Å; W33-A76 HydrophobicContact CZ2-CB 3.71Å; V46-A76 HydrophobicContact CG2-CB 4.31Å; F66-A76 HydrophobicContact CE1-CB 4.17Å; F66-A76 HydrophobicContact CZ-CB 4.42Å; C72-A76 PolarHBondContact O-N 2.94Å; A73-A76 WeakPolarHBondContact O-CB 3.2Å; A73-A76 PolarHBondContact O-N 3.37Å
77	T	84.4	Confident	85.3	Confident	85 Å²	85	55 Å²	55	52%	0.521	28%	0.284	S	S	.	.			trans	-66.6	141.2	172.2	42	0	0	0	0	110.9	H31 N79	H31-T77 PolarHBondContact CD2-O 3.2Å; H31-T77 PolarHBondContact NE2-O 2.89Å; T77-N79 PolarHBondContact O-N 3.04Å; T77-N79 PolarHBondContact O-OD1 3.42Å; T77-N79 PolarHBondContact OG1-ND2 3.32Å; T77-N79 PolarHBondContact OG1-OD1 2.73Å
78	N	82.1	Confident	84.7	Confident	111 Å²	111	54 Å²	54	59%	0.594	28%	0.28	S	S	*	.	S	Bend	trans	-77	59.2	174.8	-71.5	-24.2	0	0	0	112.1	G29	G29-N78 CarbonylContact O-C 3.55Å
79	N	83.9	Confident	83.9	Confident	87 Å²	87	56 Å²	56	47%	0.465	30%	0.301	S	S	.	.			trans	-119.6	46.7	179.2	64.9	-16.4	0	0	0	111.2	H31 T77	H31-N79 PolarHBondContact NE2-OD1 2.93Å; T77-N79 PolarHBondContact O-N 3.04Å; T77-N79 PolarHBondContact O-OD1 3.42Å; T77-N79 PolarHBondContact OG1-ND2 3.32Å; T77-N79 PolarHBondContact OG1-OD1 2.73Å
80	C	88.1	Confident	82.7	Confident	5 Å²	5	64.9 Å²	64.9	3%	0.034	34%	0.339	C	S	.	.			trans	-65.7	178.2	171.1	-161.8	0	0	0	0	111.1	G29 M30 C61 W82 Q104	G29-C80 WeakPolarHBondContact O-CB 3.39Å; G29-C80 PolarHBondContact O-N 2.66Å; M30-C80 VanDerWaalsContact O-CB 3.27Å; M30-C80 WeakPolarHBondContact O-CB 3.24Å; M30-C80 PolarHBondContact O-SG 2.98Å; C61-C80 VanDerWaalsContact SG-SG 3.66Å; C80-W82 PolarHBondContact O-N 2.86Å; C80-Q104 PolarHBondContact O-NE2 3.39Å
81	K	89.3	Confident	82	Confident	5 Å²	5	64.6 Å²	64.6	2%	0.022	34%	0.343	C	S	.	.	S	Bend	trans	-57.5	126.9	179.4	-171.9	179.4	-179.5	-175.1	0	109.7	V63 L135 W136 Q211 L212 L213 P215	V63-K81 HydrophobicContact CG1-CB 3.66Å; V63-K81 HydrophobicContact CG1-CD 4.03Å; V63-K81 HydrophobicContact CG1-CG 4.46Å; K81-L135 HydrophobicContact CB-CD1 4.35Å; K81-L135 HydrophobicContact CG-CB 4.49Å; K81-W136 HydrophobicContact CD-CH2 4.28Å; K81-W136 HydrophobicContact CD-CZ2 4.21Å; K81-W136 HydrophobicContact CG-CH2 4.1Å; K81-W136 HydrophobicContact CG-CZ2 3.6Å; K81-Q211 PolarHBondContact NZ-O 2.96Å; K81-L212 PolarHBondContact NZ-O 2.87Å; K81-L213 PolarHBondContact NZ-O 3.48Å; K81-P215 HydrophobicContact CD-CG 4.44Å
82	W	88.2	Confident	81.5	Confident	27 Å²	27	58.9 Å²	58.9	10%	0.102	32%	0.324	C	S	.	.			trans	-60	152.7	-179.3	-60.2	-46.2	0	0	0	112.1	C80 S87 I88 D91 P102 Q104 W136 P165	C80-W82 PolarHBondContact O-N 2.86Å; W82-S87 PolarHBondContact NE1-O 2.87Å; W82-I88 HydrophobicContact CD2-CG1 4.32Å; W82-I88 HydrophobicContact CE3-CG1 4.35Å; W82-I88 HydrophobicContact CG-CG1 4.45Å; W82-I88 HydrophobicContact CH2-CG2 4.28Å; W82-I88 HydrophobicContact CZ2-CG2 4.41Å; W82-I88 HydrophobicContact CZ3-CG2 4.34Å; W82-D91 HydrophobicContact CH2-CB 4.19Å; W82-D91 HydrophobicContact CZ2-CB 4.32Å; W82-D91 WeakPolarHBondContact CZ2-OD2 3.33Å; W82-P102 HydrophobicContact CH2-CG 4.03Å; W82-P102 HydrophobicContact CZ3-CG 3.83Å; W82-Q104 HydrophobicContact CD2-CB 4.35Å; W82-Q104 HydrophobicContact CD2-CG 3.9Å; W82-Q104 HydrophobicContact CE3-CB 3.71Å; W82-Q104 HydrophobicContact CE3-CG 3.77Å; W82-Q104 HydrophobicContact CH2-CB 3.92Å; W82-Q104 HydrophobicContact CH2-CG 3.79Å; W82-Q104 HydrophobicContact CZ2-CG 3.91Å; W82-Q104 HydrophobicContact CZ3-CB 3.45Å; W82-Q104 VanDerWaalsContact CZ3-CB 3.45Å; W82-Q104 HydrophobicContact CZ3-CG 3.71Å; W82-Q104 VanDerWaalsContact N-OE1 3.15Å; W82-W136 HydrophobicContact CB-CZ2 4.29Å; W82-W136 WeakPolarHBondContact O-CH2 3.34Å; W82-W136 WeakPolarHBondContact O-CZ2 3.47Å; W82-P165 HydrophobicContact CB-CB 4.23Å; W82-P165 HydrophobicContact CB-CG 3.98Å
83	T	83.5	Confident	80.9	Confident	4 Å²	4	60.5 Å²	60.5	3%	0.025	33%	0.332	C	S	.	.			trans	-125.1	-41.4	-177.4	46.4	0	0	0	0	112.1	F27 S87 N214 P215	F27-T83 HydrophobicContact CD1-CG2 4.24Å; F27-T83 PolarHBondContact O-OG1 3.02Å; F27-T83 VanDerWaalsContact O-OG1 3.11Å; T83-S87 PolarHBondContact OG1-OG 3.34Å; T83-S87 VanDerWaalsContact OG1-OG 3.13Å; T83-N214 PolarHBondContact O-ND2 2.75Å; T83-P215 HydrophobicContact CG2-CB 4Å; T83-P215 HydrophobicContact CG2-CG 4.08Å
84	T	82.7	Confident	80.4	Confident	14 Å²	14	67.5 Å²	67.5	9%	0.086	36%	0.363	C	S	.	.	S	Bend	trans	-126	168.3	-177.2	62	0	0	0	0	112.1	A86 S87 P165 L168 W177	T84-A86 VanDerWaalsContact C-N 3.29Å; T84-A86 PolarHBondContact O-N 3.02Å; T84-S87 PolarHBondContact N-OG 2.83Å; T84-S87 WeakPolarHBondContact O-CA 3.42Å; T84-S87 WeakPolarHBondContact O-CB 3.4Å; T84-S87 PolarHBondContact O-N 2.91Å; T84-S87 PolarHBondContact O-OG 2.97Å; T84-S87 PolarHBondContact OG1-N 3.04Å; T84-S87 PolarHBondContact OG1-OG 3.18Å; T84-P165 CarbonylContact C-O 3.58Å; T84-P165 VanDerWaalsContact C-O 3.27Å; T84-L168 CarbonylContact C-O 3.56Å; T84-L168 WeakPolarHBondContact CA-O 3.36Å; T84-L168 WeakPolarHBondContact CB-O 3.33Å; T84-W177 HydrophobicContact CG2-CH2 3.62Å; T84-W177 HydrophobicContact CG2-CZ3 3.53Å
85	L	79.7	Confident	79.7	Confident	44 Å²	44	65 Å²	65	23%	0.23	35%	0.346	C	S	.	.	H	α-helix	trans	-56.8	-44.4	175.1	-175.4	71.6	0	0	0	110.9	S87 I88 G89 I92 V99 P165 T166 L168 N169	L85-S87 PolarHBondContact O-N 3.17Å; L85-S87 VanDerWaalsContact O-N 3.15Å; L85-I88 HydrophobicContact CD1-CD1 4.41Å; L85-I88 WeakPolarHBondContact O-CB 3.27Å; L85-I88 PolarHBondContact O-N 2.99Å; L85-G89 PolarHBondContact O-N 2.69Å; L85-I92 HydrophobicContact CD1-CD1 3.75Å; L85-I92 HydrophobicContact CG-CD1 4.25Å; L85-V99 HydrophobicContact CD1-CG1 4.41Å; L85-P165 WeakPolarHBondContact CA-O 3.27Å; L85-P165 PolarHBondContact N-O 2.87Å; L85-T166 HydrophobicContact CD1-CG2 4.38Å; L85-L168 PolarHBondContact N-O 3.18Å; L85-N169 VanDerWaalsContact CD2-OD1 3.28Å; L85-N169 WeakPolarHBondContact CD2-OD1 3.43Å
86	A	75.9	Confident	78.4	Confident	84 Å²	84	66 Å²	66	69%	0.694	36%	0.359	S	S	*	.	H	α-helix	trans	-61	-21.4	174.9	0	0	0	0	0	113.6	T84	T84-A86 VanDerWaalsContact C-N 3.29Å; T84-A86 PolarHBondContact O-N 3.02Å
87	S	77.7	Confident	77.1	Confident	32 Å²	32	72.6 Å²	72.6	22%	0.224	39%	0.391	C	S	.	.	H	α-helix	trans	-74.9	-25.8	174.2	-51.7	0	0	0	0	113	W82 T83 T84 L85	W82-S87 PolarHBondContact NE1-O 2.87Å; T83-S87 PolarHBondContact OG1-OG 3.34Å; T83-S87 VanDerWaalsContact OG1-OG 3.13Å; T84-S87 PolarHBondContact N-OG 2.83Å; T84-S87 WeakPolarHBondContact O-CA 3.42Å; T84-S87 WeakPolarHBondContact O-CB 3.4Å; T84-S87 PolarHBondContact O-N 2.91Å; T84-S87 PolarHBondContact O-OG 2.97Å; T84-S87 PolarHBondContact OG1-N 3.04Å; T84-S87 PolarHBondContact OG1-OG 3.18Å; L85-S87 PolarHBondContact O-N 3.17Å; L85-S87 VanDerWaalsContact O-N 3.15Å
88	I	78.6	Confident	76.3	Confident	6 Å²	6	70.1 Å²	70.1	3%	0.031	38%	0.383	C	S	.	.	H	α-helix	trans	-79.3	-39.4	179.9	-46.2	174.9	0	0	0	110.2	W82 L85 K90 D91 I92 P102 P165 T166	W82-I88 HydrophobicContact CD2-CG1 4.32Å; W82-I88 HydrophobicContact CE3-CG1 4.35Å; W82-I88 HydrophobicContact CG-CG1 4.45Å; W82-I88 HydrophobicContact CH2-CG2 4.28Å; W82-I88 HydrophobicContact CZ2-CG2 4.41Å; W82-I88 HydrophobicContact CZ3-CG2 4.34Å; L85-I88 HydrophobicContact CD1-CD1 4.41Å; L85-I88 WeakPolarHBondContact O-CB 3.27Å; L85-I88 PolarHBondContact O-N 2.99Å; I88-K90 PolarHBondContact O-N 2.91Å; I88-D91 HydrophobicContact CG2-CB 3.99Å; I88-D91 PolarHBondContact O-N 3.3Å; I88-I92 HydrophobicContact CB-CD1 4.47Å; I88-I92 HydrophobicContact CB-CG1 3.89Å; I88-I92 HydrophobicContact CD1-CG1 4.42Å; I88-I92 HydrophobicContact CG2-CG1 3.63Å; I88-P102 HydrophobicContact CG2-CG 4.11Å; I88-P165 HydrophobicContact CD1-CB 4.11Å; I88-P165 HydrophobicContact CG1-CB 4.23Å; I88-T166 HydrophobicContact CD1-CG2 3.46Å; I88-T166 VanDerWaalsContact CD1-CG2 3.46Å
89	G	73.9	Confident	76	Confident	44 Å²	44	68.5 Å²	68.5	45%	0.454	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	62	-116.2	178.3	0	0	0	0	0	112.3	L85 I92	L85-G89 PolarHBondContact O-N 2.69Å; G89-I92 VanDerWaalsContact O-CD1 3.28Å; G89-I92 WeakPolarHBondContact O-CD1 3.44Å; G89-I92 WeakPolarHBondContact O-CG1 3.43Å
90	K	65	Low	75.8	Confident	211 Å²	211	65.3 Å²	65.3	92%	0.917	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-87.5	-5.4	-173.5	-62	-171.5	178.8	-172.5	0	114.9	I88 I92	I88-K90 PolarHBondContact O-N 2.91Å; K90-I92 PolarHBondContact O-N 3.49Å
91	D	71.4	Confident	75.6	Confident	99 Å²	99	65.8 Å²	65.8	53%	0.529	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-82.5	-0	-178.9	-67.9	-31.1	0	0	0	113.2	W82 I88 P102	W82-D91 HydrophobicContact CH2-CB 4.19Å; W82-D91 HydrophobicContact CZ2-CB 4.32Å; W82-D91 WeakPolarHBondContact CZ2-OD2 3.33Å; I88-D91 HydrophobicContact CG2-CB 3.99Å; I88-D91 PolarHBondContact O-N 3.3Å; D91-P102 HydrophobicContact CB-CG 4.38Å; D91-P102 VanDerWaalsContact O-CG 3.27Å; D91-P102 WeakPolarHBondContact O-CG 3.39Å
92	I	76.1	Confident	75.5	Confident	45 Å²	45	66.2 Å²	66.2	23%	0.231	37%	0.367	C	S	.	.			trans	-62.4	139	-177.7	-61.9	170.6	0	0	0	110.6	L85 I88 G89 K90 E94 V99	L85-I92 HydrophobicContact CD1-CD1 3.75Å; L85-I92 HydrophobicContact CG-CD1 4.25Å; I88-I92 HydrophobicContact CB-CD1 4.47Å; I88-I92 HydrophobicContact CB-CG1 3.89Å; I88-I92 HydrophobicContact CD1-CG1 4.42Å; I88-I92 HydrophobicContact CG2-CG1 3.63Å; G89-I92 VanDerWaalsContact O-CD1 3.28Å; G89-I92 WeakPolarHBondContact O-CD1 3.44Å; G89-I92 WeakPolarHBondContact O-CG1 3.43Å; K90-I92 PolarHBondContact O-N 3.49Å; I92-E94 HydrophobicContact CG2-CG 4.04Å; I92-V99 HydrophobicContact CG2-CG1 3.64Å
93	I	75.9	Confident	75.6	Confident	37 Å²	37	65.8 Å²	65.8	19%	0.19	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	118.5	172.6	-58.8	168.3	0	0	0	107.3	S100 P102	I93-S100 PolarHBondContact O-N 3.26Å; I93-P102 HydrophobicContact CD1-CB 3.95Å; I93-P102 HydrophobicContact CG1-CB 4.27Å
94	E	75.1	Confident	75.9	Confident	159 Å²	159	66.1 Å²	66.1	74%	0.743	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.8	124.2	175.7	-62.3	179	169.6	0	0	108.5	I92	I92-E94 HydrophobicContact CG2-CG 4.04Å
95	D	69.4	Low	76.4	Confident	58 Å²	58	68 Å²	68	31%	0.31	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	170.4	177.6	-56.3	-99.1	0	0	0	110.1	D97 G98 S100 K152	D95-D97 PolarHBondContact O-N 3.18Å; D95-G98 PolarHBondContact N-O 3.31Å; D95-G98 WeakPolarHBondContact O-CA 3.34Å; D95-G98 PolarHBondContact O-N 3.33Å; D95-S100 WeakPolarHBondContact OD2-CB 3.36Å; D95-S100 PolarHBondContact OD2-OG 3.32Å; D95-K152 VanDerWaalsContact CG-CE 3.46Å; D95-K152 WeakPolarHBondContact OD1-CE 3.39Å; D95-K152 IonicContact OD1-NZ 3.73Å; D95-K152 PolarHBondContact OD1-NZ 3.48Å; D95-K152 WeakPolarHBondContact OD2-CE 3.43Å; D95-K152 IonicContact OD2-NZ 2.97Å; D95-K152 PolarHBondContact OD2-NZ 2.83Å
96	E	58.9	Low	76.9	Confident	212 Å²	212	66.6 Å²	66.6	99%	0.991	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-24.2	172	-61.3	-170.2	142.4	0	0	112.8	G98	E96-G98 PolarHBondContact O-N 3.18Å
97	D	59	Low	77.6	Confident	155 Å²	155	64 Å²	64	83%	0.829	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-3.7	170.4	-59.2	-56.4	0	0	0	113.7	D95	D95-D97 PolarHBondContact O-N 3.18Å
98	G	68.5	Low	78.1	Confident	33 Å²	33	62.6 Å²	62.6	34%	0.34	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	102.8	-153.8	-176.8	0	0	0	0	0	114.9	D95 E96 S100	D95-G98 PolarHBondContact N-O 3.31Å; D95-G98 WeakPolarHBondContact O-CA 3.34Å; D95-G98 PolarHBondContact O-N 3.33Å; E96-G98 PolarHBondContact O-N 3.18Å; G98-S100 PolarHBondContact O-N 2.93Å
99	V	76	Confident	78.5	Confident	77 Å²	77	63.9 Å²	63.9	47%	0.467	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	105.5	-167.4	-178.6	0	0	0	0	112.5	L85 I92 T166	L85-V99 HydrophobicContact CD1-CG1 4.41Å; I92-V99 HydrophobicContact CG2-CG1 3.64Å; V99-T166 HydrophobicContact CG1-CG2 3.82Å
100	S	78.4	Confident	79.2	Confident	21 Å²	21	63 Å²	63	15%	0.147	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	143.2	176.7	-75.9	0	0	0	0	113.2	I93 D95 G98 K152	I93-S100 PolarHBondContact O-N 3.26Å; D95-S100 WeakPolarHBondContact OD2-CB 3.36Å; D95-S100 PolarHBondContact OD2-OG 3.32Å; G98-S100 PolarHBondContact O-N 2.93Å; S100-K152 WeakPolarHBondContact OG-CD 3.31Å; S100-K152 WeakPolarHBondContact OG-CE 3.37Å; S100-K152 PolarHBondContact OG-NZ 2.82Å
101	M	84.2	Confident	80.1	Confident	15 Å²	15	56 Å²	56	7%	0.074	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-90.7	122.5	-179.4	-166.3	-86.6	-73.3	0	0	111.9	W136 C153 L155 T166	M101-W136 HydrophobicContact CE-CB 3.95Å; M101-W136 HydrophobicContact CE-CD2 4.39Å; M101-W136 HydrophobicContact CE-CG 3.94Å; M101-W136 HydrophobicContact SD-CG 4.25Å; M101-C153 HydrophobicContact CE-CB 3.68Å; M101-C153 VanDerWaalsContact O-CB 3.32Å; M101-C153 WeakPolarHBondContact O-CB 3.41Å; M101-C153 PolarHBondContact O-N 2.81Å; M101-C153 HydrophobicContact SD-CB 3.85Å; M101-L155 HydrophobicContact CE-CD2 3.43Å; M101-L155 VanDerWaalsContact CE-CD2 3.43Å; M101-L155 HydrophobicContact CE-CG 3.79Å; M101-T166 HydrophobicContact CB-CG2 4.13Å; M101-T166 HydrophobicContact CG-CG2 4.26Å
102	P	87.9	Confident	80.5	Confident	13 Å²	13	55.8 Å²	55.8	8%	0.084	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-82.6	152.9	-177.1	34.7	-39.6	0	0	0	113.3	W82 I88 D91 I93 Q104	W82-P102 HydrophobicContact CH2-CG 4.03Å; W82-P102 HydrophobicContact CZ3-CG 3.83Å; I88-P102 HydrophobicContact CG2-CG 4.11Å; D91-P102 HydrophobicContact CB-CG 4.38Å; D91-P102 VanDerWaalsContact O-CG 3.27Å; D91-P102 WeakPolarHBondContact O-CG 3.39Å; I93-P102 HydrophobicContact CD1-CB 3.95Å; I93-P102 HydrophobicContact CG1-CB 4.27Å; P102-Q104 PolarHBondContact O-N 3.24Å
103	H	89.6	Confident	80.8	Confident	18 Å²	18	58.5 Å²	58.5	8%	0.083	32%	0.322	C	S	.	.			trans	-66.7	103.6	174.9	-81.2	-100.3	0	0	0	113	W105 C134 C137 S150 S151 K152 C153	H103-W105 HydrophobicContact CB-CD2 4.43Å; H103-W105 HydrophobicContact CB-CZ2 3.67Å; H103-W105 AromaticContact CG-CZ2 3.82Å; H103-W105 AromaticContact ND1-CH2 3.96Å; H103-W105 AromaticContact ND1-CZ2 3.73Å; H103-W105 PolarHBondContact O-N 3.41Å; H103-W105 PolarHBondContact O-NE1 2.69Å; H103-C134 PolarHBondContact ND1-SG 3.46Å; H103-C137 PolarHBondContact CE1-SG 3.02Å; H103-S150 PolarHBondContact CD2-O 3.33Å; H103-S150 PolarHBondContact NE2-O 3.03Å; H103-S151 PolarHBondContact N-O 2.83Å; H103-K152 PolarHBondContact NE2-O 3.03Å; H103-C153 HydrophobicContact CB-CB 4.45Å; H103-C153 WeakPolarHBondContact NE2-CA 3.1Å
104	Q	90.9	Very high	81.3	Confident	12 Å²	12	56.8 Å²	56.8	6%	0.056	31%	0.314	C	S	.	.			trans	-71	119.5	167.9	-156.1	-178.1	11.1	0	0	110.9	C80 W82 P102 C134 L135	C80-Q104 PolarHBondContact O-NE2 3.39Å; W82-Q104 HydrophobicContact CD2-CB 4.35Å; W82-Q104 HydrophobicContact CD2-CG 3.9Å; W82-Q104 HydrophobicContact CE3-CB 3.71Å; W82-Q104 HydrophobicContact CE3-CG 3.77Å; W82-Q104 HydrophobicContact CH2-CB 3.92Å; W82-Q104 HydrophobicContact CH2-CG 3.79Å; W82-Q104 HydrophobicContact CZ2-CG 3.91Å; W82-Q104 HydrophobicContact CZ3-CB 3.45Å; W82-Q104 VanDerWaalsContact CZ3-CB 3.45Å; W82-Q104 HydrophobicContact CZ3-CG 3.71Å; W82-Q104 VanDerWaalsContact N-OE1 3.15Å; P102-Q104 PolarHBondContact O-N 3.24Å; Q104-C134 CarbonylContact O-C 3.6Å; Q104-C134 VanDerWaalsContact O-CA 3.26Å; Q104-C134 WeakPolarHBondContact O-CA 3.32Å; Q104-C134 PolarHBondContact O-SG 3.18Å; Q104-C134 VanDerWaalsContact O-SG 3.37Å; Q104-L135 HydrophobicContact CB-CB 4.42Å; Q104-L135 HydrophobicContact CG-CD1 4.23Å; Q104-L135 PolarHBondContact O-N 3.16Å
105	W	91.4	Very high	82.2	Confident	52 Å²	52	55 Å²	55	20%	0.197	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	142.9	-173.2	-65.6	103	0	0	0	114.1	H103 W132 R133 C134 V141 K146 L149	H103-W105 HydrophobicContact CB-CD2 4.43Å; H103-W105 HydrophobicContact CB-CZ2 3.67Å; H103-W105 AromaticContact CG-CZ2 3.82Å; H103-W105 AromaticContact ND1-CH2 3.96Å; H103-W105 AromaticContact ND1-CZ2 3.73Å; H103-W105 PolarHBondContact O-N 3.41Å; H103-W105 PolarHBondContact O-NE1 2.69Å; W105-W132 HydrophobicContact CB-CE3 3.89Å; W105-W132 HydrophobicContact CD2-CB 4.3Å; W105-W132 HydrophobicContact CE3-CB 3.67Å; W105-W132 HydrophobicContact CZ3-CB 4.24Å; W105-R133 VanDerWaalsContact CE3-C 3.5Å; W105-C134 HydrophobicContact CE3-CB 4.07Å; W105-C134 HydrophobicContact CH2-CB 4.26Å; W105-C134 HydrophobicContact CZ3-CB 3.85Å; W105-V141 HydrophobicContact CE3-CG2 4.27Å; W105-V141 HydrophobicContact CH2-CG1 4.1Å; W105-V141 HydrophobicContact CH2-CG2 3.58Å; W105-V141 HydrophobicContact CZ2-CG2 4.28Å; W105-V141 HydrophobicContact CZ3-CG2 3.57Å; W105-K146 VanDerWaalsContact CD1-CE 3.46Å; W105-K146 HydrophobicContact CZ2-CG 4.39Å; W105-L149 HydrophobicContact CH2-CD2 3.72Å; W105-L149 HydrophobicContact CZ2-CD2 3.97Å
106	L	91.6	Very high	83.3	Confident	15 Å²	15	52.2 Å²	52.2	8%	0.079	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	136.8	166.2	-173.2	77.6	0	0	0	110.7	F66 W132 R133 L135	F66-L106 HydrophobicContact CB-CD1 4.23Å; F66-L106 HydrophobicContact CD2-CD1 3.62Å; F66-L106 HydrophobicContact CE2-CD1 4.48Å; F66-L106 HydrophobicContact CG-CD1 4.31Å; L106-W132 WeakPolarHBondContact O-CA 3.42Å; L106-R133 PolarHBondContact N-O 3.04Å; L106-R133 PolarHBondContact O-N 3.01Å; L106-L135 HydrophobicContact CB-CD2 3.92Å; L106-L135 HydrophobicContact CB-CG 4.4Å; L106-L135 HydrophobicContact CD2-CD2 4.46Å
107	E	90.8	Very high	84.8	Confident	31 Å²	31	45.2 Å²	45.2	15%	0.145	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	132.6	178.7	-167.3	-178.3	-172.2	0	0	112.9	N45 R48 L129 W132	N45-E107 PolarHBondContact ND2-O 3.34Å; R48-E107 IonicContact CZ-OE1 3.03Å; R48-E107 IonicContact CZ-OE2 3.36Å; R48-E107 IonicContact NH1-OE1 2.7Å; R48-E107 PolarHBondContact NH1-OE1 3.06Å; R48-E107 IonicContact NH1-OE2 2.69Å; R48-E107 PolarHBondContact NH1-OE2 2.94Å; R48-E107 VanDerWaalsContact NH2-CD 3.34Å; R48-E107 IonicContact NH2-OE1 3.14Å; R48-E107 PolarHBondContact NH2-OE1 3.25Å; R48-E107 IonicContact NH2-OE2 2.74Å; R48-E107 PolarHBondContact NH2-OE2 3.44Å; E107-L129 HydrophobicContact CG-CB 4.48Å; E107-W132 HydrophobicContact CB-CE3 3.93Å; E107-W132 HydrophobicContact CB-CH2 4.11Å; E107-W132 HydrophobicContact CB-CZ3 3.73Å; E107-W132 HydrophobicContact CG-CH2 4.33Å; E107-W132 HydrophobicContact CG-CZ2 4.44Å; E107-W132 HydrophobicContact CG-CZ3 4.38Å
108	G	87.7	Confident	86.3	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.01	24%	0.238	C	C	.	.	S	Bend	trans	63.7	-163.3	165.1	0	0	0	0	0	116.7	L110 Q130 D131	G108-L110 PolarHBondContact O-N 2.88Å; G108-Q130 WeakPolarHBondContact CA-O 3.17Å; G108-D131 PolarHBondContact N-O 2.6Å
109	N	87.1	Confident	87.4	Confident	33 Å²	33	40.9 Å²	40.9	18%	0.176	24%	0.237	C	C	.	.			trans	51.9	38.1	-173.1	-69.3	-47.3	0	0	0	112.9	Y43 N45 K67 L129	Y43-N109 PolarHBondContact N-OD1 3.13Å; Y43-N109 VanDerWaalsContact N-OD1 3.1Å; Y43-N109 PolarHBondContact O-ND2 3.38Å; N45-N109 PolarHBondContact OD1-ND2 2.97Å; K67-N109 HydrophobicContact CD-CB 4.42Å; N109-L129 WeakPolarHBondContact ND2-CD2 3.28Å
110	L	88.2	Confident	88.1	Confident	25 Å²	25	42.6 Å²	42.6	13%	0.131	24%	0.243	C	C	.	.			trans	-76.1	158.6	-177.2	-56.4	-169.1	0	0	0	112.8	G108 A114 D131 R133	G108-L110 PolarHBondContact O-N 2.88Å; L110-A114 HydrophobicContact CB-CB 4.16Å; L110-D131 HydrophobicContact CD1-CB 3.99Å; L110-R133 HydrophobicContact CD2-CB 3.67Å
111	P	84.4	Confident	88.8	Confident	65 Å²	65	48.6 Å²	48.6	42%	0.422	27%	0.267	S	S	.	.			trans	-57.8	146.6	168.1	-23.7	33.9	0	0	0	112.8	S113 A114	P111-S113 PolarHBondContact O-N 3.02Å; P111-A114 HydrophobicContact CB-CB 4.35Å; P111-A114 WeakPolarHBondContact O-CB 3.27Å; P111-A114 PolarHBondContact O-N 2.78Å
112	V	78.6	Confident	89.1	Confident	94 Å²	94	53.1 Å²	53.1	57%	0.57	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-25	-179.1	176	0	0	0	0	112.9
113	S	82.8	Confident	89.1	Confident	102 Å²	102	53 Å²	53	71%	0.713	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	17.8	175.8	51.7	0	0	0	0	113.6	P111 K115	P111-S113 PolarHBondContact O-N 3.02Å; S113-K115 PolarHBondContact O-N 3.42Å
114	A	87.6	Confident	89	Confident	2 Å²	2	53.4 Å²	53.4	2%	0.017	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-65	124.4	179.5	0	0	0	0	0	111.7	L110 P111 T122 C123 M140	L110-A114 HydrophobicContact CB-CB 4.16Å; P111-A114 HydrophobicContact CB-CB 4.35Å; P111-A114 WeakPolarHBondContact O-CB 3.27Å; P111-A114 PolarHBondContact O-N 2.78Å; A114-T122 CarbonylContact O-C 3.4Å; A114-T122 VanDerWaalsContact O-CA 3.31Å; A114-T122 WeakPolarHBondContact O-CA 3.37Å; A114-C123 PolarHBondContact O-N 2.93Å; A114-C123 PolarHBondContact O-SG 3.43Å; A114-C123 VanDerWaalsContact O-SG 3.38Å; A114-M140 HydrophobicContact CB-CE 3.76Å; A114-M140 HydrophobicContact CB-SD 3.53Å; A114-M140 VanDerWaalsContact CB-SD 3.53Å
115	K	92.5	Very high	88.6	Confident	121 Å²	121	55 Å²	55	53%	0.526	32%	0.316	S	S	.	.	B	Isolated β-bridge	trans	-100.8	147.4	171.1	-66.7	-174.2	174.3	-171.4	0	111	S113 D120 C123	S113-K115 PolarHBondContact O-N 3.42Å; K115-D120 WeakPolarHBondContact CD-O 3.36Å; K115-D120 WeakPolarHBondContact CG-O 3.29Å; K115-C123 VanDerWaalsContact C-SG 3.57Å
116	C	92.9	Very high	88.1	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-78.2	122.8	174.2	172.7	0	0	0	0	111.3	V118 C119 D120 K121 C123 M140 H142	C116-V118 PolarHBondContact O-N 3.04Å; C116-C119 PolarHBondContact O-N 3.44Å; C116-D120 WeakPolarHBondContact O-CA 3.42Å; C116-D120 PolarHBondContact O-N 3.09Å; C116-K121 PolarHBondContact N-O 3.18Å; C116-C123 HydrophobicContact CB-CB 4.33Å; C116-M140 CarbonylContact C-O 3.57Å; C116-M140 VanDerWaalsContact CA-O 3.25Å; C116-M140 WeakPolarHBondContact CA-O 3.49Å; C116-H142 VanDerWaalsContact CB-CE1 3.42Å; C116-H142 WeakPolarHBondContact CB-CE1 3.48Å; C116-H142 VanDerWaalsContact CB-ND1 3.33Å; C116-H142 WeakPolarHBondContact CB-ND1 3.4Å
117	S	90.9	Very high	87.7	Confident	65 Å²	65	62.4 Å²	62.4	46%	0.455	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	8.1	-179.1	-50.6	0	0	0	0	115.8	M140	S117-M140 PolarHBondContact N-O 2.72Å; S117-M140 PolarHBondContact OG-N 2.95Å; S117-M140 PolarHBondContact OG-O 2.58Å
118	V	90.7	Very high	87.4	Confident	51 Å²	51	67.7 Å²	67.7	31%	0.309	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.5	-26.8	179	179.4	0	0	0	0	112	C116 V141 C145 Q148 L149	C116-V118 PolarHBondContact O-N 3.04Å; V118-V141 HydrophobicContact CG2-CG1 4.09Å; V118-C145 HydrophobicContact CB-CB 4.1Å; V118-C145 HydrophobicContact CG1-CB 4.3Å; V118-C145 HydrophobicContact CG2-CB 4.38Å; V118-Q148 HydrophobicContact CG1-CB 3.82Å; V118-L149 HydrophobicContact CG2-CB 4.19Å; V118-L149 HydrophobicContact CG2-CD1 4.12Å
119	C	91.1	Very high	87.4	Confident	46 Å²	46	67.9 Å²	67.9	31%	0.311	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.8	6.9	-175.3	73	0	0	0	0	115.2	C116 K121	C116-C119 PolarHBondContact O-N 3.44Å; C119-K121 PolarHBondContact O-N 3.19Å
120	D	91.4	Very high	87.4	Confident	112 Å²	112	68.8 Å²	68.8	60%	0.599	38%	0.384	S	S	*	.			trans	53.1	-3.6	179.8	-82.6	-59.9	0	0	0	118.5	K115 C116	K115-D120 WeakPolarHBondContact CD-O 3.36Å; K115-D120 WeakPolarHBondContact CG-O 3.29Å; C116-D120 WeakPolarHBondContact O-CA 3.42Å; C116-D120 PolarHBondContact O-N 3.09Å
121	K	91.6	Very high	87.6	Confident	148 Å²	148	67.8 Å²	67.8	64%	0.643	38%	0.379	S	S	*	.	S	Bend	trans	-67	152.7	172.6	-67.8	166.7	-172.6	175	0	110.9	C116 C119	C116-K121 PolarHBondContact N-O 3.18Å; C119-K121 PolarHBondContact O-N 3.19Å
122	T	91	Very high	88	Confident	110 Å²	110	67.7 Å²	67.7	68%	0.675	37%	0.37	S	S	*	.	B	Isolated β-bridge	trans	-60.8	141.7	176.9	43.8	0	0	0	0	111.8	A114 H142	A114-T122 CarbonylContact O-C 3.4Å; A114-T122 VanDerWaalsContact O-CA 3.31Å; A114-T122 WeakPolarHBondContact O-CA 3.37Å; T122-H142 PolarHBondContact O-CE1 2.83Å; T122-H142 PolarHBondContact O-NE2 2.92Å
123	C	89.4	Confident	88.7	Confident	9 Å²	9	65 Å²	65	6%	0.061	35%	0.35	C	S	.	.			trans	-135.7	158.2	-176.3	64.9	0	0	0	0	111.9	A114 K115 C116 D131 H142	A114-C123 PolarHBondContact O-N 2.93Å; A114-C123 PolarHBondContact O-SG 3.43Å; A114-C123 VanDerWaalsContact O-SG 3.38Å; K115-C123 VanDerWaalsContact C-SG 3.57Å; C116-C123 HydrophobicContact CB-CB 4.33Å; C123-D131 HydrophobicContact CB-CB 4.38Å; C123-H142 WeakPolarHBondContact CB-NE2 3.5Å
124	G	86.3	Confident	89.2	Confident	27 Å²	27	60.1 Å²	60.1	28%	0.278	32%	0.316	S	S	.	.			trans	88.2	172.2	-169.9	0	0	0	0	0	112.8	D131	G124-D131 PolarHBondContact N-OD2 2.73Å
125	S	83.4	Confident	89.3	Confident	45 Å²	45	60.5 Å²	60.5	32%	0.315	32%	0.317	S	S	.	.			trans	-141.9	147.3	179.4	-173.3	0	0	0	0	111.2	L127	S125-L127 PolarHBondContact OG-N 3.08Å
126	V	81	Confident	89.2	Confident	79 Å²	79	55 Å²	55	48%	0.479	29%	0.293	S	S	.	.	S	Bend	trans	-88.5	-11	172.3	-172.7	0	0	0	0	111.2	P41 Y43	P41-V126 HydrophobicContact CB-CG1 4.02Å; P41-V126 HydrophobicContact CG-CG1 3.9Å; Y43-V126 WeakPolarHBondContact CE2-O 3.32Å; Y43-V126 PolarHBondContact OH-O 2.81Å
127	L	82.7	Confident	89	Confident	144 Å²	144	56 Å²	56	75%	0.754	30%	0.3	S	S	*	.	S	Bend	trans	-101.4	-15	-175.8	-60.8	178.1	0	0	0	114.1	Y43 S125	Y43-L127 WeakPolarHBondContact CE1-O 3.18Å; Y43-L127 VanDerWaalsContact CZ-O 3.24Å; Y43-L127 WeakPolarHBondContact OH-CA 3.35Å; Y43-L127 PolarHBondContact OH-O 2.92Å; S125-L127 PolarHBondContact OG-N 3.08Å
128	R	84.3	Confident	89	Confident	142 Å²	142	56.3 Å²	56.3	54%	0.536	29%	0.293	S	S	.	.	S	Bend	trans	-164.5	168.8	-177.5	62.3	179.4	-169.6	134	-9.8	111.9	Q130	R128-Q130 HydrophobicContact CG-CB 4.32Å; R128-Q130 PolarHBondContact O-N 3.2Å
129	L	86.8	Confident	89	Confident	6 Å²	6	54.6 Å²	54.6	3%	0.031	28%	0.284	C	S	.	.			trans	-66.6	127.6	158.6	-64	175.9	0	0	0	109.8	R48 E107 N109	R48-L129 HydrophobicContact CG-CD1 4.28Å; E107-L129 HydrophobicContact CG-CB 4.48Å; N109-L129 WeakPolarHBondContact ND2-CD2 3.28Å
130	Q	87.8	Confident	89.1	Confident	52 Å²	52	54.2 Å²	54.2	24%	0.243	28%	0.278	C	S	.	.			trans	-158.7	149.8	176.5	-168.1	-173.6	-46.1	0	0	108.8	G108 R128	G108-Q130 WeakPolarHBondContact CA-O 3.17Å; R128-Q130 HydrophobicContact CG-CB 4.32Å; R128-Q130 PolarHBondContact O-N 3.2Å
131	D	93	Very high	89.2	Confident	4 Å²	4	48.9 Å²	48.9	2%	0.021	25%	0.25	C	C	.	.	S	Bend	trans	64.9	169.1	175.6	-54.3	-35.7	0	0	0	114	G108 L110 C123 G124 V141 H142 S143	G108-D131 PolarHBondContact N-O 2.6Å; L110-D131 HydrophobicContact CD1-CB 3.99Å; C123-D131 HydrophobicContact CB-CB 4.38Å; G124-D131 PolarHBondContact N-OD2 2.73Å; D131-V141 WeakPolarHBondContact CB-O 3.45Å; D131-H142 VanDerWaalsContact OD1-CA 3.25Å; D131-H142 WeakPolarHBondContact OD1-CA 3.49Å; D131-H142 IonicContact OD1-CD2 3.82Å; D131-H142 IonicContact OD2-CD2 2.7Å; D131-H142 PolarHBondContact OD2-CD2 3.31Å; D131-S143 PolarHBondContact OD1-N 3.32Å
132	W	92.5	Very high	89.3	Confident	62 Å²	62	43.7 Å²	43.7	24%	0.235	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	147.4	-164.1	-56.4	86.3	0	0	0	112.4	W105 L106 E107 M140 V141 S143	W105-W132 HydrophobicContact CB-CE3 3.89Å; W105-W132 HydrophobicContact CD2-CB 4.3Å; W105-W132 HydrophobicContact CE3-CB 3.67Å; W105-W132 HydrophobicContact CZ3-CB 4.24Å; L106-W132 WeakPolarHBondContact O-CA 3.42Å; E107-W132 HydrophobicContact CB-CE3 3.93Å; E107-W132 HydrophobicContact CB-CH2 4.11Å; E107-W132 HydrophobicContact CB-CZ3 3.73Å; E107-W132 HydrophobicContact CG-CH2 4.33Å; E107-W132 HydrophobicContact CG-CZ2 4.44Å; E107-W132 HydrophobicContact CG-CZ3 4.38Å; W132-M140 CarbonylContact O-C 3.45Å; W132-M140 VanDerWaalsContact O-CA 3.26Å; W132-M140 WeakPolarHBondContact O-CA 3.23Å; W132-V141 HydrophobicContact CB-CG2 4.01Å; W132-V141 PolarHBondContact N-O 3.08Å; W132-V141 PolarHBondContact O-N 3.18Å; W132-S143 PolarHBondContact NE1-OG 3.2Å; W132-S143 VanDerWaalsContact NE1-OG 3.09Å
133	R	93	Very high	89.3	Confident	38 Å²	38	41.3 Å²	41.3	14%	0.143	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	132.5	171.8	-176.5	-174.3	75.6	-101.7	2.1	110.4	C64 W105 L106 L110 A139 M140	C64-R133 PolarHBondContact O-NH2 2.98Å; C64-R133 VanDerWaalsContact O-NH2 3.13Å; W105-R133 VanDerWaalsContact CE3-C 3.5Å; L106-R133 PolarHBondContact N-O 3.04Å; L106-R133 PolarHBondContact O-N 3.01Å; L110-R133 HydrophobicContact CD2-CB 3.67Å; R133-A139 WeakPolarHBondContact CA-O 3.28Å; R133-M140 HydrophobicContact CB-CG 4.09Å; R133-M140 HydrophobicContact CG-CG 3.88Å
134	C	92.4	Very high	89.3	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	133.9	173.6	-174.5	0	0	0	0	111	H103 Q104 W105 W136 K138 A139	H103-C134 PolarHBondContact ND1-SG 3.46Å; Q104-C134 CarbonylContact O-C 3.6Å; Q104-C134 VanDerWaalsContact O-CA 3.26Å; Q104-C134 WeakPolarHBondContact O-CA 3.32Å; Q104-C134 PolarHBondContact O-SG 3.18Å; Q104-C134 VanDerWaalsContact O-SG 3.37Å; W105-C134 HydrophobicContact CE3-CB 4.07Å; W105-C134 HydrophobicContact CH2-CB 4.26Å; W105-C134 HydrophobicContact CZ3-CB 3.85Å; C134-W136 VanDerWaalsContact C-N 3.25Å; C134-W136 PolarHBondContact O-N 3.15Å; C134-W136 PolarHBondContact SG-N 3.26Å; C134-K138 WeakPolarHBondContact O-CA 3.34Å; C134-K138 PolarHBondContact O-N 2.78Å; C134-A139 PolarHBondContact N-O 3.26Å
135	L	90.9	Very high	89.5	Confident	10 Å²	10	43.1 Å²	43.1	5%	0.052	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-18.5	177.6	-65.3	-175	0	0	0	113.2	C64 K81 Q104 L106 K138	C64-L135 HydrophobicContact CB-CD1 3.75Å; C64-L135 HydrophobicContact CB-CD2 4.06Å; C64-L135 WeakPolarHBondContact O-CD2 3.34Å; K81-L135 HydrophobicContact CB-CD1 4.35Å; K81-L135 HydrophobicContact CG-CB 4.49Å; Q104-L135 HydrophobicContact CB-CB 4.42Å; Q104-L135 HydrophobicContact CG-CD1 4.23Å; Q104-L135 PolarHBondContact O-N 3.16Å; L106-L135 HydrophobicContact CB-CD2 3.92Å; L106-L135 HydrophobicContact CB-CG 4.4Å; L106-L135 HydrophobicContact CD2-CD2 4.46Å; L135-K138 PolarHBondContact O-NZ 2.94Å
136	W	89.9	Confident	89.8	Confident	6 Å²	6	44.8 Å²	44.8	2%	0.023	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-86.1	177.8	-62.1	97	0	0	0	111	K81 W82 M101 C134 K138 L155 V162 P165 N214	K81-W136 HydrophobicContact CD-CH2 4.28Å; K81-W136 HydrophobicContact CD-CZ2 4.21Å; K81-W136 HydrophobicContact CG-CH2 4.1Å; K81-W136 HydrophobicContact CG-CZ2 3.6Å; W82-W136 HydrophobicContact CB-CZ2 4.29Å; W82-W136 WeakPolarHBondContact O-CH2 3.34Å; W82-W136 WeakPolarHBondContact O-CZ2 3.47Å; M101-W136 HydrophobicContact CE-CB 3.95Å; M101-W136 HydrophobicContact CE-CD2 4.39Å; M101-W136 HydrophobicContact CE-CG 3.94Å; M101-W136 HydrophobicContact SD-CG 4.25Å; C134-W136 VanDerWaalsContact C-N 3.25Å; C134-W136 PolarHBondContact O-N 3.15Å; C134-W136 PolarHBondContact SG-N 3.26Å; W136-K138 WeakPolarHBondContact O-CD 3.4Å; W136-K138 WeakPolarHBondContact O-CE 3.49Å; W136-K138 PolarHBondContact O-N 2.86Å; W136-K138 PolarHBondContact O-NZ 3.06Å; W136-K138 VanDerWaalsContact O-NZ 3.16Å; W136-L155 HydrophobicContact CE3-CD2 4.13Å; W136-V162 HydrophobicContact CE3-CG1 4.18Å; W136-V162 HydrophobicContact CZ3-CG1 3.9Å; W136-P165 HydrophobicContact CH2-CG 3.44Å; W136-P165 VanDerWaalsContact CH2-CG 3.44Å; W136-P165 HydrophobicContact CZ2-CG 3.36Å; W136-P165 HydrophobicContact CZ3-CG 4.37Å; W136-N214 HydrophobicContact CH2-CB 4.01Å; W136-N214 HydrophobicContact CZ3-CB 4.04Å
137	C	89.3	Confident	90	Very high	19 Å²	19	49.6 Å²	49.6	13%	0.128	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-2.8	-174.6	68.6	0	0	0	0	116.3	H103 A139 P154 L155	H103-C137 PolarHBondContact CE1-SG 3.02Å; C137-A139 PolarHBondContact O-N 3.17Å; C137-A139 VanDerWaalsContact SG-CB 3.6Å; C137-P154 HydrophobicContact CB-CG 4.29Å; C137-L155 VanDerWaalsContact CA-O 3.3Å; C137-L155 WeakPolarHBondContact CA-O 3.41Å
138	K	89.8	Confident	90.2	Very high	73 Å²	73	49.1 Å²	49.1	32%	0.317	25%	0.245	S	C	.	.			trans	61.8	2.1	-178.7	-39.9	-53.4	173.7	-159.2	0	116	C134 L135 W136 Q211	C134-K138 WeakPolarHBondContact O-CA 3.34Å; C134-K138 PolarHBondContact O-N 2.78Å; L135-K138 PolarHBondContact O-NZ 2.94Å; W136-K138 WeakPolarHBondContact O-CD 3.4Å; W136-K138 WeakPolarHBondContact O-CE 3.49Å; W136-K138 PolarHBondContact O-N 2.86Å; W136-K138 PolarHBondContact O-NZ 3.06Å; W136-K138 VanDerWaalsContact O-NZ 3.16Å; K138-Q211 PolarHBondContact NZ-O 3.36Å
139	A	90.9	Very high	90.3	Very high	15 Å²	15	44.4 Å²	44.4	12%	0.124	23%	0.23	C	C	.	.			trans	-50.2	140.9	171.9	0	0	0	0	0	111.1	R133 C134 C137 L149	R133-A139 WeakPolarHBondContact CA-O 3.28Å; C134-A139 PolarHBondContact N-O 3.26Å; C137-A139 PolarHBondContact O-N 3.17Å; C137-A139 VanDerWaalsContact SG-CB 3.6Å; A139-L149 HydrophobicContact CB-CD2 4.38Å
140	M	93.2	Very high	90.2	Very high	37 Å²	37	47.4 Å²	47.4	18%	0.182	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	136.1	-179	-66.8	172.3	-64.3	0	0	108.4	A114 C116 S117 W132 R133	A114-M140 HydrophobicContact CB-CE 3.76Å; A114-M140 HydrophobicContact CB-SD 3.53Å; A114-M140 VanDerWaalsContact CB-SD 3.53Å; C116-M140 CarbonylContact C-O 3.57Å; C116-M140 VanDerWaalsContact CA-O 3.25Å; C116-M140 WeakPolarHBondContact CA-O 3.49Å; S117-M140 PolarHBondContact N-O 2.72Å; S117-M140 PolarHBondContact OG-N 2.95Å; S117-M140 PolarHBondContact OG-O 2.58Å; W132-M140 CarbonylContact O-C 3.45Å; W132-M140 VanDerWaalsContact O-CA 3.26Å; W132-M140 WeakPolarHBondContact O-CA 3.23Å; R133-M140 HydrophobicContact CB-CG 4.09Å; R133-M140 HydrophobicContact CG-CG 3.88Å
141	V	94.1	Very high	90	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	141.4	-175	-63.2	0	0	0	0	111.4	W105 V118 D131 W132 C145 K146 L149	W105-V141 HydrophobicContact CE3-CG2 4.27Å; W105-V141 HydrophobicContact CH2-CG1 4.1Å; W105-V141 HydrophobicContact CH2-CG2 3.58Å; W105-V141 HydrophobicContact CZ2-CG2 4.28Å; W105-V141 HydrophobicContact CZ3-CG2 3.57Å; V118-V141 HydrophobicContact CG2-CG1 4.09Å; D131-V141 WeakPolarHBondContact CB-O 3.45Å; W132-V141 HydrophobicContact CB-CG2 4.01Å; W132-V141 PolarHBondContact N-O 3.08Å; W132-V141 PolarHBondContact O-N 3.18Å; V141-C145 HydrophobicContact CB-CB 4.45Å; V141-K146 HydrophobicContact CG2-CB 3.96Å; V141-K146 HydrophobicContact CG2-CG 4.26Å; V141-L149 HydrophobicContact CG1-CD2 4.14Å
142	H	93.4	Very high	89.8	Confident	39 Å²	39	52 Å²	52	18%	0.181	28%	0.281	C	S	.	.			trans	-61.4	152.1	165.5	-58	104.2	0	0	0	110.4	C116 T122 C123 D131 G144 C145 K146	C116-H142 VanDerWaalsContact CB-CE1 3.42Å; C116-H142 WeakPolarHBondContact CB-CE1 3.48Å; C116-H142 VanDerWaalsContact CB-ND1 3.33Å; C116-H142 WeakPolarHBondContact CB-ND1 3.4Å; T122-H142 PolarHBondContact O-CE1 2.83Å; T122-H142 PolarHBondContact O-NE2 2.92Å; C123-H142 WeakPolarHBondContact CB-NE2 3.5Å; D131-H142 VanDerWaalsContact OD1-CA 3.25Å; D131-H142 WeakPolarHBondContact OD1-CA 3.49Å; D131-H142 IonicContact OD1-CD2 3.82Å; D131-H142 IonicContact OD2-CD2 2.7Å; D131-H142 PolarHBondContact OD2-CD2 3.31Å; H142-G144 PolarHBondContact O-N 2.78Å; H142-G144 VanDerWaalsContact O-N 3.14Å; H142-C145 HydrophobicContact CB-CB 4.23Å; H142-C145 PolarHBondContact O-N 2.92Å; H142-K146 PolarHBondContact O-N 2.87Å; H142-K146 VanDerWaalsContact O-N 3.13Å
143	S	90.9	Very high	89.5	Confident	61 Å²	61	49.6 Å²	49.6	43%	0.427	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-39.4	178.6	-66.3	0	0	0	0	113.7	D131 W132	D131-S143 PolarHBondContact OD1-N 3.32Å; W132-S143 PolarHBondContact NE1-OG 3.2Å; W132-S143 VanDerWaalsContact NE1-OG 3.09Å
144	G	89.9	Confident	89.2	Confident	56 Å²	56	51.8 Å²	51.8	58%	0.577	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-8.9	176.7	0	0	0	0	0	115.8	H142	H142-G144 PolarHBondContact O-N 2.78Å; H142-G144 VanDerWaalsContact O-N 3.14Å
145	C	91.3	Very high	88.7	Confident	17 Å²	17	53.1 Å²	53.1	12%	0.115	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-8.4	173.3	-66.8	0	0	0	0	112.5	V118 V141 H142 E147 Q148	V118-C145 HydrophobicContact CB-CB 4.1Å; V118-C145 HydrophobicContact CG1-CB 4.3Å; V118-C145 HydrophobicContact CG2-CB 4.38Å; V141-C145 HydrophobicContact CB-CB 4.45Å; H142-C145 HydrophobicContact CB-CB 4.23Å; H142-C145 PolarHBondContact O-N 2.92Å; C145-E147 VanDerWaalsContact C-N 3.28Å; C145-E147 PolarHBondContact O-N 3.07Å; C145-Q148 PolarHBondContact O-N 3.4Å; C145-Q148 VanDerWaalsContact O-N 3.13Å
146	K	88.4	Confident	88.4	Confident	81 Å²	81	53.8 Å²	53.8	35%	0.352	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-58.3	-39.4	-178.8	-174.9	-168.4	171.6	-162.6	0	112.6	W105 V141 H142 Q148	W105-K146 VanDerWaalsContact CD1-CE 3.46Å; W105-K146 HydrophobicContact CZ2-CG 4.39Å; V141-K146 HydrophobicContact CG2-CB 3.96Å; V141-K146 HydrophobicContact CG2-CG 4.26Å; H142-K146 PolarHBondContact O-N 2.87Å; H142-K146 VanDerWaalsContact O-N 3.13Å; K146-Q148 VanDerWaalsContact C-N 3.28Å; K146-Q148 PolarHBondContact O-N 2.81Å
147	E	86.4	Confident	87.8	Confident	180 Å²	180	58.7 Å²	58.7	84%	0.841	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-80.1	-8.1	-178.9	-66.2	168.5	-171.4	0	0	113.4	C145	C145-E147 VanDerWaalsContact C-N 3.28Å; C145-E147 PolarHBondContact O-N 3.07Å
148	Q	86.7	Confident	87.4	Confident	133 Å²	133	58.4 Å²	58.4	62%	0.621	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-95.6	-6.4	178.2	-64	171	0.3	0	0	112.3	V118 C145 K146	V118-Q148 HydrophobicContact CG1-CB 3.82Å; C145-Q148 PolarHBondContact O-N 3.4Å; C145-Q148 VanDerWaalsContact O-N 3.13Å; K146-Q148 VanDerWaalsContact C-N 3.28Å; K146-Q148 PolarHBondContact O-N 2.81Å
149	L	85.9	Confident	87	Confident	43 Å²	43	61 Å²	61	23%	0.225	34%	0.342	C	S	.	.	S	Bend	trans	-90.9	154.2	172.7	-166.7	67.9	0	0	0	110	W105 V118 A139 V141	W105-L149 HydrophobicContact CH2-CD2 3.72Å; W105-L149 HydrophobicContact CZ2-CD2 3.97Å; V118-L149 HydrophobicContact CG2-CB 4.19Å; V118-L149 HydrophobicContact CG2-CD1 4.12Å; A139-L149 HydrophobicContact CB-CD2 4.38Å; V141-L149 HydrophobicContact CG1-CD2 4.14Å
150	S	85	Confident	86.5	Confident	69 Å²	69	62.7 Å²	62.7	48%	0.483	35%	0.35	S	S	.	.			trans	-56	141.8	173.9	54.9	0	0	0	0	112.3	H103 K152	H103-S150 PolarHBondContact CD2-O 3.33Å; H103-S150 PolarHBondContact NE2-O 3.03Å; S150-K152 PolarHBondContact OG-O 3.37Å
151	S	83.7	Confident	86.2	Confident	79 Å²	79	60.9 Å²	60.9	55%	0.552	34%	0.341	S	S	*	.	S	Bend	trans	-65.3	-41	172	52.9	0	0	0	0	111.8	H103	H103-S151 PolarHBondContact N-O 2.83Å
152	K	87.1	Confident	85.9	Confident	74 Å²	74	61 Å²	61	32%	0.322	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-69.7	128.7	174.7	-53.2	-171	-176.3	-163.5	0	110.7	D95 S100 H103 S150	D95-K152 VanDerWaalsContact CG-CE 3.46Å; D95-K152 WeakPolarHBondContact OD1-CE 3.39Å; D95-K152 IonicContact OD1-NZ 3.73Å; D95-K152 PolarHBondContact OD1-NZ 3.48Å; D95-K152 WeakPolarHBondContact OD2-CE 3.43Å; D95-K152 IonicContact OD2-NZ 2.97Å; D95-K152 PolarHBondContact OD2-NZ 2.83Å; S100-K152 WeakPolarHBondContact OG-CD 3.31Å; S100-K152 WeakPolarHBondContact OG-CE 3.37Å; S100-K152 PolarHBondContact OG-NZ 2.82Å; H103-K152 PolarHBondContact NE2-O 3.03Å; S150-K152 PolarHBondContact OG-O 3.37Å
153	C	87.4	Confident	85.5	Confident	12 Å²	12	59.3 Å²	59.3	8%	0.081	33%	0.334	C	S	.	.			trans	-96.4	120	-176.6	-169.6	0	0	0	0	112.1	M101 H103 L155	M101-C153 HydrophobicContact CE-CB 3.68Å; M101-C153 VanDerWaalsContact O-CB 3.32Å; M101-C153 WeakPolarHBondContact O-CB 3.41Å; M101-C153 PolarHBondContact O-N 2.81Å; M101-C153 HydrophobicContact SD-CB 3.85Å; H103-C153 HydrophobicContact CB-CB 4.45Å; H103-C153 WeakPolarHBondContact NE2-CA 3.1Å; C153-L155 PolarHBondContact O-N 2.92Å
154	P	85.5	Confident	85.2	Confident	83 Å²	83	56.8 Å²	56.8	54%	0.539	32%	0.316	S	S	.	.			trans	-77.9	17.1	-172.8	33	-38.3	0	0	0	114.7	C137 G156	C137-P154 HydrophobicContact CB-CG 4.29Å; P154-G156 PolarHBondContact O-N 2.81Å
155	L	83.4	Confident	84.8	Confident	29 Å²	29	54.1 Å²	54.1	15%	0.152	29%	0.288	C	S	.	.			trans	57.5	-22.7	-172	-73.5	161	0	0	0	116.9	M101 W136 C137 C153 K159 V162 P164	M101-L155 HydrophobicContact CE-CD2 3.43Å; M101-L155 VanDerWaalsContact CE-CD2 3.43Å; M101-L155 HydrophobicContact CE-CG 3.79Å; W136-L155 HydrophobicContact CE3-CD2 4.13Å; C137-L155 VanDerWaalsContact CA-O 3.3Å; C137-L155 WeakPolarHBondContact CA-O 3.41Å; C153-L155 PolarHBondContact O-N 2.92Å; L155-K159 HydrophobicContact CB-CB 3.72Å; L155-K159 HydrophobicContact CD1-CB 4.41Å; L155-V162 HydrophobicContact CD2-CB 4.29Å; L155-V162 HydrophobicContact CD2-CG1 3.74Å; L155-P164 HydrophobicContact CD1-CB 4.28Å; L155-P164 HydrophobicContact CD2-CB 4.33Å
156	G	84.1	Confident	84.3	Confident	23 Å²	23	54 Å²	54	24%	0.237	29%	0.287	C	S	.	.			trans	88.4	-159.8	-179.5	0	0	0	0	0	113.3	P154 C158 K159	P154-G156 PolarHBondContact O-N 2.81Å; G156-C158 VanDerWaalsContact C-N 3.29Å; G156-C158 PolarHBondContact O-N 2.89Å; G156-K159 WeakPolarHBondContact O-CB 3.39Å; G156-K159 PolarHBondContact O-N 3.24Å
157	Q	77.9	Confident	83.8	Confident	109 Å²	109	50.3 Å²	50.3	51%	0.509	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-40.5	-173.7	-169.7	175.8	11.8	0	0	113.4	K159 E300	Q157-K159 VanDerWaalsContact C-N 3.3Å; Q157-K159 PolarHBondContact O-N 3.01Å; Q157-E300 PolarHBondContact NE2-OE2 2.93Å
158	C	79.5	Confident	83.3	Confident	14 Å²	14	41.8 Å²	41.8	10%	0.095	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	21.1	-175.8	-50.4	0	0	0	0	114.1	G156 V160 S161 V162 L213	G156-C158 VanDerWaalsContact C-N 3.29Å; G156-C158 PolarHBondContact O-N 2.89Å; C158-V160 PolarHBondContact O-N 2.82Å; C158-S161 PolarHBondContact O-N 2.79Å; C158-V162 HydrophobicContact CB-CG2 3.93Å; C158-V162 VanDerWaalsContact O-CG2 3.26Å; C158-V162 WeakPolarHBondContact O-CG2 3.32Å; C158-V162 PolarHBondContact O-N 3.02Å; C158-L213 HydrophobicContact CB-CD2 4.45Å
159	K	81.9	Confident	82.6	Confident	128 Å²	128	37.3 Å²	37.3	56%	0.557	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-28.1	-169	65.1	171.3	-173.8	170.7	0	115.2	L155 G156 Q157	L155-K159 HydrophobicContact CB-CB 3.72Å; L155-K159 HydrophobicContact CD1-CB 4.41Å; G156-K159 WeakPolarHBondContact O-CB 3.39Å; G156-K159 PolarHBondContact O-N 3.24Å; Q157-K159 VanDerWaalsContact C-N 3.3Å; Q157-K159 PolarHBondContact O-N 3.01Å
160	V	81.4	Confident	81.6	Confident	49 Å²	49	39.2 Å²	39.2	30%	0.297	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-40.9	179.9	-173.7	0	0	0	0	110.7	C158	C158-V160 PolarHBondContact O-N 2.82Å
161	S	85.9	Confident	80.6	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-20.2	179	-61.3	0	0	0	0	114.6	C158 L189 Q217 R240 E303	C158-S161 PolarHBondContact O-N 2.79Å; S161-L189 WeakPolarHBondContact O-CB 3.45Å; S161-L189 PolarHBondContact O-N 3.42Å; S161-Q217 PolarHBondContact O-NE2 3.12Å; S161-R240 PolarHBondContact OG-NH1 3.44Å; S161-R240 PolarHBondContact OG-NH2 2.87Å; S161-E303 VanDerWaalsContact CB-OE1 3.23Å; S161-E303 WeakPolarHBondContact CB-OE1 3.42Å; S161-E303 PolarHBondContact N-OE1 3.22Å; S161-E303 VanDerWaalsContact N-OE1 3.09Å; S161-E303 WeakPolarHBondContact OG-CG 3.18Å; S161-E303 PolarHBondContact OG-OE1 3.47Å
162	V	87.2	Confident	79.4	Confident	2 Å²	2	36.9 Å²	36.9	1%	0.012	20%	0.204	C	C	.	.			trans	-87.5	124.1	-178.1	179.1	0	0	0	0	111.1	W136 L155 C158 P164 L213	W136-V162 HydrophobicContact CE3-CG1 4.18Å; W136-V162 HydrophobicContact CZ3-CG1 3.9Å; L155-V162 HydrophobicContact CD2-CB 4.29Å; L155-V162 HydrophobicContact CD2-CG1 3.74Å; C158-V162 HydrophobicContact CB-CG2 3.93Å; C158-V162 VanDerWaalsContact O-CG2 3.26Å; C158-V162 WeakPolarHBondContact O-CG2 3.32Å; C158-V162 PolarHBondContact O-N 3.02Å; V162-P164 WeakPolarHBondContact O-CD 3.36Å; V162-L213 HydrophobicContact CG2-CD2 3.74Å
163	I	86.1	Confident	77.9	Confident	3 Å²	3	39.7 Å²	39.7	2%	0.015	23%	0.233	C	C	.	.			trans	-78.2	114.5	162.7	-60.9	174	0	0	0	107.8	A167 L168 P188 N214 Q217 F233 F236	I163-A167 HydrophobicContact CG2-CB 4.03Å; I163-L168 HydrophobicContact CG2-CD1 3.86Å; I163-L168 HydrophobicContact CG2-CD2 4Å; I163-L168 HydrophobicContact CG2-CG 3.64Å; I163-P188 HydrophobicContact CD1-CB 3.8Å; I163-P188 HydrophobicContact CG1-CB 3.52Å; I163-N214 VanDerWaalsContact O-CB 3.29Å; I163-N214 WeakPolarHBondContact O-CB 3.42Å; I163-N214 PolarHBondContact O-ND2 2.96Å; I163-N214 VanDerWaalsContact O-ND2 3.07Å; I163-Q217 HydrophobicContact CB-CG 4.39Å; I163-Q217 HydrophobicContact CD1-CG 4.29Å; I163-Q217 HydrophobicContact CG1-CG 4.41Å; I163-F233 HydrophobicContact CD1-CE1 3.7Å; I163-F233 HydrophobicContact CD1-CZ 3.58Å; I163-F236 HydrophobicContact CD1-CE2 4.08Å; I163-F236 HydrophobicContact CD1-CZ 3.82Å
164	P	83.5	Confident	76.5	Confident	8 Å²	8	44.9 Å²	44.9	5%	0.052	26%	0.26	C	S	.	.			trans	-66.8	147	177.2	28.9	-33.8	0	0	0	110.1	L155 V162 T166 A167	L155-P164 HydrophobicContact CD1-CB 4.28Å; L155-P164 HydrophobicContact CD2-CB 4.33Å; V162-P164 WeakPolarHBondContact O-CD 3.36Å; P164-T166 PolarHBondContact O-N 2.88Å; P164-T166 VanDerWaalsContact O-N 3.11Å; P164-A167 HydrophobicContact CG-CB 3.96Å; P164-A167 WeakPolarHBondContact O-CB 3.48Å; P164-A167 PolarHBondContact O-N 3.01Å
165	P	83.1	Confident	75.3	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-56.2	-29.2	176.8	-27.1	35.9	0	0	0	113.4	W82 T84 L85 I88 W136 A167 L168	W82-P165 HydrophobicContact CB-CB 4.23Å; W82-P165 HydrophobicContact CB-CG 3.98Å; T84-P165 CarbonylContact C-O 3.58Å; T84-P165 VanDerWaalsContact C-O 3.27Å; L85-P165 WeakPolarHBondContact CA-O 3.27Å; L85-P165 PolarHBondContact N-O 2.87Å; I88-P165 HydrophobicContact CD1-CB 4.11Å; I88-P165 HydrophobicContact CG1-CB 4.23Å; W136-P165 HydrophobicContact CH2-CG 3.44Å; W136-P165 VanDerWaalsContact CH2-CG 3.44Å; W136-P165 HydrophobicContact CZ2-CG 3.36Å; W136-P165 HydrophobicContact CZ3-CG 4.37Å; P165-A167 PolarHBondContact O-N 3.06Å; P165-L168 PolarHBondContact O-N 2.97Å; P165-L168 VanDerWaalsContact O-N 3.11Å
166	T	80.6	Confident	74	Confident	15 Å²	15	43.2 Å²	43.2	9%	0.092	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-62.5	-19.2	175.2	52.5	0	0	0	0	114.3	L85 I88 V99 M101 P164	L85-T166 HydrophobicContact CD1-CG2 4.38Å; I88-T166 HydrophobicContact CD1-CG2 3.46Å; I88-T166 VanDerWaalsContact CD1-CG2 3.46Å; V99-T166 HydrophobicContact CG1-CG2 3.82Å; M101-T166 HydrophobicContact CB-CG2 4.13Å; M101-T166 HydrophobicContact CG-CG2 4.26Å; P164-T166 PolarHBondContact O-N 2.88Å; P164-T166 VanDerWaalsContact O-N 3.11Å
167	A	76.5	Confident	73.1	Confident	3 Å²	3	42.3 Å²	42.3	3%	0.025	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-89.9	-10.6	176.4	0	0	0	0	0	113.7	I163 P164 P165 A179 S180 P182	I163-A167 HydrophobicContact CG2-CB 4.03Å; P164-A167 HydrophobicContact CG-CB 3.96Å; P164-A167 WeakPolarHBondContact O-CB 3.48Å; P164-A167 PolarHBondContact O-N 3.01Å; P165-A167 PolarHBondContact O-N 3.06Å; A167-A179 WeakPolarHBondContact O-CA 3.29Å; A167-S180 PolarHBondContact O-N 3.02Å; A167-S180 VanDerWaalsContact O-N 3.14Å; A167-P182 HydrophobicContact CB-CG 4.04Å
168	L	77.5	Confident	72	Confident	1 Å²	1	43 Å²	43	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	101.3	-176.2	-67.2	178.3	0	0	0	110.9	T84 L85 I163 P165 W177 A179 A216	T84-L168 CarbonylContact C-O 3.56Å; T84-L168 WeakPolarHBondContact CA-O 3.36Å; T84-L168 WeakPolarHBondContact CB-O 3.33Å; L85-L168 PolarHBondContact N-O 3.18Å; I163-L168 HydrophobicContact CG2-CD1 3.86Å; I163-L168 HydrophobicContact CG2-CD2 4Å; I163-L168 HydrophobicContact CG2-CG 3.64Å; P165-L168 PolarHBondContact O-N 2.97Å; P165-L168 VanDerWaalsContact O-N 3.11Å; L168-W177 HydrophobicContact CB-CE3 4.41Å; L168-W177 HydrophobicContact CD2-CB 4.16Å; L168-W177 HydrophobicContact CD2-CD2 4.06Å; L168-W177 HydrophobicContact CD2-CE3 4.38Å; L168-W177 HydrophobicContact CD2-CG 3.94Å; L168-A179 HydrophobicContact CD2-CB 4.21Å; L168-A216 HydrophobicContact CD1-CB 4.1Å
169	N	71.3	Confident	71.1	Confident	40 Å²	40	43.9 Å²	43.9	21%	0.214	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	-178.1	165.4	-54.7	-63.2	0	0	0	110	L85 W177 K178 S180	L85-N169 VanDerWaalsContact CD2-OD1 3.28Å; L85-N169 WeakPolarHBondContact CD2-OD1 3.43Å; N169-W177 VanDerWaalsContact O-CE3 3.26Å; N169-W177 WeakPolarHBondContact O-CZ3 3.46Å; N169-K178 HydrophobicContact CB-CB 4.18Å; N169-K178 WeakPolarHBondContact CB-O 3.37Å; N169-K178 PolarHBondContact ND2-O 3.06Å; N169-S180 PolarHBondContact ND2-OG 3.31Å
170	S	64.9	Low	70	Confident	82 Å²	82	40.8 Å²	40.8	57%	0.573	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-57.8	158.3	176.4	50	0	0	0	0	112.6	D172	S170-D172 PolarHBondContact O-N 3.27Å
171	I	64.2	Low	68.6	Low	58 Å²	58	41.5 Å²	41.5	30%	0.297	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	129	168.3	-53.4	176.8	0	0	0	107.5	F27 F176 W177	F27-I171 HydrophobicContact CD2-CD1 4.37Å; F27-I171 HydrophobicContact CE2-CD1 4.14Å; I171-F176 CarbonylContact C-O 3.53Å; I171-F176 WeakPolarHBondContact CA-O 3.39Å; I171-W177 HydrophobicContact CD1-CH2 4.14Å; I171-W177 HydrophobicContact CD1-CZ2 4.42Å; I171-W177 HydrophobicContact CD1-CZ3 4.37Å; I171-W177 HydrophobicContact CG1-CD2 4.27Å; I171-W177 HydrophobicContact CG1-CE3 3.77Å; I171-W177 HydrophobicContact CG1-CH2 3.79Å; I171-W177 HydrophobicContact CG1-CZ2 4.29Å; I171-W177 HydrophobicContact CG1-CZ3 3.52Å
172	D	58.9	Low	66.9	Low	41 Å²	41	43.3 Å²	43.3	22%	0.219	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-63.1	159.2	174.2	-67.6	-48.6	0	0	0	110.6	S170 D174 G175 F176 K235	S170-D172 PolarHBondContact O-N 3.27Å; D172-D174 PolarHBondContact O-N 3.04Å; D172-G175 PolarHBondContact O-N 3.14Å; D172-F176 PolarHBondContact N-O 2.99Å; D172-K235 IonicContact OD2-NZ 2.78Å; D172-K235 PolarHBondContact OD2-NZ 3.35Å
173	S	54.3	Low	65.1	Low	133 Å²	133	49.7 Å²	49.7	93%	0.93	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-30	176.7	-56.5	0	0	0	0	113.7	G175	S173-G175 VanDerWaalsContact C-N 3.31Å; S173-G175 PolarHBondContact O-N 2.83Å
174	D	58	Low	63.3	Low	121 Å²	121	53.9 Å²	53.9	65%	0.647	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	0.8	179.8	-47.1	-60.1	0	0	0	113.9	D172 F176	D172-D174 PolarHBondContact O-N 3.04Å; D174-F176 HydrophobicContact CB-CD2 3.87Å; D174-F176 HydrophobicContact CB-CE2 4.02Å
175	G	60.8	Low	62	Low	26 Å²	26	54 Å²	54	27%	0.268	34%	0.335	S	S	.	.	S	Bend	trans	88.1	17.2	175.6	0	0	0	0	0	116.1	D172 S173 L232	D172-G175 PolarHBondContact O-N 3.14Å; S173-G175 VanDerWaalsContact C-N 3.31Å; S173-G175 PolarHBondContact O-N 2.83Å; G175-L232 WeakPolarHBondContact O-CD2 3.35Å
176	F	56.1	Low	61	Low	51 Å²	51	59.3 Å²	59.3	22%	0.224	37%	0.367	C	S	.	.			trans	-102	152.9	177	-62.6	-82.5	0	0	0	112.5	I171 D172 D174 R231 K235	I171-F176 CarbonylContact C-O 3.53Å; I171-F176 WeakPolarHBondContact CA-O 3.39Å; D172-F176 PolarHBondContact N-O 2.99Å; D174-F176 HydrophobicContact CB-CD2 3.87Å; D174-F176 HydrophobicContact CB-CE2 4.02Å; F176-R231 HydrophobicContact CD1-CG 4.19Å; F176-R231 WeakPolarHBondContact CD1-O 3.34Å; F176-R231 HydrophobicContact CE1-CG 3.72Å; F176-R231 HydrophobicContact CZ-CG 4.31Å; F176-K235 HydrophobicContact CB-CD 4.23Å; F176-K235 VanDerWaalsContact CB-CE 3.49Å
177	W	64.9	Low	60.8	Low	5 Å²	5	59.5 Å²	59.5	2%	0.019	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	129.8	164.5	-76.3	125.4	0	0	0	110.7	F27 T84 L168 N169 I171 A179 A216 L232 K235	F27-W177 HydrophobicContact CD2-CH2 4.4Å; F27-W177 HydrophobicContact CE1-CZ2 4.37Å; F27-W177 HydrophobicContact CE2-CH2 4.48Å; F27-W177 HydrophobicContact CE2-CZ2 4.33Å; F27-W177 HydrophobicContact CG-CH2 4.5Å; F27-W177 HydrophobicContact CZ-CZ2 4.18Å; T84-W177 HydrophobicContact CG2-CH2 3.62Å; T84-W177 HydrophobicContact CG2-CZ3 3.53Å; L168-W177 HydrophobicContact CB-CE3 4.41Å; L168-W177 HydrophobicContact CD2-CB 4.16Å; L168-W177 HydrophobicContact CD2-CD2 4.06Å; L168-W177 HydrophobicContact CD2-CE3 4.38Å; L168-W177 HydrophobicContact CD2-CG 3.94Å; N169-W177 VanDerWaalsContact O-CE3 3.26Å; N169-W177 WeakPolarHBondContact O-CZ3 3.46Å; I171-W177 HydrophobicContact CD1-CH2 4.14Å; I171-W177 HydrophobicContact CD1-CZ2 4.42Å; I171-W177 HydrophobicContact CD1-CZ3 4.37Å; I171-W177 HydrophobicContact CG1-CD2 4.27Å; I171-W177 HydrophobicContact CG1-CE3 3.77Å; I171-W177 HydrophobicContact CG1-CH2 3.79Å; I171-W177 HydrophobicContact CG1-CZ2 4.29Å; I171-W177 HydrophobicContact CG1-CZ3 3.52Å; W177-A179 PolarHBondContact O-N 3.36Å; W177-A216 HydrophobicContact CZ2-CB 3.85Å; W177-L232 HydrophobicContact CD2-CD2 4.41Å; W177-L232 HydrophobicContact CG-CD2 4.08Å; W177-K235 WeakPolarHBondContact O-CD 3.45Å
178	K	56.2	Low	61.3	Low	123 Å²	123	59.5 Å²	59.5	54%	0.535	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	70.1	165.1	-168.3	170.2	-172.9	168.1	0	110.2	N169 S180	N169-K178 HydrophobicContact CB-CB 4.18Å; N169-K178 WeakPolarHBondContact CB-O 3.37Å; N169-K178 PolarHBondContact ND2-O 3.06Å; K178-S180 PolarHBondContact O-N 3.37Å
179	A	60.1	Low	62	Low	32 Å²	32	59.4 Å²	59.4	26%	0.264	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	108.3	-177.6	0	0	0	0	0	111.5	A167 L168 W177 C181 F236	A167-A179 WeakPolarHBondContact O-CA 3.29Å; L168-A179 HydrophobicContact CD2-CB 4.21Å; W177-A179 PolarHBondContact O-N 3.36Å; A179-C181 PolarHBondContact O-N 3.33Å; A179-F236 HydrophobicContact CB-CE1 4.01Å; A179-F236 HydrophobicContact CB-CE2 4.24Å; A179-F236 HydrophobicContact CB-CZ 3.56Å
180	S	58.3	Low	63	Low	63 Å²	63	57.5 Å²	57.5	44%	0.441	36%	0.358	S	S	.	.			trans	-85.9	84.9	168.4	46.3	0	0	0	0	108.2	A167 N169 K178 P182	A167-S180 PolarHBondContact O-N 3.02Å; A167-S180 VanDerWaalsContact O-N 3.14Å; N169-S180 PolarHBondContact ND2-OG 3.31Å; K178-S180 PolarHBondContact O-N 3.37Å; S180-P182 VanDerWaalsContact O-CD 3.24Å; S180-P182 WeakPolarHBondContact O-CD 3.4Å
181	C	51.7	Low	64.4	Low	65 Å²	65	53.6 Å²	53.6	44%	0.439	33%	0.331	S	S	.	.			trans	-68.2	116.6	-169.6	-159.3	0	0	0	0	111.9	A179	A179-C181 PolarHBondContact O-N 3.33Å
182	P	51.1	Low	65.8	Low	37 Å²	37	50.9 Å²	50.9	24%	0.24	32%	0.317	C	S	.	.			trans	-73.4	150.4	175.2	-14.3	30.7	0	0	0	110.6	A167 S180 S184 C185	A167-P182 HydrophobicContact CB-CG 4.04Å; S180-P182 VanDerWaalsContact O-CD 3.24Å; S180-P182 WeakPolarHBondContact O-CD 3.4Å; P182-S184 PolarHBondContact O-N 2.99Å; P182-C185 PolarHBondContact O-N 3.22Å
183	P	49.3	Very low	67.4	Low	136 Å²	136	48.9 Å²	48.9	88%	0.883	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-14.7	179	-27.8	35.6	0	0	0	115.8
184	S	48.8	Very low	69.2	Low	92 Å²	92	43.4 Å²	43.4	64%	0.643	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-7.9	178.6	55.9	0	0	0	0	115.3	P182	P182-S184 PolarHBondContact O-N 2.99Å
185	C	55.8	Low	70.5	Confident	11 Å²	11	38.4 Å²	38.4	7%	0.074	24%	0.241	C	C	.	.			trans	-105.6	64.2	-177.3	-158.7	0	0	0	0	112.5	P182 S187	P182-C185 PolarHBondContact O-N 3.22Å; C185-S187 VanDerWaalsContact C-N 3.3Å; C185-S187 PolarHBondContact O-N 3.4Å
186	T	62.2	Low	71.5	Confident	110 Å²	110	43.6 Å²	43.6	68%	0.675	26%	0.256	S	S	*	.	S	Bend	trans	-67.8	-21	-171.4	-34.3	0	0	0	0	115
187	S	76.2	Confident	72.6	Confident	20 Å²	20	41.9 Å²	41.9	14%	0.14	25%	0.251	C	S	.	.	S	Bend	trans	-160.8	84.7	179.4	-174.7	0	0	0	0	111.5	C185 R240	C185-S187 VanDerWaalsContact C-N 3.3Å; C185-S187 PolarHBondContact O-N 3.4Å; S187-R240 PolarHBondContact O-NH2 2.98Å; S187-R240 PolarHBondContact OG-NE 2.92Å
188	P	86.9	Confident	72.9	Confident	2 Å²	2	42 Å²	42	1%	0.013	25%	0.254	C	S	.	.			trans	-67.5	157	-180	28.4	-34.6	0	0	0	112.1	I163 F233 F236 F239 R240	I163-P188 HydrophobicContact CD1-CB 3.8Å; I163-P188 HydrophobicContact CG1-CB 3.52Å; P188-F233 HydrophobicContact CB-CE1 4.41Å; P188-F236 HydrophobicContact CG-CD1 4.05Å; P188-F236 HydrophobicContact CG-CE1 4.31Å; P188-F236 HydrophobicContact CG-CG 4.25Å; P188-F239 HydrophobicContact CG-CB 3.98Å; P188-R240 PolarHBondContact O-N 3.49Å
189	L	91.3	Very high	73.8	Confident	0 Å²	0	40 Å²	40	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	125.3	179.9	-177.4	63.9	0	0	0	111.9	S161 V191 L213 Q217 R240 L242 L299 L302	S161-L189 WeakPolarHBondContact O-CB 3.45Å; S161-L189 PolarHBondContact O-N 3.42Å; L189-V191 HydrophobicContact CD2-CG2 3.98Å; L189-V191 HydrophobicContact CG-CG2 3.9Å; L189-L213 HydrophobicContact CD2-CD1 4.01Å; L189-L213 HydrophobicContact CG-CD1 4.5Å; L189-Q217 PolarHBondContact O-NE2 2.96Å; L189-R240 CarbonylContact C-O 3.46Å; L189-R240 WeakPolarHBondContact CA-O 3.33Å; L189-R240 HydrophobicContact CD1-CB 3.77Å; L189-L242 HydrophobicContact CD1-CB 4.08Å; L189-L299 HydrophobicContact CD2-CD2 3.37Å; L189-L302 HydrophobicContact CD1-CD2 3.72Å; L189-L302 HydrophobicContact CD2-CD2 3.99Å
190	L	92.4	Very high	74.4	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	131.7	167.1	174.8	58.4	0	0	0	109	F192 F219 L230 F233 F239 R240 I241 L242	L190-F192 HydrophobicContact CD1-CE2 4.43Å; L190-F192 HydrophobicContact CD1-CZ 4.22Å; L190-F192 HydrophobicContact CD2-CE2 3.56Å; L190-F192 HydrophobicContact CD2-CZ 3.72Å; L190-F192 HydrophobicContact CG-CD2 4.36Å; L190-F192 HydrophobicContact CG-CE2 3.78Å; L190-F192 HydrophobicContact CG-CZ 4.03Å; L190-F219 HydrophobicContact CD1-CD2 3.57Å; L190-F219 HydrophobicContact CD1-CE2 3.57Å; L190-L230 HydrophobicContact CD2-CD2 4.01Å; L190-F233 HydrophobicContact CB-CD1 4.06Å; L190-F233 HydrophobicContact CB-CE1 3.88Å; L190-F233 HydrophobicContact CB-CE2 4.41Å; L190-F233 HydrophobicContact CB-CG 4.39Å; L190-F233 HydrophobicContact CB-CZ 4.06Å; L190-F233 HydrophobicContact CD1-CD2 4.01Å; L190-F233 HydrophobicContact CD1-CE2 3.78Å; L190-F233 HydrophobicContact CD1-CZ 4.16Å; L190-F233 HydrophobicContact CD2-CB 4.34Å; L190-F233 HydrophobicContact CD2-CD2 4.22Å; L190-F233 HydrophobicContact CD2-CG 4.13Å; L190-F233 HydrophobicContact CG-CD2 4.5Å; L190-F239 HydrophobicContact CB-CD2 4.39Å; L190-F239 HydrophobicContact CD2-CE2 4.06Å; L190-R240 PolarHBondContact N-O 3.37Å; L190-I241 HydrophobicContact CB-CG1 4.45Å; L190-I241 HydrophobicContact CD2-CG1 4.42Å; L190-I241 CarbonylContact O-C 3.19Å; L190-I241 VanDerWaalsContact O-CA 3.31Å; L190-I241 WeakPolarHBondContact O-CA 3.24Å; L190-L242 PolarHBondContact O-N 3.05Å
191	V	94.3	Very high	75.3	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	122.3	-179.3	-172.6	0	0	0	0	111.1	L189 V193 F209 L213 Q217 V218 F219 L242	L189-V191 HydrophobicContact CD2-CG2 3.98Å; L189-V191 HydrophobicContact CG-CG2 3.9Å; V191-V193 HydrophobicContact CG1-CG2 3.92Å; V191-F209 HydrophobicContact CB-CD1 4.48Å; V191-F209 HydrophobicContact CG1-CD1 3.93Å; V191-F209 HydrophobicContact CG1-CD2 3.86Å; V191-F209 HydrophobicContact CG1-CE1 3.89Å; V191-F209 HydrophobicContact CG1-CE2 3.83Å; V191-F209 HydrophobicContact CG1-CG 3.92Å; V191-F209 HydrophobicContact CG1-CZ 3.82Å; V191-F209 HydrophobicContact CG2-CD1 4.07Å; V191-F209 HydrophobicContact CG2-CE1 4.17Å; V191-L213 HydrophobicContact CG2-CD1 3.43Å; V191-L213 VanDerWaalsContact CG2-CD1 3.43Å; V191-Q217 PolarHBondContact N-O 2.82Å; V191-V218 WeakPolarHBondContact O-CA 3.48Å; V191-F219 PolarHBondContact O-N 3.15Å; V191-L242 HydrophobicContact CG1-CB 4.46Å; V191-L242 HydrophobicContact CG1-CD2 4.49Å; V191-L242 HydrophobicContact CG2-CB 4.33Å
192	F	94.7	Very high	76.9	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	129.2	170.4	-70.5	-65.1	0	0	0	109.6	L190 F219 L221 P226 L230 I241 L242 C244 V253	L190-F192 HydrophobicContact CD1-CE2 4.43Å; L190-F192 HydrophobicContact CD1-CZ 4.22Å; L190-F192 HydrophobicContact CD2-CE2 3.56Å; L190-F192 HydrophobicContact CD2-CZ 3.72Å; L190-F192 HydrophobicContact CG-CD2 4.36Å; L190-F192 HydrophobicContact CG-CE2 3.78Å; L190-F192 HydrophobicContact CG-CZ 4.03Å; F192-F219 HydrophobicContact CD1-CB 3.8Å; F192-F219 HydrophobicContact CE1-CB 3.87Å; F192-F219 HydrophobicContact CE1-CD2 4.34Å; F192-F219 HydrophobicContact CE1-CG 4.23Å; F192-L221 HydrophobicContact CB-CD1 4.11Å; F192-L221 HydrophobicContact CB-CD2 3.89Å; F192-L221 HydrophobicContact CB-CG 3.91Å; F192-L221 HydrophobicContact CD1-CD2 3.77Å; F192-L221 HydrophobicContact CD1-CG 4.43Å; F192-L221 HydrophobicContact CG-CD2 3.96Å; F192-L221 HydrophobicContact CG-CG 4.49Å; F192-P226 HydrophobicContact CE1-CB 4.29Å; F192-P226 HydrophobicContact CZ-CB 4.3Å; F192-P226 WeakPolarHBondContact CZ-O 3.33Å; F192-L230 HydrophobicContact CE2-CD2 4.11Å; F192-L230 HydrophobicContact CE2-CG 4.17Å; F192-L230 HydrophobicContact CZ-CD2 4.39Å; F192-L230 HydrophobicContact CZ-CG 4.02Å; F192-I241 HydrophobicContact CD2-CG2 3.8Å; F192-I241 HydrophobicContact CE2-CG2 4.09Å; F192-L242 PolarHBondContact N-O 2.88Å; F192-C244 WeakPolarHBondContact O-CB 3.39Å; F192-C244 PolarHBondContact O-N 3.41Å; F192-V253 HydrophobicContact CB-CG2 4.5Å; F192-V253 HydrophobicContact CD2-CG1 4.12Å; F192-V253 HydrophobicContact CD2-CG2 4.2Å; F192-V253 HydrophobicContact CE2-CG1 4.26Å; F192-V253 HydrophobicContact CG-CG2 4.38Å
193	V	92.6	Very high	78.5	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	128.3	176.9	-171.6	0	0	0	0	110	V191 S195 G202 F205 L206 F209 F219 D220 L221 C244	V191-V193 HydrophobicContact CG1-CG2 3.92Å; V193-S195 PolarHBondContact O-N 2.78Å; V193-G202 WeakPolarHBondContact CG1-O 3.28Å; V193-F205 HydrophobicContact CG1-CB 4.48Å; V193-L206 HydrophobicContact CB-CB 4.32Å; V193-L206 HydrophobicContact CB-CD1 3.94Å; V193-L206 HydrophobicContact CG1-CB 4.23Å; V193-L206 HydrophobicContact CG2-CB 4.47Å; V193-L206 HydrophobicContact CG2-CD1 4.05Å; V193-F209 HydrophobicContact CG2-CD2 3.79Å; V193-F209 HydrophobicContact CG2-CE2 4.03Å; V193-F219 PolarHBondContact N-O 3.19Å; V193-D220 CarbonylContact O-C 3.54Å; V193-D220 VanDerWaalsContact O-CA 3.3Å; V193-D220 WeakPolarHBondContact O-CA 3.27Å; V193-D220 VanDerWaalsContact O-OD1 3.05Å; V193-L221 PolarHBondContact O-N 3.03Å; V193-C244 HydrophobicContact CB-CB 4.28Å; V193-C244 HydrophobicContact CG1-CB 4.08Å; V193-C244 HydrophobicContact CG2-CB 4.08Å
194	N	90.9	Very high	80.3	Confident	18 Å²	18	36.6 Å²	36.6	10%	0.096	20%	0.203	C	C	.	.			trans	-82.6	103.6	167.7	179	-30.6	0	0	0	108.7	K196 S197 L221 C244 S249	N194-K196 PolarHBondContact O-N 3.23Å; N194-K196 PolarHBondContact OD1-N 3.02Å; N194-K196 VanDerWaalsContact OD1-N 3.12Å; N194-S197 PolarHBondContact ND2-OG 3.43Å; N194-S197 WeakPolarHBondContact O-CB 3.32Å; N194-S197 PolarHBondContact O-N 2.82Å; N194-S197 VanDerWaalsContact O-N 3.08Å; N194-S197 PolarHBondContact OD1-N 2.95Å; N194-S197 PolarHBondContact OD1-OG 2.81Å; N194-L221 HydrophobicContact CB-CD1 4.3Å; N194-C244 PolarHBondContact N-O 2.94Å; N194-S249 PolarHBondContact ND2-OG 2.74Å
195	S	85.6	Confident	82.2	Confident	15 Å²	15	32.2 Å²	32.2	11%	0.105	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-28	-176.3	50	0	0	0	0	115.1	V193 V203 D220	V193-S195 PolarHBondContact O-N 2.78Å; S195-V203 PolarHBondContact O-N 2.84Å; S195-D220 WeakPolarHBondContact CB-OD1 3.28Å; S195-D220 WeakPolarHBondContact CB-OD2 3.25Å; S195-D220 PolarHBondContact N-OD1 2.86Å; S195-D220 VanDerWaalsContact OG-CG 3.25Å; S195-D220 PolarHBondContact OG-OD1 3.3Å; S195-D220 PolarHBondContact OG-OD2 3.37Å
196	K	81.9	Confident	83.8	Confident	135 Å²	135	32.3 Å²	32.3	59%	0.587	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-17.5	178.1	-65.6	176.1	-175.7	177.5	0	113.1	N194 M222	N194-K196 PolarHBondContact O-N 3.23Å; N194-K196 PolarHBondContact OD1-N 3.02Å; N194-K196 VanDerWaalsContact OD1-N 3.12Å; K196-M222 HydrophobicContact CD-CE 4.05Å; K196-M222 HydrophobicContact CD-CG 4.17Å; K196-M222 HydrophobicContact CD-SD 4.23Å; K196-M222 HydrophobicContact CG-CG 4.11Å
197	S	79.2	Confident	85.1	Confident	16 Å²	16	29.9 Å²	29.9	11%	0.112	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	156.3	-178.7	-74.7	0	0	0	0	113.5	N194 N200 Q201 G202	N194-S197 PolarHBondContact ND2-OG 3.43Å; N194-S197 WeakPolarHBondContact O-CB 3.32Å; N194-S197 PolarHBondContact O-N 2.82Å; N194-S197 VanDerWaalsContact O-N 3.08Å; N194-S197 PolarHBondContact OD1-N 2.95Å; N194-S197 PolarHBondContact OD1-OG 2.81Å; S197-N200 PolarHBondContact O-N 2.93Å; S197-Q201 PolarHBondContact O-N 3.16Å; S197-G202 PolarHBondContact O-N 2.91Å
198	G	72.2	Confident	85.7	Confident	8 Å²	8	31.7 Å²	31.7	8%	0.082	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.8	32.3	173.2	0	0	0	0	0	115	Q201 L273	G198-Q201 VanDerWaalsContact O-CB 3.22Å; G198-Q201 WeakPolarHBondContact O-CB 3.29Å; G198-Q201 WeakPolarHBondContact O-CG 3.38Å; G198-Q201 PolarHBondContact O-N 3.34Å; G198-Q201 PolarHBondContact O-NE2 3.28Å; G198-L273 WeakPolarHBondContact CA-O 3.28Å; G198-L273 PolarHBondContact N-O 3.29Å
199	D	73.6	Confident	85.9	Confident	80 Å²	80	31.6 Å²	31.6	43%	0.428	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	49.5	-171.2	-148.4	-11.2	0	0	0	111.5	Q201 S666	D199-Q201 PolarHBondContact O-N 3.46Å; D199-S666 WeakPolarHBondContact OD2-CB 3.37Å; D199-S666 PolarHBondContact OD2-OG 3.03Å
200	N	72.8	Confident	85.8	Confident	79 Å²	79	31.9 Å²	31.9	42%	0.422	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.7	12.4	-174.2	-46.9	-85.9	0	0	0	115.2	S197 G202 V203	S197-N200 PolarHBondContact O-N 2.93Å; N200-G202 PolarHBondContact O-N 2.9Å; N200-V203 PolarHBondContact O-N 2.68Å
201	Q	78.3	Confident	85.7	Confident	27 Å²	27	33 Å²	33	13%	0.126	16%	0.16	C	C	.	.	H	α-helix	trans	-62.7	-24.9	170.3	-74.1	-173.8	93.5	0	0	112.8	S197 G198 D199 V203 K204 F205 D290	S197-Q201 PolarHBondContact O-N 3.16Å; G198-Q201 VanDerWaalsContact O-CB 3.22Å; G198-Q201 WeakPolarHBondContact O-CB 3.29Å; G198-Q201 WeakPolarHBondContact O-CG 3.38Å; G198-Q201 PolarHBondContact O-N 3.34Å; G198-Q201 PolarHBondContact O-NE2 3.28Å; D199-Q201 PolarHBondContact O-N 3.46Å; Q201-V203 PolarHBondContact O-N 2.7Å; Q201-V203 VanDerWaalsContact O-N 3.12Å; Q201-K204 HydrophobicContact CG-CD 4.38Å; Q201-K204 WeakPolarHBondContact O-CA 3.46Å; Q201-K204 VanDerWaalsContact O-CB 3.3Å; Q201-K204 WeakPolarHBondContact O-CB 3.47Å; Q201-K204 PolarHBondContact O-N 2.73Å; Q201-F205 HydrophobicContact CB-CD2 4.42Å; Q201-F205 HydrophobicContact CB-CE2 4.48Å; Q201-F205 WeakPolarHBondContact O-CD2 3.28Å; Q201-F205 PolarHBondContact O-N 3.32Å; Q201-F205 VanDerWaalsContact O-N 3.11Å; Q201-D290 PolarHBondContact NE2-OD1 3.43Å; Q201-D290 PolarHBondContact OE1-O 2.84Å
202	G	84.4	Confident	85.4	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-48.8	-39.1	174.4	0	0	0	0	0	113.4	V193 S197 N200 K204 F205 L206	V193-G202 WeakPolarHBondContact CG1-O 3.28Å; S197-G202 PolarHBondContact O-N 2.91Å; N200-G202 PolarHBondContact O-N 2.9Å; G202-K204 VanDerWaalsContact C-N 3.35Å; G202-K204 PolarHBondContact O-N 3.43Å; G202-F205 PolarHBondContact O-N 3.45Å; G202-L206 WeakPolarHBondContact O-CB 3.31Å; G202-L206 PolarHBondContact O-N 3.16Å
203	V	85.8	Confident	85.2	Confident	46 Å²	46	33.7 Å²	33.7	28%	0.279	16%	0.164	S	C	.	.	H	α-helix	trans	-63.8	-35.6	175.1	-177.9	0	0	0	0	112.6	S195 N200 Q201 R207	S195-V203 PolarHBondContact O-N 2.84Å; N200-V203 PolarHBondContact O-N 2.68Å; Q201-V203 PolarHBondContact O-N 2.7Å; Q201-V203 VanDerWaalsContact O-N 3.12Å; V203-R207 WeakPolarHBondContact O-CD 3.42Å; V203-R207 WeakPolarHBondContact O-CG 3.35Å; V203-R207 PolarHBondContact O-N 3.2Å
204	K	86.8	Confident	85	Confident	110 Å²	110	33.7 Å²	33.7	48%	0.478	16%	0.164	S	C	.	.	H	α-helix	trans	-66.2	-48.7	174.7	-55.7	178.7	-172	170.7	0	110.4	Q201 G202 R207 R208	Q201-K204 HydrophobicContact CG-CD 4.38Å; Q201-K204 WeakPolarHBondContact O-CA 3.46Å; Q201-K204 VanDerWaalsContact O-CB 3.3Å; Q201-K204 WeakPolarHBondContact O-CB 3.47Å; Q201-K204 PolarHBondContact O-N 2.73Å; G202-K204 VanDerWaalsContact C-N 3.35Å; G202-K204 PolarHBondContact O-N 3.43Å; K204-R207 WeakPolarHBondContact O-CB 3.36Å; K204-R207 PolarHBondContact O-N 3.47Å; K204-R208 WeakPolarHBondContact O-CB 3.44Å; K204-R208 PolarHBondContact O-N 3.44Å
205	F	89.3	Confident	84.9	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62.4	-46.5	179	-81.1	-90.5	0	0	0	111.6	V193 Q201 G202 R207 R208 F209 L271 L273 D292 L295	V193-F205 HydrophobicContact CG1-CB 4.48Å; Q201-F205 HydrophobicContact CB-CD2 4.42Å; Q201-F205 HydrophobicContact CB-CE2 4.48Å; Q201-F205 WeakPolarHBondContact O-CD2 3.28Å; Q201-F205 PolarHBondContact O-N 3.32Å; Q201-F205 VanDerWaalsContact O-N 3.11Å; G202-F205 PolarHBondContact O-N 3.45Å; F205-R207 VanDerWaalsContact C-N 3.32Å; F205-R207 PolarHBondContact O-N 2.89Å; F205-R208 CarbonylContact O-C 3.51Å; F205-R208 WeakPolarHBondContact O-CA 3.35Å; F205-R208 WeakPolarHBondContact O-CB 3.44Å; F205-R208 PolarHBondContact O-N 3.48Å; F205-F209 HydrophobicContact CB-CD2 4.37Å; F205-F209 HydrophobicContact CB-CE2 4.24Å; F205-F209 HydrophobicContact CD1-CE2 4.37Å; F205-F209 WeakPolarHBondContact O-CD2 3.34Å; F205-F209 PolarHBondContact O-N 3.1Å; F205-L271 HydrophobicContact CD1-CD2 3.76Å; F205-L271 HydrophobicContact CE1-CD2 3.88Å; F205-L273 HydrophobicContact CB-CD1 4.3Å; F205-L273 HydrophobicContact CD2-CD1 4.1Å; F205-L273 HydrophobicContact CD2-CD2 3.99Å; F205-L273 HydrophobicContact CE1-CD2 4.47Å; F205-L273 HydrophobicContact CE2-CD2 3.77Å; F205-L273 HydrophobicContact CG-CD1 4.15Å; F205-L273 HydrophobicContact CG-CD2 4.45Å; F205-L273 HydrophobicContact CZ-CD2 4.03Å; F205-D292 HydrophobicContact CE1-CB 4.47Å; F205-D292 HydrophobicContact CZ-CB 4.46Å; F205-L295 HydrophobicContact CD1-CD1 4.02Å; F205-L295 HydrophobicContact CD1-CD2 4.22Å; F205-L295 HydrophobicContact CE1-CD1 4.06Å
206	L	89	Confident	84.9	Confident	13 Å²	13	32.6 Å²	32.6	7%	0.068	16%	0.157	C	C	.	.	H	α-helix	trans	-52.9	-47.5	175.2	-175.4	76.9	0	0	0	111.8	V193 G202 K210 V218 D220	V193-L206 HydrophobicContact CB-CB 4.32Å; V193-L206 HydrophobicContact CB-CD1 3.94Å; V193-L206 HydrophobicContact CG1-CB 4.23Å; V193-L206 HydrophobicContact CG2-CB 4.47Å; V193-L206 HydrophobicContact CG2-CD1 4.05Å; G202-L206 WeakPolarHBondContact O-CB 3.31Å; G202-L206 PolarHBondContact O-N 3.16Å; L206-K210 WeakPolarHBondContact O-CG 3.36Å; L206-K210 PolarHBondContact O-N 3.48Å; L206-K210 VanDerWaalsContact O-N 3.1Å; L206-V218 HydrophobicContact CD1-CG1 3.85Å; L206-D220 HydrophobicContact CD1-CB 4.22Å; L206-D220 HydrophobicContact CD2-CB 4.16Å
207	R	88.3	Confident	85.2	Confident	59 Å²	59	26.1 Å²	26.1	22%	0.223	13%	0.129	C	C	.	.	H	α-helix	trans	-60.7	-44.8	174.5	-70.3	167.9	173.2	159.9	2.9	111.4	E62 V203 K204 F205 K210 Q211	E62-R207 HydrophobicContact CB-CG 4.05Å; E62-R207 HydrophobicContact CG-CG 4Å; E62-R207 IonicContact OE1-CZ 3.87Å; E62-R207 IonicContact OE1-NE 3.5Å; E62-R207 PolarHBondContact OE1-NE 2.78Å; E62-R207 IonicContact OE1-NH2 3.88Å; E62-R207 PolarHBondContact OE1-NH2 3.1Å; V203-R207 WeakPolarHBondContact O-CD 3.42Å; V203-R207 WeakPolarHBondContact O-CG 3.35Å; V203-R207 PolarHBondContact O-N 3.2Å; K204-R207 WeakPolarHBondContact O-CB 3.36Å; K204-R207 PolarHBondContact O-N 3.47Å; F205-R207 VanDerWaalsContact C-N 3.32Å; F205-R207 PolarHBondContact O-N 2.89Å; R207-K210 PolarHBondContact O-N 3.41Å; R207-Q211 VanDerWaalsContact O-CD 3.27Å; R207-Q211 WeakPolarHBondContact O-CG 3.41Å; R207-Q211 PolarHBondContact O-N 3.04Å; R207-Q211 VanDerWaalsContact O-N 3.1Å; R207-Q211 PolarHBondContact O-NE2 3.32Å
208	R	89.5	Confident	85.7	Confident	57 Å²	57	25.4 Å²	25.4	22%	0.215	12%	0.124	C	C	.	.	H	α-helix	trans	-64.3	-43.2	-179.1	-168.1	69.7	171.8	128.7	6.2	112	K204 F205 Q211 L212 D292 L295	K204-R208 WeakPolarHBondContact O-CB 3.44Å; K204-R208 PolarHBondContact O-N 3.44Å; F205-R208 CarbonylContact O-C 3.51Å; F205-R208 WeakPolarHBondContact O-CA 3.35Å; F205-R208 WeakPolarHBondContact O-CB 3.44Å; F205-R208 PolarHBondContact O-N 3.48Å; R208-Q211 WeakPolarHBondContact O-CB 3.29Å; R208-Q211 PolarHBondContact O-N 3.44Å; R208-L212 WeakPolarHBondContact O-CG 3.27Å; R208-L212 PolarHBondContact O-N 3.03Å; R208-L212 VanDerWaalsContact O-N 3.07Å; R208-D292 HydrophobicContact CB-CB 4.3Å; R208-D292 WeakPolarHBondContact CD-OD2 3.37Å; R208-D292 HydrophobicContact CG-CB 4.12Å; R208-D292 PolarHBondContact NE-O 2.84Å; R208-D292 IonicContact NE-OD2 2.71Å; R208-L295 HydrophobicContact CB-CD2 3.89Å; R208-L295 HydrophobicContact CG-CB 4.31Å; R208-L295 HydrophobicContact CG-CD2 3.56Å
209	F	91.2	Very high	86.6	Confident	0 Å²	0	26 Å²	26	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-60.4	-48.6	173.3	-77.5	-67.7	0	0	0	111.9	V191 V193 F205 Q211 L212 L213 V218 L242 C244 L271 L295 L299	V191-F209 HydrophobicContact CB-CD1 4.48Å; V191-F209 HydrophobicContact CG1-CD1 3.93Å; V191-F209 HydrophobicContact CG1-CD2 3.86Å; V191-F209 HydrophobicContact CG1-CE1 3.89Å; V191-F209 HydrophobicContact CG1-CE2 3.83Å; V191-F209 HydrophobicContact CG1-CG 3.92Å; V191-F209 HydrophobicContact CG1-CZ 3.82Å; V191-F209 HydrophobicContact CG2-CD1 4.07Å; V191-F209 HydrophobicContact CG2-CE1 4.17Å; V193-F209 HydrophobicContact CG2-CD2 3.79Å; V193-F209 HydrophobicContact CG2-CE2 4.03Å; F205-F209 HydrophobicContact CB-CD2 4.37Å; F205-F209 HydrophobicContact CB-CE2 4.24Å; F205-F209 HydrophobicContact CD1-CE2 4.37Å; F205-F209 WeakPolarHBondContact O-CD2 3.34Å; F205-F209 PolarHBondContact O-N 3.1Å; F209-Q211 PolarHBondContact O-N 2.86Å; F209-L212 CarbonylContact O-C 3.46Å; F209-L212 PolarHBondContact O-N 3.43Å; F209-L213 HydrophobicContact CD1-CD1 4.15Å; F209-L213 PolarHBondContact O-N 3.3Å; F209-V218 HydrophobicContact CB-CB 4.46Å; F209-V218 HydrophobicContact CB-CG1 3.6Å; F209-V218 HydrophobicContact CB-CG2 3.94Å; F209-L242 HydrophobicContact CE1-CD2 3.73Å; F209-L242 HydrophobicContact CZ-CD2 3.56Å; F209-C244 WeakPolarHBondContact CE2-SG 3.5Å; F209-L271 HydrophobicContact CE2-CD2 4.36Å; F209-L271 HydrophobicContact CZ-CD2 4.27Å; F209-L295 HydrophobicContact CD1-CD2 3.84Å; F209-L295 HydrophobicContact CD1-CG 4.47Å; F209-L295 HydrophobicContact CD2-CD2 4.05Å; F209-L295 HydrophobicContact CE1-CD1 3.89Å; F209-L295 HydrophobicContact CE1-CD2 3.79Å; F209-L295 HydrophobicContact CE1-CG 4.03Å; F209-L295 HydrophobicContact CE2-CD1 4.23Å; F209-L295 HydrophobicContact CE2-CD2 4Å; F209-L295 HydrophobicContact CG-CD2 3.98Å; F209-L295 HydrophobicContact CZ-CD1 3.6Å; F209-L295 HydrophobicContact CZ-CD2 3.89Å; F209-L295 HydrophobicContact CZ-CG 4.17Å; F209-L299 HydrophobicContact CE1-CD2 4.25Å
210	K	89.7	Confident	87.4	Confident	7 Å²	7	23.4 Å²	23.4	3%	0.03	11%	0.11	C	C	.	.	H	α-helix	trans	-60	-27.9	176.1	-69.2	-179.2	-176.2	-178.4	0	113.6	H26 V63 L206 R207 V218	H26-K210 VanDerWaalsContact CE1-CE 3.43Å; H26-K210 WeakPolarHBondContact CE1-CE 3.11Å; H26-K210 PolarHBondContact CE1-NZ 3.32Å; H26-K210 PolarHBondContact NE2-NZ 3.16Å; V63-K210 HydrophobicContact CG1-CB 4.44Å; V63-K210 HydrophobicContact CG2-CB 4.18Å; V63-K210 HydrophobicContact CG2-CD 4.33Å; L206-K210 WeakPolarHBondContact O-CG 3.36Å; L206-K210 PolarHBondContact O-N 3.48Å; L206-K210 VanDerWaalsContact O-N 3.1Å; R207-K210 PolarHBondContact O-N 3.41Å; K210-V218 WeakPolarHBondContact CE-O 3.25Å; K210-V218 HydrophobicContact CG-CB 3.84Å; K210-V218 HydrophobicContact CG-CG1 3.8Å; K210-V218 HydrophobicContact CG-CG2 4.38Å
211	Q	89.4	Confident	88.1	Confident	22 Å²	22	19.7 Å²	19.7	10%	0.103	9%	0.091	C	C	.	.	H	α-helix	trans	-72.5	-43.3	172.1	-69.9	149.2	46.2	0	0	112	E62 V63 K65 K81 K138 R207 R208 F209	E62-Q211 WeakPolarHBondContact O-CG 3.29Å; E62-Q211 PolarHBondContact O-NE2 3.44Å; V63-Q211 WeakPolarHBondContact O-CA 3.35Å; V63-Q211 WeakPolarHBondContact O-CG 3.4Å; K65-Q211 HydrophobicContact CD-CG 4.49Å; K65-Q211 VanDerWaalsContact CE-CD 3.42Å; K65-Q211 HydrophobicContact CG-CG 4.31Å; K81-Q211 PolarHBondContact NZ-O 2.96Å; K138-Q211 PolarHBondContact NZ-O 3.36Å; R207-Q211 VanDerWaalsContact O-CD 3.27Å; R207-Q211 WeakPolarHBondContact O-CG 3.41Å; R207-Q211 PolarHBondContact O-N 3.04Å; R207-Q211 VanDerWaalsContact O-N 3.1Å; R207-Q211 PolarHBondContact O-NE2 3.32Å; R208-Q211 WeakPolarHBondContact O-CB 3.29Å; R208-Q211 PolarHBondContact O-N 3.44Å; F209-Q211 PolarHBondContact O-N 2.86Å
212	L	89.2	Confident	88.5	Confident	16 Å²	16	22 Å²	22	8%	0.084	10%	0.102	C	C	.	.	H	α-helix	trans	-73.9	-68.7	-179.6	-62.7	177.4	0	0	0	110.9	K81 R208 F209 L295 P296 L299	K81-L212 PolarHBondContact NZ-O 2.87Å; R208-L212 WeakPolarHBondContact O-CG 3.27Å; R208-L212 PolarHBondContact O-N 3.03Å; R208-L212 VanDerWaalsContact O-N 3.07Å; F209-L212 CarbonylContact O-C 3.46Å; F209-L212 PolarHBondContact O-N 3.43Å; L212-L295 HydrophobicContact CD1-CB 4.33Å; L212-L295 HydrophobicContact CD1-CD2 4.18Å; L212-L295 HydrophobicContact CD1-CG 4.26Å; L212-P296 HydrophobicContact CD1-CG 4.14Å; L212-P296 HydrophobicContact CD2-CG 4.43Å; L212-L299 HydrophobicContact CB-CD1 4.49Å; L212-L299 HydrophobicContact CD1-CD1 3.86Å
213	L	89.9	Confident	88.3	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.126	C	C	.	.	S	Bend	trans	-79	169.5	-176.1	-54.1	178.7	0	0	0	112.9	K81 C158 V162 L189 V191 F209 V218 L299	K81-L213 PolarHBondContact NZ-O 3.48Å; C158-L213 HydrophobicContact CB-CD2 4.45Å; V162-L213 HydrophobicContact CG2-CD2 3.74Å; L189-L213 HydrophobicContact CD2-CD1 4.01Å; L189-L213 HydrophobicContact CG-CD1 4.5Å; V191-L213 HydrophobicContact CG2-CD1 3.43Å; V191-L213 VanDerWaalsContact CG2-CD1 3.43Å; F209-L213 HydrophobicContact CD1-CD1 4.15Å; F209-L213 PolarHBondContact O-N 3.3Å; L213-V218 HydrophobicContact CB-CG2 4.15Å; L213-V218 HydrophobicContact CD1-CG2 4.41Å; L213-L299 HydrophobicContact CD2-CD1 4.36Å
214	N	89	Confident	87.8	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.141	C	C	.	.			trans	-63.7	131.8	169.6	179.5	-20.2	0	0	0	108.7	T83 W136 I163 A216 Q217	T83-N214 PolarHBondContact O-ND2 2.75Å; W136-N214 HydrophobicContact CH2-CB 4.01Å; W136-N214 HydrophobicContact CZ3-CB 4.04Å; I163-N214 VanDerWaalsContact O-CB 3.29Å; I163-N214 WeakPolarHBondContact O-CB 3.42Å; I163-N214 PolarHBondContact O-ND2 2.96Å; I163-N214 VanDerWaalsContact O-ND2 3.07Å; N214-A216 PolarHBondContact O-N 3.42Å; N214-A216 VanDerWaalsContact O-N 3.09Å; N214-A216 PolarHBondContact OD1-N 3.45Å; N214-A216 VanDerWaalsContact OD1-N 3.09Å; N214-Q217 HydrophobicContact CB-CG 4.06Å; N214-Q217 VanDerWaalsContact CB-OE1 3.29Å; N214-Q217 VanDerWaalsContact O-CB 3.31Å; N214-Q217 WeakPolarHBondContact O-CB 3.39Å; N214-Q217 PolarHBondContact O-N 3.34Å
215	P	87.9	Confident	87.8	Confident	8 Å²	8	22.3 Å²	22.3	5%	0.052	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-54.1	-28.1	179.8	-27.9	35.7	0	0	0	114.7	V63 K81 T83 Q217 V218	V63-P215 HydrophobicContact CG1-CG 3.53Å; K81-P215 HydrophobicContact CD-CG 4.44Å; T83-P215 HydrophobicContact CG2-CB 4Å; T83-P215 HydrophobicContact CG2-CG 4.08Å; P215-Q217 PolarHBondContact O-N 2.69Å; P215-Q217 VanDerWaalsContact O-N 3.17Å; P215-V218 PolarHBondContact O-N 3.04Å
216	A	84.8	Confident	87.8	Confident	1 Å²	1	22.3 Å²	22.3	1%	0.008	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-66.3	-7.8	174.3	0	0	0	0	0	114.8	F27 L168 W177 N214 F219	F27-A216 HydrophobicContact CD1-CB 4.37Å; F27-A216 HydrophobicContact CE1-CB 3.95Å; L168-A216 HydrophobicContact CD1-CB 4.1Å; W177-A216 HydrophobicContact CZ2-CB 3.85Å; N214-A216 PolarHBondContact O-N 3.42Å; N214-A216 VanDerWaalsContact O-N 3.09Å; N214-A216 PolarHBondContact OD1-N 3.45Å; N214-A216 VanDerWaalsContact OD1-N 3.09Å; A216-F219 WeakPolarHBondContact O-CE2 3.41Å; A216-F219 WeakPolarHBondContact O-CZ 3.27Å
217	Q	88.1	Confident	87.8	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-98.9	-1.1	176.2	-54.2	179.4	-100.3	0	0	113.1	S161 I163 L189 V191 N214 P215 F233	S161-Q217 PolarHBondContact O-NE2 3.12Å; I163-Q217 HydrophobicContact CB-CG 4.39Å; I163-Q217 HydrophobicContact CD1-CG 4.29Å; I163-Q217 HydrophobicContact CG1-CG 4.41Å; L189-Q217 PolarHBondContact O-NE2 2.96Å; V191-Q217 PolarHBondContact N-O 2.82Å; N214-Q217 HydrophobicContact CB-CG 4.06Å; N214-Q217 VanDerWaalsContact CB-OE1 3.29Å; N214-Q217 VanDerWaalsContact O-CB 3.31Å; N214-Q217 WeakPolarHBondContact O-CB 3.39Å; N214-Q217 PolarHBondContact O-N 3.34Å; P215-Q217 PolarHBondContact O-N 2.69Å; P215-Q217 VanDerWaalsContact O-N 3.17Å; Q217-F233 HydrophobicContact CB-CZ 4.49Å; Q217-F233 HydrophobicContact CG-CZ 4.26Å
218	V	91.1	Very high	87.5	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	98.6	-162.7	-172.6	0	0	0	0	112.4	V191 L206 F209 K210 L213 P215	V191-V218 WeakPolarHBondContact O-CA 3.48Å; L206-V218 HydrophobicContact CD1-CG1 3.85Å; F209-V218 HydrophobicContact CB-CB 4.46Å; F209-V218 HydrophobicContact CB-CG1 3.6Å; F209-V218 HydrophobicContact CB-CG2 3.94Å; K210-V218 WeakPolarHBondContact CE-O 3.25Å; K210-V218 HydrophobicContact CG-CB 3.84Å; K210-V218 HydrophobicContact CG-CG1 3.8Å; K210-V218 HydrophobicContact CG-CG2 4.38Å; L213-V218 HydrophobicContact CB-CG2 4.15Å; L213-V218 HydrophobicContact CD1-CG2 4.41Å; P215-V218 PolarHBondContact O-N 3.04Å
219	F	90.4	Very high	87.3	Confident	21 Å²	21	22.2 Å²	22.2	9%	0.092	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	149.7	-173.9	-61.4	-93.6	0	0	0	112	L190 V191 F192 V193 A216 L228 L232	L190-F219 HydrophobicContact CD1-CD2 3.57Å; L190-F219 HydrophobicContact CD1-CE2 3.57Å; V191-F219 PolarHBondContact O-N 3.15Å; F192-F219 HydrophobicContact CD1-CB 3.8Å; F192-F219 HydrophobicContact CE1-CB 3.87Å; F192-F219 HydrophobicContact CE1-CD2 4.34Å; F192-F219 HydrophobicContact CE1-CG 4.23Å; V193-F219 PolarHBondContact N-O 3.19Å; A216-F219 WeakPolarHBondContact O-CE2 3.41Å; A216-F219 WeakPolarHBondContact O-CZ 3.27Å; F219-L228 HydrophobicContact CE1-CD2 4.31Å; F219-L228 HydrophobicContact CE1-CG 4.26Å; F219-L232 HydrophobicContact CE1-CD1 4.15Å; F219-L232 HydrophobicContact CZ-CD1 3.84Å
220	D	89.8	Confident	87.2	Confident	26 Å²	26	22.2 Å²	22.2	14%	0.139	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	118.9	171.5	-175.6	-6.7	0	0	0	109.1	V193 S195 L206 M222 N223	V193-D220 CarbonylContact O-C 3.54Å; V193-D220 VanDerWaalsContact O-CA 3.3Å; V193-D220 WeakPolarHBondContact O-CA 3.27Å; V193-D220 VanDerWaalsContact O-OD1 3.05Å; S195-D220 WeakPolarHBondContact CB-OD1 3.28Å; S195-D220 WeakPolarHBondContact CB-OD2 3.25Å; S195-D220 PolarHBondContact N-OD1 2.86Å; S195-D220 VanDerWaalsContact OG-CG 3.25Å; S195-D220 PolarHBondContact OG-OD1 3.3Å; S195-D220 PolarHBondContact OG-OD2 3.37Å; L206-D220 HydrophobicContact CD1-CB 4.22Å; L206-D220 HydrophobicContact CD2-CB 4.16Å; D220-M222 PolarHBondContact O-N 3.43Å; D220-M222 WeakPolarHBondContact OD1-CB 3.41Å; D220-M222 PolarHBondContact OD1-N 2.89Å; D220-N223 HydrophobicContact CB-CB 4.31Å; D220-N223 CarbonylContact O-C 3.57Å; D220-N223 PolarHBondContact O-N 3.14Å; D220-N223 VanDerWaalsContact O-O 3.13Å
221	L	88.8	Confident	86.9	Confident	1 Å²	1	26.6 Å²	26.6	1%	0.005	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-28.9	178.6	-70.8	171.4	0	0	0	111.9	F192 V193 N194 N223 P226 V243 W252 V253	F192-L221 HydrophobicContact CB-CD1 4.11Å; F192-L221 HydrophobicContact CB-CD2 3.89Å; F192-L221 HydrophobicContact CB-CG 3.91Å; F192-L221 HydrophobicContact CD1-CD2 3.77Å; F192-L221 HydrophobicContact CD1-CG 4.43Å; F192-L221 HydrophobicContact CG-CD2 3.96Å; F192-L221 HydrophobicContact CG-CG 4.49Å; V193-L221 PolarHBondContact O-N 3.03Å; N194-L221 HydrophobicContact CB-CD1 4.3Å; L221-N223 VanDerWaalsContact C-N 3.29Å; L221-N223 PolarHBondContact O-N 3.28Å; L221-P226 HydrophobicContact CD2-CB 4.02Å; L221-P226 HydrophobicContact CD2-CG 4.45Å; L221-V243 HydrophobicContact CD1-CG1 4.3Å; L221-W252 HydrophobicContact CB-CE3 4.48Å; L221-W252 HydrophobicContact CB-CZ3 4.09Å; L221-W252 WeakPolarHBondContact O-CH2 3.26Å; L221-W252 WeakPolarHBondContact O-CZ3 3.24Å; L221-V253 HydrophobicContact CD1-CG2 4.27Å; L221-V253 HydrophobicContact CD2-CG2 3.82Å
222	M	85.3	Confident	86.4	Confident	75 Å²	75	25.8 Å²	25.8	37%	0.369	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-6.1	178.7	-54.5	-54.7	-38	0	0	113.9	K196 D220	K196-M222 HydrophobicContact CD-CE 4.05Å; K196-M222 HydrophobicContact CD-CG 4.17Å; K196-M222 HydrophobicContact CD-SD 4.23Å; K196-M222 HydrophobicContact CG-CG 4.11Å; D220-M222 PolarHBondContact O-N 3.43Å; D220-M222 WeakPolarHBondContact OD1-CB 3.41Å; D220-M222 PolarHBondContact OD1-N 2.89Å
223	N	81.9	Confident	86	Confident	92 Å²	92	25 Å²	25	49%	0.492	14%	0.139	S	C	.	.	B	Isolated β-bridge	trans	-142.7	87.4	-177.5	-173.9	32.3	0	0	0	111.1	D220 L221	D220-N223 HydrophobicContact CB-CB 4.31Å; D220-N223 CarbonylContact O-C 3.57Å; D220-N223 PolarHBondContact O-N 3.14Å; D220-N223 VanDerWaalsContact O-O 3.13Å; L221-N223 VanDerWaalsContact C-N 3.29Å; L221-N223 PolarHBondContact O-N 3.28Å
224	G	73.5	Confident	85.5	Confident	59 Å²	59	28.2 Å²	28.2	61%	0.608	15%	0.153	S	C	*	.	B	Isolated β-bridge	trans	107.4	-14.5	-177.4	0	0	0	0	0	114.9
225	G	87.2	Confident	84.8	Confident	11 Å²	11	33.3 Å²	33.3	11%	0.113	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.8	-174.2	175.5	0	0	0	0	0	114.6
226	P	90.9	Very high	84.3	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.006	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-31.4	179.2	27.9	-32	0	0	0	113.8	F192 L221 L228 G229 L230 W252 V253 E256	F192-P226 HydrophobicContact CE1-CB 4.29Å; F192-P226 HydrophobicContact CZ-CB 4.3Å; F192-P226 WeakPolarHBondContact CZ-O 3.33Å; L221-P226 HydrophobicContact CD2-CB 4.02Å; L221-P226 HydrophobicContact CD2-CG 4.45Å; P226-L228 PolarHBondContact O-N 3.41Å; P226-G229 PolarHBondContact O-N 3.27Å; P226-L230 HydrophobicContact CB-CD1 4.33Å; P226-L230 PolarHBondContact O-N 2.99Å; P226-L230 VanDerWaalsContact O-N 3.15Å; P226-W252 HydrophobicContact CG-CD2 4.38Å; P226-W252 HydrophobicContact CG-CG 4.35Å; P226-V253 HydrophobicContact CB-CG2 4.14Å; P226-E256 HydrophobicContact CB-CB 4.11Å; P226-E256 HydrophobicContact CB-CG 4.11Å; P226-E256 HydrophobicContact CG-CB 3.79Å; P226-E256 HydrophobicContact CG-CG 3.89Å
227	H	87.4	Confident	84	Confident	61 Å²	61	40.4 Å²	40.4	28%	0.282	21%	0.212	S	C	.	.	H	α-helix	trans	-51.1	-50.1	-169.8	-169.7	86.3	0	0	0	114.2	G229 L230 R231 E256	H227-G229 PolarHBondContact O-N 2.86Å; H227-L230 PolarHBondContact O-N 2.92Å; H227-R231 PolarHBondContact NE2-NE 3.39Å; H227-R231 VanDerWaalsContact NE2-NE 3.17Å; H227-R231 PolarHBondContact NE2-NH2 3.29Å; H227-R231 WeakPolarHBondContact O-CB 3.38Å; H227-R231 PolarHBondContact O-N 3.06Å; H227-E256 HydrophobicContact CB-CG 4.17Å; H227-E256 IonicContact CE1-OE1 3.21Å; H227-E256 IonicContact CG-OE1 3.88Å; H227-E256 IonicContact ND1-OE1 2.72Å; H227-E256 PolarHBondContact ND1-OE1 2.89Å
228	L	82.9	Confident	83.8	Confident	65 Å²	65	43.6 Å²	43.6	34%	0.34	23%	0.232	S	C	.	.	H	α-helix	trans	-61.8	-45.4	-177.2	178.9	61.2	0	0	0	111.6	F219 P226 L230 L232	F219-L228 HydrophobicContact CE1-CD2 4.31Å; F219-L228 HydrophobicContact CE1-CG 4.26Å; P226-L228 PolarHBondContact O-N 3.41Å; L228-L230 VanDerWaalsContact C-N 3.34Å; L228-L230 PolarHBondContact O-N 2.97Å; L228-L232 HydrophobicContact CD1-CD1 3.85Å; L228-L232 HydrophobicContact CD1-CG 4.09Å; L228-L232 HydrophobicContact CG-CD1 3.87Å; L228-L232 VanDerWaalsContact O-CB 3.29Å; L228-L232 WeakPolarHBondContact O-CB 3.41Å; L228-L232 WeakPolarHBondContact O-CD1 3.23Å; L228-L232 WeakPolarHBondContact O-CG 3.46Å; L228-L232 PolarHBondContact O-N 2.91Å
229	G	85.3	Confident	83.7	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.7	-37.3	-179.9	0	0	0	0	0	112.8	P226 H227 F233	P226-G229 PolarHBondContact O-N 3.27Å; H227-G229 PolarHBondContact O-N 2.86Å; G229-F233 WeakPolarHBondContact O-CD2 3.26Å; G229-F233 PolarHBondContact O-N 3.35Å
230	L	88	Confident	83.8	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-72.7	-46.9	177.6	-68.5	171.6	0	0	0	112.2	L190 F192 P226 H227 L228 L232 F233 Q234 I241 E256 I257 L260 L262	L190-L230 HydrophobicContact CD2-CD2 4.01Å; F192-L230 HydrophobicContact CE2-CD2 4.11Å; F192-L230 HydrophobicContact CE2-CG 4.17Å; F192-L230 HydrophobicContact CZ-CD2 4.39Å; F192-L230 HydrophobicContact CZ-CG 4.02Å; P226-L230 HydrophobicContact CB-CD1 4.33Å; P226-L230 PolarHBondContact O-N 2.99Å; P226-L230 VanDerWaalsContact O-N 3.15Å; H227-L230 PolarHBondContact O-N 2.92Å; L228-L230 VanDerWaalsContact C-N 3.34Å; L228-L230 PolarHBondContact O-N 2.97Å; L230-L232 VanDerWaalsContact C-N 3.27Å; L230-L232 PolarHBondContact O-N 3.43Å; L230-F233 PolarHBondContact O-N 2.93Å; L230-Q234 PolarHBondContact O-N 2.98Å; L230-I241 HydrophobicContact CD2-CD1 3.67Å; L230-E256 HydrophobicContact CD1-CB 3.71Å; L230-E256 HydrophobicContact CD1-CG 3.57Å; L230-I257 HydrophobicContact CD1-CG1 3.82Å; L230-I257 HydrophobicContact CD2-CG1 3.94Å; L230-L260 HydrophobicContact CB-CD1 3.51Å; L230-L260 HydrophobicContact CD1-CD1 4.36Å; L230-L262 HydrophobicContact CB-CD1 4.02Å; L230-L262 HydrophobicContact CD2-CD1 4.23Å
231	R	83.4	Confident	84	Confident	99 Å²	99	41.9 Å²	41.9	37%	0.374	22%	0.223	S	C	.	.	H	α-helix	trans	-56.6	-42.2	175.3	-171.8	-168.1	-69.2	-148.5	0.3	111.3	F176 H227 F233 Q234	F176-R231 HydrophobicContact CD1-CG 4.19Å; F176-R231 WeakPolarHBondContact CD1-O 3.34Å; F176-R231 HydrophobicContact CE1-CG 3.72Å; F176-R231 HydrophobicContact CZ-CG 4.31Å; H227-R231 PolarHBondContact NE2-NE 3.39Å; H227-R231 VanDerWaalsContact NE2-NE 3.17Å; H227-R231 PolarHBondContact NE2-NH2 3.29Å; H227-R231 WeakPolarHBondContact O-CB 3.38Å; H227-R231 PolarHBondContact O-N 3.06Å; R231-F233 VanDerWaalsContact C-N 3.25Å; R231-F233 PolarHBondContact O-N 3.19Å; R231-Q234 WeakPolarHBondContact O-CB 3.33Å; R231-Q234 PolarHBondContact O-N 3.14Å
232	L	79.3	Confident	84.3	Confident	5 Å²	5	42 Å²	42	3%	0.026	22%	0.223	C	C	.	.	H	α-helix	trans	-65.1	-24	177.5	-76.1	173.2	0	0	0	113.9	G175 W177 F219 L228 L230	G175-L232 WeakPolarHBondContact O-CD2 3.35Å; W177-L232 HydrophobicContact CD2-CD2 4.41Å; W177-L232 HydrophobicContact CG-CD2 4.08Å; F219-L232 HydrophobicContact CE1-CD1 4.15Å; F219-L232 HydrophobicContact CZ-CD1 3.84Å; L228-L232 HydrophobicContact CD1-CD1 3.85Å; L228-L232 HydrophobicContact CD1-CG 4.09Å; L228-L232 HydrophobicContact CG-CD1 3.87Å; L228-L232 VanDerWaalsContact O-CB 3.29Å; L228-L232 WeakPolarHBondContact O-CB 3.41Å; L228-L232 WeakPolarHBondContact O-CD1 3.23Å; L228-L232 WeakPolarHBondContact O-CG 3.46Å; L228-L232 PolarHBondContact O-N 2.91Å; L230-L232 VanDerWaalsContact C-N 3.27Å; L230-L232 PolarHBondContact O-N 3.43Å
233	F	81.8	Confident	84.7	Confident	1 Å²	1	38.4 Å²	38.4	0%	0.004	21%	0.206	C	C	.	.	H	α-helix	trans	-100.4	-5.6	179.4	-86.3	-115	0	0	0	114.1	I163 P188 L190 Q217 G229 L230 R231 K235 F236 F239	I163-F233 HydrophobicContact CD1-CE1 3.7Å; I163-F233 HydrophobicContact CD1-CZ 3.58Å; P188-F233 HydrophobicContact CB-CE1 4.41Å; L190-F233 HydrophobicContact CB-CD1 4.06Å; L190-F233 HydrophobicContact CB-CE1 3.88Å; L190-F233 HydrophobicContact CB-CE2 4.41Å; L190-F233 HydrophobicContact CB-CG 4.39Å; L190-F233 HydrophobicContact CB-CZ 4.06Å; L190-F233 HydrophobicContact CD1-CD2 4.01Å; L190-F233 HydrophobicContact CD1-CE2 3.78Å; L190-F233 HydrophobicContact CD1-CZ 4.16Å; L190-F233 HydrophobicContact CD2-CB 4.34Å; L190-F233 HydrophobicContact CD2-CD2 4.22Å; L190-F233 HydrophobicContact CD2-CG 4.13Å; L190-F233 HydrophobicContact CG-CD2 4.5Å; Q217-F233 HydrophobicContact CB-CZ 4.49Å; Q217-F233 HydrophobicContact CG-CZ 4.26Å; G229-F233 WeakPolarHBondContact O-CD2 3.26Å; G229-F233 PolarHBondContact O-N 3.35Å; L230-F233 PolarHBondContact O-N 2.93Å; R231-F233 VanDerWaalsContact C-N 3.25Å; R231-F233 PolarHBondContact O-N 3.19Å; F233-K235 PolarHBondContact O-N 3.34Å; F233-F236 HydrophobicContact CB-CD2 4.3Å; F233-F236 AromaticContact CD1-CD2 3.9Å; F233-F236 HydrophobicContact CD1-CD2 3.9Å; F233-F236 HydrophobicContact CD1-CE2 4.14Å; F233-F236 HydrophobicContact CE1-CE2 4.44Å; F233-F236 HydrophobicContact CG-CD2 4.21Å; F233-F236 HydrophobicContact CG-CE2 4.4Å; F233-F236 WeakPolarHBondContact O-CD2 3.2Å; F233-F236 PolarHBondContact O-N 2.96Å; F233-F239 HydrophobicContact CB-CD2 4.22Å; F233-F239 HydrophobicContact CB-CE1 4.27Å; F233-F239 HydrophobicContact CB-CE2 3.9Å; F233-F239 HydrophobicContact CB-CZ 3.93Å; F233-F239 HydrophobicContact CD1-CB 4.31Å; F233-F239 AromaticContact CD1-CD2 3.85Å; F233-F239 HydrophobicContact CD1-CD2 3.85Å; F233-F239 HydrophobicContact CD1-CE2 4.33Å; F233-F239 HydrophobicContact CD1-CG 4.09Å; F233-F239 HydrophobicContact CG-CD2 4.43Å; F233-F239 HydrophobicContact CG-CE2 4.46Å
234	Q	79	Confident	85.2	Confident	66 Å²	66	34 Å²	34	31%	0.308	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-18.5	-176.4	-176.2	167	18.2	0	0	115.2	L230 R231 L262	L230-Q234 PolarHBondContact O-N 2.98Å; R231-Q234 WeakPolarHBondContact O-CB 3.33Å; R231-Q234 PolarHBondContact O-N 3.14Å; Q234-L262 HydrophobicContact CB-CD2 4.36Å; Q234-L262 HydrophobicContact CG-CD2 3.86Å
235	K	75.1	Confident	86	Confident	108 Å²	108	31.2 Å²	31.2	47%	0.47	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-1.8	176.4	-68.2	-176.9	-179.1	176.5	0	114.6	D172 F176 W177 F233	D172-K235 IonicContact OD2-NZ 2.78Å; D172-K235 PolarHBondContact OD2-NZ 3.35Å; F176-K235 HydrophobicContact CB-CD 4.23Å; F176-K235 VanDerWaalsContact CB-CE 3.49Å; W177-K235 WeakPolarHBondContact O-CD 3.45Å; F233-K235 PolarHBondContact O-N 3.34Å
236	F	77.3	Confident	86.1	Confident	15 Å²	15	31.1 Å²	31.1	7%	0.066	15%	0.152	C	C	.	.	S	Bend	trans	-94.9	129.8	175.8	-67.7	-80.1	0	0	0	111.4	I163 A179 P188 F233 T238 F239	I163-F236 HydrophobicContact CD1-CE2 4.08Å; I163-F236 HydrophobicContact CD1-CZ 3.82Å; A179-F236 HydrophobicContact CB-CE1 4.01Å; A179-F236 HydrophobicContact CB-CE2 4.24Å; A179-F236 HydrophobicContact CB-CZ 3.56Å; P188-F236 HydrophobicContact CG-CD1 4.05Å; P188-F236 HydrophobicContact CG-CE1 4.31Å; P188-F236 HydrophobicContact CG-CG 4.25Å; F233-F236 HydrophobicContact CB-CD2 4.3Å; F233-F236 AromaticContact CD1-CD2 3.9Å; F233-F236 HydrophobicContact CD1-CD2 3.9Å; F233-F236 HydrophobicContact CD1-CE2 4.14Å; F233-F236 HydrophobicContact CE1-CE2 4.44Å; F233-F236 HydrophobicContact CG-CD2 4.21Å; F233-F236 HydrophobicContact CG-CE2 4.4Å; F233-F236 WeakPolarHBondContact O-CD2 3.2Å; F233-F236 PolarHBondContact O-N 2.96Å; F236-T238 PolarHBondContact O-N 3.37Å; F236-F239 HydrophobicContact CB-CD1 4.18Å
237	D	77.1	Confident	85.9	Confident	143 Å²	143	31.9 Å²	31.9	77%	0.765	16%	0.156	S	C	*	.	S	Bend	trans	-59.5	-42.2	-177	-58.1	-66.7	0	0	0	113.5	Q265	D237-Q265 WeakPolarHBondContact O-CB 3.45Å; D237-Q265 WeakPolarHBondContact O-CG 3.38Å
238	T	85.2	Confident	86	Confident	67 Å²	67	31.1 Å²	31.1	41%	0.411	17%	0.165	S	C	.	.	S	Bend	trans	-142.2	139.2	171.1	63.6	0	0	0	0	110.9	F236 Q265	F236-T238 PolarHBondContact O-N 3.37Å; T238-Q265 VanDerWaalsContact CA-O 3.31Å; T238-Q265 WeakPolarHBondContact CA-O 3.42Å
239	F	89.1	Confident	86.4	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	154.6	176.9	63.8	-83.6	0	0	0	111.8	P188 L190 F233 F236 I241 L262 Q265 C266 Q267	P188-F239 HydrophobicContact CG-CB 3.98Å; L190-F239 HydrophobicContact CB-CD2 4.39Å; L190-F239 HydrophobicContact CD2-CE2 4.06Å; F233-F239 HydrophobicContact CB-CD2 4.22Å; F233-F239 HydrophobicContact CB-CE1 4.27Å; F233-F239 HydrophobicContact CB-CE2 3.9Å; F233-F239 HydrophobicContact CB-CZ 3.93Å; F233-F239 HydrophobicContact CD1-CB 4.31Å; F233-F239 AromaticContact CD1-CD2 3.85Å; F233-F239 HydrophobicContact CD1-CD2 3.85Å; F233-F239 HydrophobicContact CD1-CE2 4.33Å; F233-F239 HydrophobicContact CD1-CG 4.09Å; F233-F239 HydrophobicContact CG-CD2 4.43Å; F233-F239 HydrophobicContact CG-CE2 4.46Å; F236-F239 HydrophobicContact CB-CD1 4.18Å; F239-I241 HydrophobicContact CD2-CD1 4.49Å; F239-I241 HydrophobicContact CD2-CG1 3.92Å; F239-I241 HydrophobicContact CE2-CD1 3.76Å; F239-I241 HydrophobicContact CE2-CG1 3.66Å; F239-I241 HydrophobicContact CZ-CD1 4.48Å; F239-L262 HydrophobicContact CZ-CD1 4.32Å; F239-Q265 HydrophobicContact CE1-CB 4.25Å; F239-Q265 PolarHBondContact N-O 2.97Å; F239-C266 HydrophobicContact CE1-CB 4.45Å; F239-C266 HydrophobicContact CE2-CB 4.14Å; F239-C266 HydrophobicContact CZ-CB 4.03Å; F239-C266 WeakPolarHBondContact O-CA 3.39Å; F239-Q267 PolarHBondContact O-N 3.15Å
240	R	91.6	Very high	86.7	Confident	11 Å²	11	28.9 Å²	28.9	4%	0.042	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	144.8	176.8	-69.6	173.3	-66.1	128.2	11.1	109.9	S161 S187 P188 L189 L190 Q267 L302 L812	S161-R240 PolarHBondContact OG-NH1 3.44Å; S161-R240 PolarHBondContact OG-NH2 2.87Å; S187-R240 PolarHBondContact O-NH2 2.98Å; S187-R240 PolarHBondContact OG-NE 2.92Å; P188-R240 PolarHBondContact O-N 3.49Å; L189-R240 CarbonylContact C-O 3.46Å; L189-R240 WeakPolarHBondContact CA-O 3.33Å; L189-R240 HydrophobicContact CD1-CB 3.77Å; L190-R240 PolarHBondContact N-O 3.37Å; R240-Q267 CarbonylContact C-O 3.58Å; R240-Q267 WeakPolarHBondContact CA-O 3.47Å; R240-Q267 HydrophobicContact CG-CB 4.04Å; R240-L302 PolarHBondContact NH1-O 3.4Å; R240-L812 HydrophobicContact CB-CD1 4.24Å; R240-L812 HydrophobicContact CG-CD1 4.03Å
241	I	94.2	Very high	86.9	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	134.1	175	-57.2	178.7	0	0	0	108	L190 F192 L230 F239 V243 V253 I257 C266 Q267 M268 G269	L190-I241 HydrophobicContact CB-CG1 4.45Å; L190-I241 HydrophobicContact CD2-CG1 4.42Å; L190-I241 CarbonylContact O-C 3.19Å; L190-I241 VanDerWaalsContact O-CA 3.31Å; L190-I241 WeakPolarHBondContact O-CA 3.24Å; F192-I241 HydrophobicContact CD2-CG2 3.8Å; F192-I241 HydrophobicContact CE2-CG2 4.09Å; L230-I241 HydrophobicContact CD2-CD1 3.67Å; F239-I241 HydrophobicContact CD2-CD1 4.49Å; F239-I241 HydrophobicContact CD2-CG1 3.92Å; F239-I241 HydrophobicContact CE2-CD1 3.76Å; F239-I241 HydrophobicContact CE2-CG1 3.66Å; F239-I241 HydrophobicContact CZ-CD1 4.48Å; I241-V243 HydrophobicContact CG2-CG2 4.05Å; I241-V253 HydrophobicContact CG2-CG1 4.42Å; I241-I257 HydrophobicContact CD1-CD1 3.7Å; I241-I257 HydrophobicContact CD1-CG1 4.35Å; I241-C266 HydrophobicContact CD1-CB 3.56Å; I241-C266 HydrophobicContact CG1-CB 4.15Å; I241-Q267 PolarHBondContact N-O 3.4Å; I241-M268 CarbonylContact O-C 3.27Å; I241-M268 WeakPolarHBondContact O-CA 3.09Å; I241-G269 PolarHBondContact O-N 3.24Å
242	L	94.3	Very high	87.3	Confident	3 Å²	3	30.1 Å²	30.1	2%	0.016	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	114	170.2	-178.1	64.7	0	0	0	110.2	L189 L190 V191 F192 F209 G269 L271 L302	L189-L242 HydrophobicContact CD1-CB 4.08Å; L190-L242 PolarHBondContact O-N 3.05Å; V191-L242 HydrophobicContact CG1-CB 4.46Å; V191-L242 HydrophobicContact CG1-CD2 4.49Å; V191-L242 HydrophobicContact CG2-CB 4.33Å; F192-L242 PolarHBondContact N-O 2.88Å; F209-L242 HydrophobicContact CE1-CD2 3.73Å; F209-L242 HydrophobicContact CZ-CD2 3.56Å; L242-G269 WeakPolarHBondContact CA-O 3.48Å; L242-L271 HydrophobicContact CD1-CB 4.22Å; L242-L302 HydrophobicContact CB-CD2 4.02Å; L242-L302 HydrophobicContact CD1-CD1 4.36Å; L242-L302 HydrophobicContact CD1-CD2 4.02Å; L242-L302 HydrophobicContact CD2-CD2 4.05Å; L242-L302 HydrophobicContact CG-CD2 4.26Å
243	V	94.4	Very high	88	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	117.3	176.9	-173	0	0	0	0	109.8	L221 I241 V250 V253 M268 G269 V270 L271	L221-V243 HydrophobicContact CD1-CG1 4.3Å; I241-V243 HydrophobicContact CG2-CG2 4.05Å; V243-V250 HydrophobicContact CB-CG2 4.21Å; V243-V250 HydrophobicContact CG1-CG2 4Å; V243-V253 HydrophobicContact CG1-CG2 4.13Å; V243-V253 HydrophobicContact CG2-CB 4.05Å; V243-V253 HydrophobicContact CG2-CG1 3.91Å; V243-V253 HydrophobicContact CG2-CG2 3.94Å; V243-M268 HydrophobicContact CG2-CG 4.21Å; V243-G269 PolarHBondContact N-O 2.89Å; V243-V270 WeakPolarHBondContact O-CA 3.45Å; V243-L271 PolarHBondContact O-N 2.89Å
244	C	92.3	Very high	88.5	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	98	-177.8	-50.1	0	0	0	0	110.2	F192 V193 N194 F209 L271 L273	F192-C244 WeakPolarHBondContact O-CB 3.39Å; F192-C244 PolarHBondContact O-N 3.41Å; V193-C244 HydrophobicContact CB-CB 4.28Å; V193-C244 HydrophobicContact CG1-CB 4.08Å; V193-C244 HydrophobicContact CG2-CB 4.08Å; N194-C244 PolarHBondContact N-O 2.94Å; F209-C244 WeakPolarHBondContact CE2-SG 3.5Å; C244-L271 HydrophobicContact CB-CB 4.06Å; C244-L271 HydrophobicContact CB-CD2 4.02Å; C244-L273 HydrophobicContact CB-CD1 3.79Å; C244-L273 HydrophobicContact CB-CG 4.4Å
245	G	90.3	Very high	89.1	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.5	-148.3	-170.8	0	0	0	0	0	111.4	L271 L273 G274 N277	G245-L271 PolarHBondContact N-O 2.9Å; G245-L273 PolarHBondContact O-N 3.36Å; G245-G274 PolarHBondContact O-N 2.66Å; G245-N277 PolarHBondContact O-OD1 3.14Å
246	G	88.6	Confident	89.9	Confident	8 Å²	8	26.4 Å²	26.4	8%	0.082	16%	0.155	C	C	.	.			trans	-117.5	-178.2	167.4	0	0	0	0	0	112	G248 S249 V250 G276 N277	G246-G248 PolarHBondContact O-N 2.81Å; G246-S249 WeakPolarHBondContact O-CA 3.37Å; G246-S249 VanDerWaalsContact O-CB 3.32Å; G246-S249 WeakPolarHBondContact O-CB 3.47Å; G246-S249 PolarHBondContact O-N 2.86Å; G246-V250 PolarHBondContact O-N 2.99Å; G246-G276 CarbonylContact C-O 3.58Å; G246-G276 WeakPolarHBondContact CA-O 3.33Å; G246-N277 WeakPolarHBondContact CA-OD1 3.39Å
247	D	88.4	Confident	90.6	Very high	18 Å²	18	25.7 Å²	25.7	10%	0.096	15%	0.152	C	C	.	.	H	α-helix	trans	-51.3	-48.8	-169.9	-58.9	-52.2	0	0	0	113.5	S249 V250 G251 G276 N277 D278 L279 N639	D247-S249 VanDerWaalsContact C-N 3.27Å; D247-S249 PolarHBondContact O-N 2.71Å; D247-V250 CarbonylContact O-C 3.52Å; D247-V250 WeakPolarHBondContact O-CA 3.18Å; D247-V250 VanDerWaalsContact O-CB 3.27Å; D247-V250 WeakPolarHBondContact O-CB 3.43Å; D247-V250 PolarHBondContact O-N 2.76Å; D247-G251 PolarHBondContact O-N 3.06Å; D247-G276 PolarHBondContact N-O 3.3Å; D247-G276 WeakPolarHBondContact OD2-CA 3.45Å; D247-N277 WeakPolarHBondContact OD2-CA 3.36Å; D247-N277 PolarHBondContact OD2-N 2.9Å; D247-D278 VanDerWaalsContact CG-N 3.34Å; D247-D278 PolarHBondContact OD1-N 2.82Å; D247-D278 PolarHBondContact OD2-N 3.45Å; D247-L279 WeakPolarHBondContact OD1-CB 3.35Å; D247-L279 PolarHBondContact OD1-N 2.82Å; D247-N639 VanDerWaalsContact CG-ND2 3.33Å; D247-N639 PolarHBondContact OD1-ND2 3.31Å
248	G	88.8	Confident	91.2	Very high	45 Å²	45	20.3 Å²	20.3	46%	0.464	12%	0.123	S	C	.	.	H	α-helix	trans	-63.7	-24.4	176.3	0	0	0	0	0	115.3	G246 V250 W252	G246-G248 PolarHBondContact O-N 2.81Å; G248-V250 VanDerWaalsContact C-N 3.32Å; G248-W252 PolarHBondContact O-N 3.05Å; G248-W252 VanDerWaalsContact O-N 3.07Å
249	S	91.2	Very high	91.4	Very high	15 Å²	15	20.7 Å²	20.7	11%	0.105	13%	0.133	C	C	.	.	H	α-helix	trans	-74.4	-25	169.9	-57.1	0	0	0	0	112.3	N194 G246 D247 V253	N194-S249 PolarHBondContact ND2-OG 2.74Å; G246-S249 WeakPolarHBondContact O-CA 3.37Å; G246-S249 VanDerWaalsContact O-CB 3.32Å; G246-S249 WeakPolarHBondContact O-CB 3.47Å; G246-S249 PolarHBondContact O-N 2.86Å; D247-S249 VanDerWaalsContact C-N 3.27Å; D247-S249 PolarHBondContact O-N 2.71Å; S249-V253 WeakPolarHBondContact O-CG2 3.46Å
250	V	92.3	Very high	91.4	Very high	2 Å²	2	21.9 Å²	21.9	1%	0.012	14%	0.139	C	C	.	.	H	α-helix	trans	-76.1	-43.7	170.4	-171.5	0	0	0	0	110	V243 G246 D247 G248 W252 V253 L254 M268 V270 L279	V243-V250 HydrophobicContact CB-CG2 4.21Å; V243-V250 HydrophobicContact CG1-CG2 4Å; G246-V250 PolarHBondContact O-N 2.99Å; D247-V250 CarbonylContact O-C 3.52Å; D247-V250 WeakPolarHBondContact O-CA 3.18Å; D247-V250 VanDerWaalsContact O-CB 3.27Å; D247-V250 WeakPolarHBondContact O-CB 3.43Å; D247-V250 PolarHBondContact O-N 2.76Å; G248-V250 VanDerWaalsContact C-N 3.32Å; V250-W252 PolarHBondContact O-N 3.17Å; V250-V253 PolarHBondContact O-N 2.95Å; V250-V253 VanDerWaalsContact O-N 3.15Å; V250-L254 HydrophobicContact CG1-CD1 4.02Å; V250-L254 HydrophobicContact CG1-CG 4.31Å; V250-L254 WeakPolarHBondContact O-CG 3.31Å; V250-L254 PolarHBondContact O-N 3.27Å; V250-M268 HydrophobicContact CG1-CE 3.28Å; V250-M268 HydrophobicContact CG1-SD 3.58Å; V250-M268 VanDerWaalsContact CG1-SD 3.58Å; V250-V270 HydrophobicContact CG1-CG2 4.2Å; V250-V270 HydrophobicContact CG2-CB 4.46Å; V250-V270 HydrophobicContact CG2-CG1 3.77Å; V250-V270 HydrophobicContact CG2-CG2 3.81Å; V250-L279 HydrophobicContact CB-CD2 4.49Å; V250-L279 HydrophobicContact CG1-CD2 3.94Å
251	G	91.6	Very high	91.2	Very high	15 Å²	15	26.1 Å²	26.1	16%	0.155	17%	0.166	C	C	.	.	H	α-helix	trans	-53.4	-47.4	173.8	0	0	0	0	0	112.8	D247 V253 L254 S255	D247-G251 PolarHBondContact O-N 3.06Å; G251-V253 PolarHBondContact O-N 3.44Å; G251-L254 PolarHBondContact O-N 3Å; G251-L254 VanDerWaalsContact O-N 3.15Å; G251-S255 PolarHBondContact O-N 2.94Å; G251-S255 PolarHBondContact O-OG 2.89Å
252	W	91.5	Very high	90.9	Very high	111 Å²	111	26.3 Å²	26.3	42%	0.42	17%	0.167	S	C	.	.	H	α-helix	trans	-59.5	-42.9	176.3	-174.4	15.6	0	0	0	113	L221 P226 G248 V250 E256	L221-W252 HydrophobicContact CB-CE3 4.48Å; L221-W252 HydrophobicContact CB-CZ3 4.09Å; L221-W252 WeakPolarHBondContact O-CH2 3.26Å; L221-W252 WeakPolarHBondContact O-CZ3 3.24Å; P226-W252 HydrophobicContact CG-CD2 4.38Å; P226-W252 HydrophobicContact CG-CG 4.35Å; G248-W252 PolarHBondContact O-N 3.05Å; G248-W252 VanDerWaalsContact O-N 3.07Å; V250-W252 PolarHBondContact O-N 3.17Å; W252-E256 PolarHBondContact O-N 2.82Å
253	V	93.6	Very high	90.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66.4	-37.5	175.8	175.6	0	0	0	0	111.3	F192 L221 P226 I241 V243 S249 V250 G251 E256 I257	F192-V253 HydrophobicContact CB-CG2 4.5Å; F192-V253 HydrophobicContact CD2-CG1 4.12Å; F192-V253 HydrophobicContact CD2-CG2 4.2Å; F192-V253 HydrophobicContact CE2-CG1 4.26Å; F192-V253 HydrophobicContact CG-CG2 4.38Å; L221-V253 HydrophobicContact CD1-CG2 4.27Å; L221-V253 HydrophobicContact CD2-CG2 3.82Å; P226-V253 HydrophobicContact CB-CG2 4.14Å; I241-V253 HydrophobicContact CG2-CG1 4.42Å; V243-V253 HydrophobicContact CG1-CG2 4.13Å; V243-V253 HydrophobicContact CG2-CB 4.05Å; V243-V253 HydrophobicContact CG2-CG1 3.91Å; V243-V253 HydrophobicContact CG2-CG2 3.94Å; S249-V253 WeakPolarHBondContact O-CG2 3.46Å; V250-V253 PolarHBondContact O-N 2.95Å; V250-V253 VanDerWaalsContact O-N 3.15Å; G251-V253 PolarHBondContact O-N 3.44Å; V253-E256 PolarHBondContact O-N 2.86Å; V253-I257 HydrophobicContact CG1-CD1 3.87Å; V253-I257 VanDerWaalsContact O-CG1 3.29Å; V253-I257 WeakPolarHBondContact O-CG1 3.5Å; V253-I257 PolarHBondContact O-N 2.94Å
254	L	92.8	Very high	89.7	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-66.8	-40.8	177.4	-74.4	171.5	0	0	0	112.8	V250 G251 E256 I257 D258 M268 T809	V250-L254 HydrophobicContact CG1-CD1 4.02Å; V250-L254 HydrophobicContact CG1-CG 4.31Å; V250-L254 WeakPolarHBondContact O-CG 3.31Å; V250-L254 PolarHBondContact O-N 3.27Å; G251-L254 PolarHBondContact O-N 3Å; G251-L254 VanDerWaalsContact O-N 3.15Å; L254-E256 VanDerWaalsContact C-N 3.29Å; L254-E256 PolarHBondContact O-N 2.8Å; L254-I257 HydrophobicContact CD2-CD1 4.49Å; L254-I257 WeakPolarHBondContact O-CB 3.45Å; L254-I257 PolarHBondContact O-N 3.29Å; L254-D258 PolarHBondContact O-N 2.82Å; L254-M268 HydrophobicContact CD1-CE 4.01Å; L254-M268 HydrophobicContact CD2-CE 3.91Å; L254-M268 HydrophobicContact CG-CE 4.13Å; L254-T809 HydrophobicContact CD2-CG2 3.78Å
255	S	91.4	Very high	89.3	Confident	64 Å²	64	39 Å²	39	45%	0.448	22%	0.224	S	C	.	.	H	α-helix	trans	-63.3	-34.8	175	-61.2	0	0	0	0	112.5	G251 D258 A259	G251-S255 PolarHBondContact O-N 2.94Å; G251-S255 PolarHBondContact O-OG 2.89Å; S255-D258 PolarHBondContact O-N 2.99Å; S255-A259 PolarHBondContact O-N 2.99Å
256	E	91.6	Very high	89.2	Confident	37 Å²	37	39 Å²	39	17%	0.173	22%	0.224	C	C	.	.	H	α-helix	trans	-73.7	-34.1	174.6	-162.7	76.4	-114.5	0	0	112.2	P226 H227 L230 W252 V253 L254 D258 A259 L260	P226-E256 HydrophobicContact CB-CB 4.11Å; P226-E256 HydrophobicContact CB-CG 4.11Å; P226-E256 HydrophobicContact CG-CB 3.79Å; P226-E256 HydrophobicContact CG-CG 3.89Å; H227-E256 HydrophobicContact CB-CG 4.17Å; H227-E256 IonicContact CE1-OE1 3.21Å; H227-E256 IonicContact CG-OE1 3.88Å; H227-E256 IonicContact ND1-OE1 2.72Å; H227-E256 PolarHBondContact ND1-OE1 2.89Å; L230-E256 HydrophobicContact CD1-CB 3.71Å; L230-E256 HydrophobicContact CD1-CG 3.57Å; W252-E256 PolarHBondContact O-N 2.82Å; V253-E256 PolarHBondContact O-N 2.86Å; L254-E256 VanDerWaalsContact C-N 3.29Å; L254-E256 PolarHBondContact O-N 2.8Å; E256-D258 VanDerWaalsContact C-N 3.31Å; E256-A259 PolarHBondContact O-N 2.84Å; E256-L260 HydrophobicContact CG-CD1 4.45Å; E256-L260 PolarHBondContact O-N 3.46Å
257	I	91.8	Very high	89.4	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64	-35.6	170.6	-73.6	164	0	0	0	111.3	L230 I241 V253 L254 T261 L262 H263	L230-I257 HydrophobicContact CD1-CG1 3.82Å; L230-I257 HydrophobicContact CD2-CG1 3.94Å; I241-I257 HydrophobicContact CD1-CD1 3.7Å; I241-I257 HydrophobicContact CD1-CG1 4.35Å; V253-I257 HydrophobicContact CG1-CD1 3.87Å; V253-I257 VanDerWaalsContact O-CG1 3.29Å; V253-I257 WeakPolarHBondContact O-CG1 3.5Å; V253-I257 PolarHBondContact O-N 2.94Å; L254-I257 HydrophobicContact CD2-CD1 4.49Å; L254-I257 WeakPolarHBondContact O-CB 3.45Å; L254-I257 PolarHBondContact O-N 3.29Å; I257-T261 CarbonylContact O-C 3.37Å; I257-T261 WeakPolarHBondContact O-CA 3.28Å; I257-T261 PolarHBondContact O-N 3.4Å; I257-L262 HydrophobicContact CG2-CB 4.37Å; I257-L262 PolarHBondContact O-N 2.99Å; I257-H263 HydrophobicContact CG2-CB 4.46Å
258	D	90.2	Very high	89.6	Confident	29 Å²	29	39.7 Å²	39.7	16%	0.155	23%	0.225	C	C	.	.	H	α-helix	trans	-66.9	-48.1	172.5	-71.7	-31.1	0	0	0	111.4	L254 S255 E256 L260 T261 R312 N807	L254-D258 PolarHBondContact O-N 2.82Å; S255-D258 PolarHBondContact O-N 2.99Å; E256-D258 VanDerWaalsContact C-N 3.31Å; D258-L260 VanDerWaalsContact C-N 3.27Å; D258-L260 PolarHBondContact O-N 2.9Å; D258-T261 WeakPolarHBondContact O-CA 3.36Å; D258-T261 PolarHBondContact O-N 3.12Å; D258-R312 IonicContact OD1-CZ 3.08Å; D258-R312 IonicContact OD1-NH1 3.98Å; D258-R312 PolarHBondContact OD1-NH1 3.29Å; D258-R312 IonicContact OD2-CZ 3.62Å; D258-R312 VanDerWaalsContact OD2-CZ 3.25Å; D258-R312 IonicContact OD2-NH1 3.4Å; D258-R312 PolarHBondContact OD2-NH1 2.86Å; D258-R312 IonicContact OD2-NH2 3.03Å; D258-R312 PolarHBondContact OD2-NH2 2.82Å; D258-N807 PolarHBondContact OD1-ND2 2.94Å
259	A	90.2	Very high	89.8	Confident	75 Å²	75	37.5 Å²	37.5	62%	0.62	20%	0.203	S	C	*	.	H	α-helix	trans	-60.5	-35	-179.9	0	0	0	0	0	113	S255 E256	S255-A259 PolarHBondContact O-N 2.99Å; E256-A259 PolarHBondContact O-N 2.84Å
260	L	88.4	Confident	89.9	Confident	25 Å²	25	36.9 Å²	36.9	13%	0.131	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	0	173.8	-64	171.9	0	0	0	113.2	L230 E256 D258 L262	L230-L260 HydrophobicContact CB-CD1 3.51Å; L230-L260 HydrophobicContact CD1-CD1 4.36Å; E256-L260 HydrophobicContact CG-CD1 4.45Å; E256-L260 PolarHBondContact O-N 3.46Å; D258-L260 VanDerWaalsContact C-N 3.27Å; D258-L260 PolarHBondContact O-N 2.9Å; L260-L262 HydrophobicContact CB-CD1 3.93Å; L260-L262 HydrophobicContact CB-CD2 4.28Å; L260-L262 HydrophobicContact CB-CG 3.73Å; L260-L262 HydrophobicContact CD1-CD1 4.3Å; L260-L262 WeakPolarHBondContact O-CD2 3.21Å; L260-L262 PolarHBondContact O-N 2.88Å
261	T	88.1	Confident	89.8	Confident	100 Å²	100	37 Å²	37	61%	0.613	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	58	18.2	-179.7	69.3	0	0	0	0	116.8	I257 D258 H263	I257-T261 CarbonylContact O-C 3.37Å; I257-T261 WeakPolarHBondContact O-CA 3.28Å; I257-T261 PolarHBondContact O-N 3.4Å; D258-T261 WeakPolarHBondContact O-CA 3.36Å; D258-T261 PolarHBondContact O-N 3.12Å; T261-H263 PolarHBondContact O-N 3.43Å; T261-H263 PolarHBondContact O-ND1 2.69Å
262	L	86.4	Confident	89.8	Confident	4 Å²	4	36.5 Å²	36.5	2%	0.021	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-73.2	0.9	-168.5	-52.2	177.8	0	0	0	115.4	L230 Q234 F239 I257 L260 K264 Q265 C266	L230-L262 HydrophobicContact CB-CD1 4.02Å; L230-L262 HydrophobicContact CD2-CD1 4.23Å; Q234-L262 HydrophobicContact CB-CD2 4.36Å; Q234-L262 HydrophobicContact CG-CD2 3.86Å; F239-L262 HydrophobicContact CZ-CD1 4.32Å; I257-L262 HydrophobicContact CG2-CB 4.37Å; I257-L262 PolarHBondContact O-N 2.99Å; L260-L262 HydrophobicContact CB-CD1 3.93Å; L260-L262 HydrophobicContact CB-CD2 4.28Å; L260-L262 HydrophobicContact CB-CG 3.73Å; L260-L262 HydrophobicContact CD1-CD1 4.3Å; L260-L262 WeakPolarHBondContact O-CD2 3.21Å; L260-L262 PolarHBondContact O-N 2.88Å; L262-K264 PolarHBondContact O-N 3.11Å; L262-Q265 PolarHBondContact O-N 2.89Å; L262-C266 PolarHBondContact O-N 3.09Å; L262-C266 PolarHBondContact O-SG 3Å
263	H	81.7	Confident	89.5	Confident	58 Å²	58	31.3 Å²	31.3	27%	0.269	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-48.2	-19.6	-172.6	69.8	-67.9	0	0	0	117.8	I257 T261	I257-H263 HydrophobicContact CG2-CB 4.46Å; T261-H263 PolarHBondContact O-N 3.43Å; T261-H263 PolarHBondContact O-ND1 2.69Å
264	K	81.8	Confident	88.9	Confident	156 Å²	156	31.7 Å²	31.7	68%	0.678	18%	0.177	S	C	*	.	G	3₁₀ helix	trans	-93.8	-23.6	176.9	-62.7	-179.9	-176	173.3	0	114.1	L262	L262-K264 PolarHBondContact O-N 3.11Å
265	Q	84.9	Confident	88.1	Confident	56 Å²	56	34.9 Å²	34.9	26%	0.262	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-33.1	-175.4	-60.3	175.5	-46.5	0	0	111.9	D237 T238 F239 L262	D237-Q265 WeakPolarHBondContact O-CB 3.45Å; D237-Q265 WeakPolarHBondContact O-CG 3.38Å; T238-Q265 VanDerWaalsContact CA-O 3.31Å; T238-Q265 WeakPolarHBondContact CA-O 3.42Å; F239-Q265 HydrophobicContact CE1-CB 4.25Å; F239-Q265 PolarHBondContact N-O 2.97Å; L262-Q265 PolarHBondContact O-N 2.89Å
266	C	88.8	Confident	87.5	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	135.3	-173.1	64.4	0	0	0	0	113.9	F239 I241 L262	F239-C266 HydrophobicContact CE1-CB 4.45Å; F239-C266 HydrophobicContact CE2-CB 4.14Å; F239-C266 HydrophobicContact CZ-CB 4.03Å; F239-C266 WeakPolarHBondContact O-CA 3.39Å; I241-C266 HydrophobicContact CD1-CB 3.56Å; I241-C266 HydrophobicContact CG1-CB 4.15Å; L262-C266 PolarHBondContact O-N 3.09Å; L262-C266 PolarHBondContact O-SG 3Å
267	Q	91.7	Very high	87.3	Confident	40 Å²	40	31.3 Å²	31.3	19%	0.187	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	111.9	173.3	-70.6	171.1	1.8	0	0	110.5	F239 R240 I241 T307 Q810 L812	F239-Q267 PolarHBondContact O-N 3.15Å; R240-Q267 CarbonylContact C-O 3.58Å; R240-Q267 WeakPolarHBondContact CA-O 3.47Å; R240-Q267 HydrophobicContact CG-CB 4.04Å; I241-Q267 PolarHBondContact N-O 3.4Å; Q267-T307 HydrophobicContact CB-CG2 4.49Å; Q267-T307 HydrophobicContact CG-CG2 3.86Å; Q267-Q810 HydrophobicContact CG-CB 4.1Å; Q267-Q810 VanDerWaalsContact CG-OE1 3.22Å; Q267-L812 HydrophobicContact CB-CD1 4.4Å; Q267-L812 HydrophobicContact CB-CD2 4.15Å; Q267-L812 HydrophobicContact CB-CG 4.16Å
268	M	93.3	Very high	87.2	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	121.8	-168.2	-176.1	-86	-73.4	0	0	113.4	I241 V243 V250 L254 V270 L279 Q810 T811 L812	I241-M268 CarbonylContact O-C 3.27Å; I241-M268 WeakPolarHBondContact O-CA 3.09Å; V243-M268 HydrophobicContact CG2-CG 4.21Å; V250-M268 HydrophobicContact CG1-CE 3.28Å; V250-M268 HydrophobicContact CG1-SD 3.58Å; V250-M268 VanDerWaalsContact CG1-SD 3.58Å; L254-M268 HydrophobicContact CD1-CE 4.01Å; L254-M268 HydrophobicContact CD2-CE 3.91Å; L254-M268 HydrophobicContact CG-CE 4.13Å; M268-V270 HydrophobicContact SD-CG2 3.59Å; M268-V270 VanDerWaalsContact SD-CG2 3.59Å; M268-L279 HydrophobicContact CE-CD2 4.31Å; M268-Q810 PolarHBondContact N-O 2.83Å; M268-T811 HydrophobicContact CE-CG2 3.98Å; M268-T811 CarbonylContact O-C 3.56Å; M268-T811 WeakPolarHBondContact O-CA 3.43Å; M268-L812 PolarHBondContact O-N 2.83Å
269	G	92.8	Very high	87.2	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	158.2	169.7	0	0	0	0	0	112.3	I241 L242 V243	I241-G269 PolarHBondContact O-N 3.24Å; L242-G269 WeakPolarHBondContact CA-O 3.48Å; V243-G269 PolarHBondContact N-O 2.89Å
270	V	92.4	Very high	87.2	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.006	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	129.2	-175.1	-172.2	0	0	0	0	111.2	V243 V250 M268 L279 A280 L283 W285	V243-V270 WeakPolarHBondContact O-CA 3.45Å; V250-V270 HydrophobicContact CG1-CG2 4.2Å; V250-V270 HydrophobicContact CG2-CB 4.46Å; V250-V270 HydrophobicContact CG2-CG1 3.77Å; V250-V270 HydrophobicContact CG2-CG2 3.81Å; M268-V270 HydrophobicContact SD-CG2 3.59Å; M268-V270 VanDerWaalsContact SD-CG2 3.59Å; V270-L279 HydrophobicContact CG2-CD2 4.26Å; V270-A280 HydrophobicContact CB-CB 4.16Å; V270-A280 HydrophobicContact CG1-CB 3.84Å; V270-L283 HydrophobicContact CG2-CD1 4.01Å; V270-W285 WeakPolarHBondContact O-CB 3.38Å; V270-W285 VanDerWaalsContact O-CG 3.3Å
271	L	91.8	Very high	87.2	Confident	5 Å²	5	28.3 Å²	28.3	3%	0.026	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	114.7	169	-173.9	74.3	0	0	0	109.5	F205 F209 L242 V243 C244 G245 L273 C289 L295 I298	F205-L271 HydrophobicContact CD1-CD2 3.76Å; F205-L271 HydrophobicContact CE1-CD2 3.88Å; F209-L271 HydrophobicContact CE2-CD2 4.36Å; F209-L271 HydrophobicContact CZ-CD2 4.27Å; L242-L271 HydrophobicContact CD1-CB 4.22Å; V243-L271 PolarHBondContact O-N 2.89Å; C244-L271 HydrophobicContact CB-CB 4.06Å; C244-L271 HydrophobicContact CB-CD2 4.02Å; G245-L271 PolarHBondContact N-O 2.9Å; L271-L273 HydrophobicContact CD2-CD1 4.36Å; L271-L273 HydrophobicContact CD2-CD2 4.13Å; L271-L273 HydrophobicContact CD2-CG 4.22Å; L271-L273 HydrophobicContact CG-CD2 4.29Å; L271-L273 HydrophobicContact CG-CG 4.35Å; L271-L273 PolarHBondContact O-N 2.84Å; L271-C289 HydrophobicContact CD1-CB 3.99Å; L271-C289 HydrophobicContact CG-CB 4.36Å; L271-L295 HydrophobicContact CD2-CD1 4.31Å; L271-I298 HydrophobicContact CD1-CD1 3.97Å; L271-I298 HydrophobicContact CD1-CG2 4.06Å
272	P	90.1	Very high	87.2	Confident	4 Å²	4	25.2 Å²	25.2	3%	0.026	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	85.5	-171.6	29.7	-36.4	0	0	0	113.1	N277 A280 G286 A288 C289	P272-N277 HydrophobicContact CB-CB 3.85Å; P272-A280 HydrophobicContact CB-CB 3.83Å; P272-A280 HydrophobicContact CG-CB 4.34Å; P272-G286 WeakPolarHBondContact CB-O 3.48Å; P272-G286 WeakPolarHBondContact CG-O 3.18Å; P272-A288 CarbonylContact O-C 3.35Å; P272-A288 WeakPolarHBondContact O-CA 3.43Å; P272-C289 HydrophobicContact CG-CB 4.42Å; P272-C289 PolarHBondContact O-N 3.07Å
273	L	85.8	Confident	87.3	Confident	3 Å²	3	25.1 Å²	25.1	2%	0.016	13%	0.129	C	C	.	.			trans	-100.5	-9.7	172.6	-56.7	-173.2	0	0	0	112.7	G198 F205 C244 G245 L271 C289	G198-L273 WeakPolarHBondContact CA-O 3.28Å; G198-L273 PolarHBondContact N-O 3.29Å; F205-L273 HydrophobicContact CB-CD1 4.3Å; F205-L273 HydrophobicContact CD2-CD1 4.1Å; F205-L273 HydrophobicContact CD2-CD2 3.99Å; F205-L273 HydrophobicContact CE1-CD2 4.47Å; F205-L273 HydrophobicContact CE2-CD2 3.77Å; F205-L273 HydrophobicContact CG-CD1 4.15Å; F205-L273 HydrophobicContact CG-CD2 4.45Å; F205-L273 HydrophobicContact CZ-CD2 4.03Å; C244-L273 HydrophobicContact CB-CD1 3.79Å; C244-L273 HydrophobicContact CB-CG 4.4Å; G245-L273 PolarHBondContact O-N 3.36Å; L271-L273 HydrophobicContact CD2-CD1 4.36Å; L271-L273 HydrophobicContact CD2-CD2 4.13Å; L271-L273 HydrophobicContact CD2-CG 4.22Å; L271-L273 HydrophobicContact CG-CD2 4.29Å; L271-L273 HydrophobicContact CG-CG 4.35Å; L271-L273 PolarHBondContact O-N 2.84Å; L273-C289 HydrophobicContact CD2-CB 4.33Å; L273-C289 WeakPolarHBondContact CD2-O 3.29Å
274	G	80.2	Confident	87.6	Confident	7 Å²	7	23 Å²	23	7%	0.072	12%	0.123	C	C	.	.	S	Bend	trans	-85.4	-172.9	-173.8	0	0	0	0	0	115.7	G245 N277 R667	G245-G274 PolarHBondContact O-N 2.66Å; G274-N277 WeakPolarHBondContact CA-OD1 3.27Å; G274-N277 PolarHBondContact N-OD1 2.93Å; G274-N277 PolarHBondContact O-ND2 3.17Å; G274-R667 PolarHBondContact O-NE 2.98Å
275	T	76.8	Confident	87.8	Confident	69 Å²	69	16.4 Å²	16.4	42%	0.423	9%	0.094	S	C	.	.	S	Bend	trans	-85.9	-59	168.4	40	0	0	0	0	110.9	R667 N670	T275-R667 HydrophobicContact CG2-CB 4.34Å; T275-R667 HydrophobicContact CG2-CG 3.89Å; T275-N670 HydrophobicContact CG2-CB 3.8Å
276	G	79.4	Confident	87.8	Confident	26 Å²	26	14 Å²	14	27%	0.268	9%	0.085	S	C	.	.			trans	-77.1	120.6	162	0	0	0	0	0	108.9	G246 D247	G246-G276 CarbonylContact C-O 3.58Å; G246-G276 WeakPolarHBondContact CA-O 3.33Å; D247-G276 PolarHBondContact N-O 3.3Å; D247-G276 WeakPolarHBondContact OD2-CA 3.45Å
277	N	87.8	Confident	87.4	Confident	0 Å²	0	17.1 Å²	17.1	0%	0	11%	0.106	C	C	.	.			trans	-140	32.8	179.3	-65.4	-33.7	0	0	0	108.7	G245 G246 D247 P272 G274 A280 R281 S287 R667	G245-N277 PolarHBondContact O-OD1 3.14Å; G246-N277 WeakPolarHBondContact CA-OD1 3.39Å; D247-N277 WeakPolarHBondContact OD2-CA 3.36Å; D247-N277 PolarHBondContact OD2-N 2.9Å; P272-N277 HydrophobicContact CB-CB 3.85Å; G274-N277 WeakPolarHBondContact CA-OD1 3.27Å; G274-N277 PolarHBondContact N-OD1 2.93Å; G274-N277 PolarHBondContact O-ND2 3.17Å; N277-A280 HydrophobicContact CB-CB 4.24Å; N277-A280 PolarHBondContact O-N 3.01Å; N277-R281 WeakPolarHBondContact O-CG 3.5Å; N277-R281 PolarHBondContact O-N 3.23Å; N277-R281 PolarHBondContact O-NH1 2.76Å; N277-S287 PolarHBondContact ND2-O 2.88Å; N277-R667 PolarHBondContact ND2-NH2 3.24Å
278	D	88.6	Confident	86.9	Confident	5 Å²	5	17.1 Å²	17.1	3%	0.027	11%	0.113	C	C	.	.	H	α-helix	trans	-72	-36.1	-167.4	-79	-105	0	0	0	111.2	D247 A280 R281 V282 I716 S718 G721 G722	D247-D278 VanDerWaalsContact CG-N 3.34Å; D247-D278 PolarHBondContact OD1-N 2.82Å; D247-D278 PolarHBondContact OD2-N 3.45Å; D278-A280 VanDerWaalsContact C-N 3.33Å; D278-A280 PolarHBondContact O-N 3.15Å; D278-R281 VanDerWaalsContact CA-NH1 3.33Å; D278-R281 VanDerWaalsContact CG-NH1 3.25Å; D278-R281 VanDerWaalsContact N-NH1 3.13Å; D278-R281 WeakPolarHBondContact O-CB 3.36Å; D278-R281 PolarHBondContact O-N 3.17Å; D278-R281 IonicContact OD1-NH1 3.14Å; D278-R281 IonicContact OD2-CZ 3.25Å; D278-R281 IonicContact OD2-NH1 2.73Å; D278-R281 PolarHBondContact OD2-NH1 2.88Å; D278-R281 IonicContact OD2-NH2 3.85Å; D278-V282 PolarHBondContact O-N 3.33Å; D278-I716 HydrophobicContact CB-CD1 4.23Å; D278-S718 PolarHBondContact OD1-OG 3.34Å; D278-G721 WeakPolarHBondContact OD1-CA 3.4Å; D278-G721 PolarHBondContact OD1-N 3.26Å; D278-G721 VanDerWaalsContact OD1-N 3.08Å; D278-G721 VanDerWaalsContact OD2-CA 3.26Å; D278-G721 WeakPolarHBondContact OD2-CA 3.15Å; D278-G721 PolarHBondContact OD2-N 3.07Å; D278-G722 PolarHBondContact OD1-N 3.2Å
279	L	89.8	Confident	86.3	Confident	3 Å²	3	17.7 Å²	17.7	2%	0.016	12%	0.117	C	C	.	.	H	α-helix	trans	-61.2	-42.7	168	-174.4	59.3	0	0	0	111.3	D247 V250 M268 V270 R281 V282 L283 L310	D247-L279 WeakPolarHBondContact OD1-CB 3.35Å; D247-L279 PolarHBondContact OD1-N 2.82Å; V250-L279 HydrophobicContact CB-CD2 4.49Å; V250-L279 HydrophobicContact CG1-CD2 3.94Å; M268-L279 HydrophobicContact CE-CD2 4.31Å; V270-L279 HydrophobicContact CG2-CD2 4.26Å; L279-R281 VanDerWaalsContact C-N 3.29Å; L279-R281 PolarHBondContact O-N 3.43Å; L279-V282 PolarHBondContact O-N 3.26Å; L279-L283 HydrophobicContact CD1-CD1 4.03Å; L279-L283 HydrophobicContact CD1-CD2 4.43Å; L279-L283 HydrophobicContact CD1-CG 4.01Å; L279-L283 HydrophobicContact CD2-CD1 4.43Å; L279-L283 HydrophobicContact CG-CD1 3.8Å; L279-L283 HydrophobicContact CG-CG 4.19Å; L279-L283 WeakPolarHBondContact O-CB 3.33Å; L279-L283 VanDerWaalsContact O-CG 3.3Å; L279-L283 WeakPolarHBondContact O-CG 3.35Å; L279-L283 PolarHBondContact O-N 2.99Å; L279-L310 HydrophobicContact CD1-CD1 4.34Å; L279-L310 HydrophobicContact CD1-CD2 3.98Å; L279-L310 HydrophobicContact CD2-CD2 4.3Å
280	A	90.5	Very high	85	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-67	-26.2	178.6	0	0	0	0	0	113.5	V270 P272 N277 D278 W285 G286	V270-A280 HydrophobicContact CB-CB 4.16Å; V270-A280 HydrophobicContact CG1-CB 3.84Å; P272-A280 HydrophobicContact CB-CB 3.83Å; P272-A280 HydrophobicContact CG-CB 4.34Å; N277-A280 HydrophobicContact CB-CB 4.24Å; N277-A280 PolarHBondContact O-N 3.01Å; D278-A280 VanDerWaalsContact C-N 3.33Å; D278-A280 PolarHBondContact O-N 3.15Å; A280-W285 HydrophobicContact CB-CB 4.47Å; A280-W285 PolarHBondContact O-N 2.96Å; A280-G286 CarbonylContact C-O 3.54Å; A280-G286 PolarHBondContact O-N 3.32Å
281	R	88.3	Confident	84.4	Confident	57 Å²	57	24.2 Å²	24.2	22%	0.215	15%	0.152	C	C	.	.	H	α-helix	trans	-68.1	-49.6	170	-68.7	174.8	-171.5	85	-14.4	110.6	N277 D278 L279 G284 G721	N277-R281 WeakPolarHBondContact O-CG 3.5Å; N277-R281 PolarHBondContact O-N 3.23Å; N277-R281 PolarHBondContact O-NH1 2.76Å; D278-R281 VanDerWaalsContact CA-NH1 3.33Å; D278-R281 VanDerWaalsContact CG-NH1 3.25Å; D278-R281 VanDerWaalsContact N-NH1 3.13Å; D278-R281 WeakPolarHBondContact O-CB 3.36Å; D278-R281 PolarHBondContact O-N 3.17Å; D278-R281 IonicContact OD1-NH1 3.14Å; D278-R281 IonicContact OD2-CZ 3.25Å; D278-R281 IonicContact OD2-NH1 2.73Å; D278-R281 PolarHBondContact OD2-NH1 2.88Å; D278-R281 IonicContact OD2-NH2 3.85Å; L279-R281 VanDerWaalsContact C-N 3.29Å; L279-R281 PolarHBondContact O-N 3.43Å; R281-G284 WeakPolarHBondContact O-CA 3.33Å; R281-G284 PolarHBondContact O-N 2.99Å; R281-G721 VanDerWaalsContact CZ-O 3.22Å; R281-G721 PolarHBondContact NE-O 3.43Å; R281-G721 VanDerWaalsContact NH2-CA 3.29Å; R281-G721 PolarHBondContact NH2-O 3.43Å
282	V	87.8	Confident	83.7	Confident	36 Å²	36	26.7 Å²	26.7	22%	0.218	17%	0.165	C	C	.	.	H	α-helix	trans	-67.7	-41.7	-176.3	173.5	0	0	0	0	112.2	D278 L279 G284 I716 P717 S718 F740	D278-V282 PolarHBondContact O-N 3.33Å; L279-V282 PolarHBondContact O-N 3.26Å; V282-G284 PolarHBondContact O-N 2.99Å; V282-G284 VanDerWaalsContact O-N 3.07Å; V282-I716 HydrophobicContact CG1-CB 4.4Å; V282-I716 HydrophobicContact CG2-CB 4.16Å; V282-I716 HydrophobicContact CG2-CD1 4.08Å; V282-I716 HydrophobicContact CG2-CG1 4.4Å; V282-P717 HydrophobicContact CG1-CG 4.47Å; V282-P717 HydrophobicContact CG2-CG 4.28Å; V282-S718 VanDerWaalsContact CG2-CB 3.41Å; V282-F740 HydrophobicContact CG1-CD1 3.57Å; V282-F740 HydrophobicContact CG1-CE1 3.51Å; V282-F740 HydrophobicContact CG1-CZ 4.4Å
283	L	89.2	Confident	83.1	Confident	2 Å²	2	30.9 Å²	30.9	1%	0.01	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	1.4	171.8	-60.3	178.1	0	0	0	113.4	V270 L279 W285 F740 T811 T813 R814	V270-L283 HydrophobicContact CG2-CD1 4.01Å; L279-L283 HydrophobicContact CD1-CD1 4.03Å; L279-L283 HydrophobicContact CD1-CD2 4.43Å; L279-L283 HydrophobicContact CD1-CG 4.01Å; L279-L283 HydrophobicContact CD2-CD1 4.43Å; L279-L283 HydrophobicContact CG-CD1 3.8Å; L279-L283 HydrophobicContact CG-CG 4.19Å; L279-L283 WeakPolarHBondContact O-CB 3.33Å; L279-L283 VanDerWaalsContact O-CG 3.3Å; L279-L283 WeakPolarHBondContact O-CG 3.35Å; L279-L283 PolarHBondContact O-N 2.99Å; L283-W285 VanDerWaalsContact C-N 3.32Å; L283-W285 PolarHBondContact O-N 3.19Å; L283-F740 HydrophobicContact CD2-CE2 4.13Å; L283-F740 HydrophobicContact CD2-CZ 4.16Å; L283-T811 WeakPolarHBondContact CD2-OG1 3.47Å; L283-T813 HydrophobicContact CB-CG2 4.48Å; L283-T813 HydrophobicContact CD2-CG2 3.61Å; L283-T813 WeakPolarHBondContact O-CA 3.05Å; L283-R814 PolarHBondContact O-N 3Å
284	G	87.1	Confident	82.9	Confident	12 Å²	12	34.9 Å²	34.9	12%	0.124	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.2	-10.5	173.4	0	0	0	0	0	115.8	R281 V282 G286 R814 R816	R281-G284 WeakPolarHBondContact O-CA 3.33Å; R281-G284 PolarHBondContact O-N 2.99Å; V282-G284 PolarHBondContact O-N 2.99Å; V282-G284 VanDerWaalsContact O-N 3.07Å; G284-G286 VanDerWaalsContact C-N 3.34Å; G284-G286 PolarHBondContact O-N 3.29Å; G284-R814 PolarHBondContact O-NE 3.22Å; G284-R814 PolarHBondContact O-NH2 2.84Å; G284-R816 PolarHBondContact O-NE 3.39Å; G284-R816 PolarHBondContact O-NH2 3.25Å
285	W	87.9	Confident	83.2	Confident	18 Å²	18	34.6 Å²	34.6	7%	0.068	21%	0.206	C	C	.	.	S	Bend	trans	-59.7	-40.4	178.7	-62.9	105.8	0	0	0	112.6	V270 A280 L283 I298 K301 L302 A305 L812 R814 R816	V270-W285 WeakPolarHBondContact O-CB 3.38Å; V270-W285 VanDerWaalsContact O-CG 3.3Å; A280-W285 HydrophobicContact CB-CB 4.47Å; A280-W285 PolarHBondContact O-N 2.96Å; L283-W285 VanDerWaalsContact C-N 3.32Å; L283-W285 PolarHBondContact O-N 3.19Å; W285-I298 HydrophobicContact CZ3-CG2 4.44Å; W285-K301 HydrophobicContact CZ3-CB 4.29Å; W285-L302 HydrophobicContact CH2-CB 4.2Å; W285-L302 HydrophobicContact CH2-CD1 3.64Å; W285-L302 HydrophobicContact CZ2-CD1 3.61Å; W285-A305 HydrophobicContact CH2-CB 4.09Å; W285-A305 HydrophobicContact CZ2-CB 3.91Å; W285-L812 HydrophobicContact CZ2-CB 4.37Å; W285-L812 PolarHBondContact NE1-O 3.31Å; W285-R814 HydrophobicContact CD2-CB 4.46Å; W285-R814 HydrophobicContact CH2-CB 4.26Å; W285-R814 HydrophobicContact CZ2-CB 4.21Å; W285-R814 HydrophobicContact CZ3-CB 4.43Å; W285-R814 PolarHBondContact O-NH2 3.4Å; W285-R816 PolarHBondContact O-NH2 2.81Å
286	G	84.9	Confident	83.5	Confident	7 Å²	7	32.2 Å²	32.2	7%	0.072	19%	0.191	C	C	.	.			trans	120.7	-173.7	170.2	0	0	0	0	0	114.3	P272 A280 G284	P272-G286 WeakPolarHBondContact CB-O 3.48Å; P272-G286 WeakPolarHBondContact CG-O 3.18Å; A280-G286 CarbonylContact C-O 3.54Å; A280-G286 PolarHBondContact O-N 3.32Å; G284-G286 VanDerWaalsContact C-N 3.34Å; G284-G286 PolarHBondContact O-N 3.29Å
287	S	79.1	Confident	83.8	Confident	64 Å²	64	36.7 Å²	36.7	45%	0.448	21%	0.206	S	C	.	.	S	Bend	trans	-84.1	-21.4	-177.4	52.7	0	0	0	0	114	N277 R667	N277-S287 PolarHBondContact ND2-O 2.88Å; S287-R667 PolarHBondContact O-NH2 2.87Å
288	A	81.9	Confident	83.8	Confident	40 Å²	40	37.5 Å²	37.5	33%	0.331	21%	0.21	S	C	.	.			trans	-157.3	151.4	-171.2	0	0	0	0	0	112.7	P272	P272-A288 CarbonylContact O-C 3.35Å; P272-A288 WeakPolarHBondContact O-CA 3.43Å
289	C	79.6	Confident	83.8	Confident	12 Å²	12	37.3 Å²	37.3	8%	0.081	21%	0.209	C	C	.	.			trans	-143.1	104.9	163.9	-173.8	0	0	0	0	109.8	L271 P272 L273 I298	L271-C289 HydrophobicContact CD1-CB 3.99Å; L271-C289 HydrophobicContact CG-CB 4.36Å; P272-C289 HydrophobicContact CG-CB 4.42Å; P272-C289 PolarHBondContact O-N 3.07Å; L273-C289 HydrophobicContact CD2-CB 4.33Å; L273-C289 WeakPolarHBondContact CD2-O 3.29Å; C289-I298 VanDerWaalsContact SG-CD1 3.59Å
290	D	67.1	Low	83.6	Confident	89 Å²	89	39.8 Å²	39.8	48%	0.476	22%	0.22	S	C	.	.			trans	-112.2	15.7	-171.3	-62.2	-74.5	0	0	0	113.3	Q201 R667	Q201-D290 PolarHBondContact NE2-OD1 3.43Å; Q201-D290 PolarHBondContact OE1-O 2.84Å; D290-R667 IonicContact OD2-NH1 2.67Å
291	D	77.8	Confident	83.3	Confident	50 Å²	50	42.7 Å²	42.7	27%	0.267	23%	0.233	S	C	.	.			trans	-140.4	112.8	-170.9	-179.8	0.1	0	0	0	112.2	T293 Q294	D291-T293 VanDerWaalsContact C-N 3.27Å; D291-T293 VanDerWaalsContact CG-OG1 3.22Å; D291-T293 PolarHBondContact O-N 2.94Å; D291-T293 WeakPolarHBondContact OD1-CA 3.17Å; D291-T293 VanDerWaalsContact OD1-CB 3.25Å; D291-T293 WeakPolarHBondContact OD1-CB 3.32Å; D291-T293 WeakPolarHBondContact OD1-CG2 3.13Å; D291-T293 PolarHBondContact OD1-N 3.21Å; D291-T293 PolarHBondContact OD1-OG1 3.37Å; D291-T293 PolarHBondContact OD2-OG1 3.28Å; D291-T293 VanDerWaalsContact OD2-OG1 3.09Å; D291-Q294 HydrophobicContact CB-CG 4.33Å; D291-Q294 WeakPolarHBondContact OD2-CG 3.47Å; D291-Q294 PolarHBondContact OD2-NE2 3.05Å
292	D	77.3	Confident	83.3	Confident	56 Å²	56	40.1 Å²	40.1	30%	0.299	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-5.1	-179.9	77.3	-73.7	0	0	0	113.9	F205 R208	F205-D292 HydrophobicContact CE1-CB 4.47Å; F205-D292 HydrophobicContact CZ-CB 4.46Å; R208-D292 HydrophobicContact CB-CB 4.3Å; R208-D292 WeakPolarHBondContact CD-OD2 3.37Å; R208-D292 HydrophobicContact CG-CB 4.12Å; R208-D292 PolarHBondContact NE-O 2.84Å; R208-D292 IonicContact NE-OD2 2.71Å
293	T	77.9	Confident	83.2	Confident	93 Å²	93	41.1 Å²	41.1	57%	0.571	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-31.6	173.2	74.2	0	0	0	0	112	D291 L295 P296	D291-T293 VanDerWaalsContact C-N 3.27Å; D291-T293 VanDerWaalsContact CG-OG1 3.22Å; D291-T293 PolarHBondContact O-N 2.94Å; D291-T293 WeakPolarHBondContact OD1-CA 3.17Å; D291-T293 VanDerWaalsContact OD1-CB 3.25Å; D291-T293 WeakPolarHBondContact OD1-CB 3.32Å; D291-T293 WeakPolarHBondContact OD1-CG2 3.13Å; D291-T293 PolarHBondContact OD1-N 3.21Å; D291-T293 PolarHBondContact OD1-OG1 3.37Å; D291-T293 PolarHBondContact OD2-OG1 3.28Å; D291-T293 VanDerWaalsContact OD2-OG1 3.09Å; T293-L295 PolarHBondContact O-N 3.06Å; T293-P296 VanDerWaalsContact O-CD 3.22Å; T293-P296 WeakPolarHBondContact O-CD 3.42Å
294	Q	81.7	Confident	82.9	Confident	87 Å²	87	49.4 Å²	49.4	41%	0.407	26%	0.257	S	S	.	.	S	Bend	trans	-73.1	-13.2	179.2	-65.1	174.9	38.2	0	0	113.3	D291 P296 Q297 I298	D291-Q294 HydrophobicContact CB-CG 4.33Å; D291-Q294 WeakPolarHBondContact OD2-CG 3.47Å; D291-Q294 PolarHBondContact OD2-NE2 3.05Å; Q294-P296 VanDerWaalsContact C-CD 3.45Å; Q294-Q297 WeakPolarHBondContact O-CB 3.42Å; Q294-Q297 PolarHBondContact O-N 3.46Å; Q294-I298 HydrophobicContact CB-CD1 4.26Å; Q294-I298 PolarHBondContact O-N 2.91Å; Q294-I298 VanDerWaalsContact O-N 3.09Å
295	L	86.1	Confident	82.9	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-55.3	-37.8	-171.2	-159.4	61	0	0	0	115.9	F205 R208 F209 L212 L271 T293 Q297 I298 L299	F205-L295 HydrophobicContact CD1-CD1 4.02Å; F205-L295 HydrophobicContact CD1-CD2 4.22Å; F205-L295 HydrophobicContact CE1-CD1 4.06Å; R208-L295 HydrophobicContact CB-CD2 3.89Å; R208-L295 HydrophobicContact CG-CB 4.31Å; R208-L295 HydrophobicContact CG-CD2 3.56Å; F209-L295 HydrophobicContact CD1-CD2 3.84Å; F209-L295 HydrophobicContact CD1-CG 4.47Å; F209-L295 HydrophobicContact CD2-CD2 4.05Å; F209-L295 HydrophobicContact CE1-CD1 3.89Å; F209-L295 HydrophobicContact CE1-CD2 3.79Å; F209-L295 HydrophobicContact CE1-CG 4.03Å; F209-L295 HydrophobicContact CE2-CD1 4.23Å; F209-L295 HydrophobicContact CE2-CD2 4Å; F209-L295 HydrophobicContact CG-CD2 3.98Å; F209-L295 HydrophobicContact CZ-CD1 3.6Å; F209-L295 HydrophobicContact CZ-CD2 3.89Å; F209-L295 HydrophobicContact CZ-CG 4.17Å; L212-L295 HydrophobicContact CD1-CB 4.33Å; L212-L295 HydrophobicContact CD1-CD2 4.18Å; L212-L295 HydrophobicContact CD1-CG 4.26Å; L271-L295 HydrophobicContact CD2-CD1 4.31Å; T293-L295 PolarHBondContact O-N 3.06Å; L295-Q297 VanDerWaalsContact C-N 3.34Å; L295-Q297 PolarHBondContact O-N 2.92Å; L295-I298 HydrophobicContact CD1-CD1 4.49Å; L295-I298 PolarHBondContact O-N 3.08Å; L295-L299 WeakPolarHBondContact O-CG 3.3Å; L295-L299 PolarHBondContact O-N 3.04Å
296	P	84.6	Confident	82.9	Confident	19 Å²	19	51.9 Å²	51.9	12%	0.123	28%	0.276	C	S	.	.	H	α-helix	trans	-62.4	-38.4	173.5	-21.8	34.7	0	0	0	113.1	L212 T293 Q294 I298 L299 E300	L212-P296 HydrophobicContact CD1-CG 4.14Å; L212-P296 HydrophobicContact CD2-CG 4.43Å; T293-P296 VanDerWaalsContact O-CD 3.22Å; T293-P296 WeakPolarHBondContact O-CD 3.42Å; Q294-P296 VanDerWaalsContact C-CD 3.45Å; P296-I298 VanDerWaalsContact C-N 3.32Å; P296-L299 PolarHBondContact O-N 3.28Å; P296-E300 PolarHBondContact O-N 2.91Å
297	Q	85.4	Confident	83.1	Confident	121 Å²	121	55 Å²	55	57%	0.565	29%	0.294	S	S	*	.	H	α-helix	trans	-68.9	-33.6	176.5	-57.5	177.2	-1.3	0	0	111.3	Q294 L295 E300 K301	Q294-Q297 WeakPolarHBondContact O-CB 3.42Å; Q294-Q297 PolarHBondContact O-N 3.46Å; L295-Q297 VanDerWaalsContact C-N 3.34Å; L295-Q297 PolarHBondContact O-N 2.92Å; Q297-E300 PolarHBondContact O-N 3.26Å; Q297-K301 VanDerWaalsContact O-CG 3.29Å; Q297-K301 WeakPolarHBondContact O-CG 3.35Å; Q297-K301 PolarHBondContact O-N 2.99Å
298	I	87.3	Confident	83.6	Confident	17 Å²	17	55.8 Å²	55.8	9%	0.087	29%	0.289	C	S	.	.	H	α-helix	trans	-69.1	-41.4	175.6	-62.5	170.9	0	0	0	110.6	L271 W285 C289 Q294 L295 P296 K301 L302	L271-I298 HydrophobicContact CD1-CD1 3.97Å; L271-I298 HydrophobicContact CD1-CG2 4.06Å; W285-I298 HydrophobicContact CZ3-CG2 4.44Å; C289-I298 VanDerWaalsContact SG-CD1 3.59Å; Q294-I298 HydrophobicContact CB-CD1 4.26Å; Q294-I298 PolarHBondContact O-N 2.91Å; Q294-I298 VanDerWaalsContact O-N 3.09Å; L295-I298 HydrophobicContact CD1-CD1 4.49Å; L295-I298 PolarHBondContact O-N 3.08Å; P296-I298 VanDerWaalsContact C-N 3.32Å; I298-K301 PolarHBondContact O-N 3.23Å; I298-L302 WeakPolarHBondContact O-CB 3.3Å; I298-L302 PolarHBondContact O-N 2.88Å
299	L	87.6	Confident	84.1	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-61.3	-43.2	172.9	-71.6	172.6	0	0	0	111.8	L189 F209 L212 L213 L295 P296 K301 L302 E303	L189-L299 HydrophobicContact CD2-CD2 3.37Å; F209-L299 HydrophobicContact CE1-CD2 4.25Å; L212-L299 HydrophobicContact CB-CD1 4.49Å; L212-L299 HydrophobicContact CD1-CD1 3.86Å; L213-L299 HydrophobicContact CD2-CD1 4.36Å; L295-L299 WeakPolarHBondContact O-CG 3.3Å; L295-L299 PolarHBondContact O-N 3.04Å; P296-L299 PolarHBondContact O-N 3.28Å; L299-K301 VanDerWaalsContact C-N 3.29Å; L299-K301 PolarHBondContact O-N 3.17Å; L299-L302 CarbonylContact O-C 3.55Å; L299-L302 WeakPolarHBondContact O-CA 3.38Å; L299-L302 WeakPolarHBondContact O-CB 3.43Å; L299-L302 PolarHBondContact O-N 2.93Å; L299-L302 VanDerWaalsContact O-N 3.09Å; L299-E303 PolarHBondContact O-N 2.9Å
300	E	85.6	Confident	84.8	Confident	56 Å²	56	55.9 Å²	55.9	26%	0.262	28%	0.282	S	S	.	.	H	α-helix	trans	-65.5	-30.9	177.1	-151.8	-164.6	126	0	0	112.7	Q157 P296 Q297 R304	Q157-E300 PolarHBondContact NE2-OE2 2.93Å; P296-E300 PolarHBondContact O-N 2.91Å; Q297-E300 PolarHBondContact O-N 3.26Å; E300-R304 PolarHBondContact O-N 3.07Å; E300-R304 PolarHBondContact O-NH1 3.38Å; E300-R304 IonicContact OE1-CZ 3.6Å; E300-R304 IonicContact OE1-NH1 3.14Å; E300-R304 PolarHBondContact OE1-NH1 3.12Å; E300-R304 IonicContact OE1-NH2 3.77Å; E300-R304 PolarHBondContact OE1-NH2 2.83Å
301	K	86.1	Confident	86.1	Confident	61 Å²	61	51.7 Å²	51.7	27%	0.265	26%	0.26	S	S	.	.	H	α-helix	trans	-73.9	-33.5	170.5	-72.6	172.2	175.8	-73.2	0	112.3	W285 Q297 I298 L299 E303 R304 A305 E819	W285-K301 HydrophobicContact CZ3-CB 4.29Å; Q297-K301 VanDerWaalsContact O-CG 3.29Å; Q297-K301 WeakPolarHBondContact O-CG 3.35Å; Q297-K301 PolarHBondContact O-N 2.99Å; I298-K301 PolarHBondContact O-N 3.23Å; L299-K301 VanDerWaalsContact C-N 3.29Å; L299-K301 PolarHBondContact O-N 3.17Å; K301-E303 VanDerWaalsContact C-N 3.27Å; K301-E303 PolarHBondContact O-N 3.17Å; K301-R304 CarbonylContact O-C 3.56Å; K301-R304 PolarHBondContact O-N 2.88Å; K301-A305 WeakPolarHBondContact O-CB 3.36Å; K301-A305 PolarHBondContact O-N 3.25Å; K301-E819 WeakPolarHBondContact CG-OE1 3.38Å; K301-E819 IonicContact NZ-OE1 2.71Å; K301-E819 PolarHBondContact NZ-OE1 3.06Å; K301-E819 IonicContact NZ-OE2 3.17Å; K301-E819 PolarHBondContact NZ-OE2 3.49Å
302	L	86.9	Confident	86.9	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-72.7	-18.3	174	-163.5	72.6	0	0	0	113	L189 R240 L242 W285 I298 L299 L812	L189-L302 HydrophobicContact CD1-CD2 3.72Å; L189-L302 HydrophobicContact CD2-CD2 3.99Å; R240-L302 PolarHBondContact NH1-O 3.4Å; L242-L302 HydrophobicContact CB-CD2 4.02Å; L242-L302 HydrophobicContact CD1-CD1 4.36Å; L242-L302 HydrophobicContact CD1-CD2 4.02Å; L242-L302 HydrophobicContact CD2-CD2 4.05Å; L242-L302 HydrophobicContact CG-CD2 4.26Å; W285-L302 HydrophobicContact CH2-CB 4.2Å; W285-L302 HydrophobicContact CH2-CD1 3.64Å; W285-L302 HydrophobicContact CZ2-CD1 3.61Å; I298-L302 WeakPolarHBondContact O-CB 3.3Å; I298-L302 PolarHBondContact O-N 2.88Å; L299-L302 CarbonylContact O-C 3.55Å; L299-L302 WeakPolarHBondContact O-CA 3.38Å; L299-L302 WeakPolarHBondContact O-CB 3.43Å; L299-L302 PolarHBondContact O-N 2.93Å; L299-L302 VanDerWaalsContact O-N 3.09Å; L302-L812 HydrophobicContact CD1-CB 4.21Å; L302-L812 HydrophobicContact CD1-CD1 3.57Å; L302-L812 HydrophobicContact CG-CD1 4.04Å
303	E	85.1	Confident	87.7	Confident	57 Å²	57	46.7 Å²	46.7	27%	0.266	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-15.3	169	-73.4	175.4	178.9	0	0	112.8	S161 L299 K301	S161-E303 VanDerWaalsContact CB-OE1 3.23Å; S161-E303 WeakPolarHBondContact CB-OE1 3.42Å; S161-E303 PolarHBondContact N-OE1 3.22Å; S161-E303 VanDerWaalsContact N-OE1 3.09Å; S161-E303 WeakPolarHBondContact OG-CG 3.18Å; S161-E303 PolarHBondContact OG-OE1 3.47Å; L299-E303 PolarHBondContact O-N 2.9Å; K301-E303 VanDerWaalsContact C-N 3.27Å; K301-E303 PolarHBondContact O-N 3.17Å
304	R	83.3	Confident	88.5	Confident	176 Å²	176	42.5 Å²	42.5	66%	0.664	21%	0.207	S	C	*	.	S	Bend	trans	-113.7	4	175.5	-60	-167.1	-168.8	91	-6.5	114.6	E300 K301	E300-R304 PolarHBondContact O-N 3.07Å; E300-R304 PolarHBondContact O-NH1 3.38Å; E300-R304 IonicContact OE1-CZ 3.6Å; E300-R304 IonicContact OE1-NH1 3.14Å; E300-R304 PolarHBondContact OE1-NH1 3.12Å; E300-R304 IonicContact OE1-NH2 3.77Å; E300-R304 PolarHBondContact OE1-NH2 2.83Å; K301-R304 CarbonylContact O-C 3.56Å; K301-R304 PolarHBondContact O-N 2.88Å
305	A	87.2	Confident	89.2	Confident	20 Å²	20	38.4 Å²	38.4	17%	0.165	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-71.1	139	-177.4	0	0	0	0	0	111.6	W285 K301 L812 T813	W285-A305 HydrophobicContact CH2-CB 4.09Å; W285-A305 HydrophobicContact CZ2-CB 3.91Å; K301-A305 WeakPolarHBondContact O-CB 3.36Å; K301-A305 PolarHBondContact O-N 3.25Å; A305-L812 HydrophobicContact CB-CB 4.1Å; A305-L812 HydrophobicContact CB-CD2 4.31Å; A305-T813 WeakPolarHBondContact CB-O 3.35Å
306	S	87.9	Confident	89.5	Confident	62 Å²	62	39.7 Å²	39.7	43%	0.434	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	139.3	176.9	45.9	0	0	0	0	111.4	T813	S306-T813 PolarHBondContact N-O 2.7Å; S306-T813 VanDerWaalsContact N-O 3.07Å; S306-T813 PolarHBondContact O-N 2.99Å; S306-T813 PolarHBondContact O-OG1 3.48Å; S306-T813 PolarHBondContact OG-O 2.88Å; S306-T813 PolarHBondContact OG-OG1 3.24Å
307	T	89.6	Confident	89.9	Confident	72 Å²	72	38.9 Å²	38.9	44%	0.442	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	134.5	172.6	44.3	0	0	0	0	111.6	Q267 T811 L812	Q267-T307 HydrophobicContact CB-CG2 4.49Å; Q267-T307 HydrophobicContact CG-CG2 3.86Å; T307-T811 CarbonylContact C-O 3.46Å; T307-T811 WeakPolarHBondContact CA-O 3.23Å; T307-L812 HydrophobicContact CG2-CD2 3.85Å
308	K	90.6	Very high	90.2	Very high	81 Å²	81	37.4 Å²	37.4	35%	0.352	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	156.7	163.5	-84	-172.8	156.2	-113.5	0	109.7	F740 D741 T811 T813	K308-F740 HydrophobicContact CB-CE2 4.02Å; K308-F740 HydrophobicContact CB-CZ 4.41Å; K308-F740 HydrophobicContact CD-CE2 4.1Å; K308-F740 HydrophobicContact CD-CZ 3.72Å; K308-D741 IonicContact NZ-OD1 3.4Å; K308-D741 IonicContact NZ-OD2 2.71Å; K308-D741 PolarHBondContact NZ-OD2 3.15Å; K308-T811 PolarHBondContact N-O 3.04Å; K308-T811 PolarHBondContact O-N 2.87Å; K308-T811 PolarHBondContact O-OG1 3.41Å; K308-T813 HydrophobicContact CB-CG2 3.92Å; K308-T813 HydrophobicContact CD-CG2 4.06Å; K308-T813 HydrophobicContact CG-CG2 4.17Å
309	M	92.3	Very high	90.2	Very high	55 Å²	55	41 Å²	41	27%	0.271	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	153	165.8	-59.4	-50.8	-58.2	0	0	109.5	F740 D741 R808 T809 Q810	M309-F740 VanDerWaalsContact O-CD2 3.28Å; M309-F740 WeakPolarHBondContact O-CD2 3.46Å; M309-F740 WeakPolarHBondContact O-CE2 3.37Å; M309-D741 HydrophobicContact CB-CB 4.19Å; M309-R808 HydrophobicContact CE-CB 3.47Å; M309-R808 VanDerWaalsContact CE-CB 3.47Å; M309-T809 CarbonylContact C-O 3.53Å; M309-T809 WeakPolarHBondContact CA-O 3.44Å; M309-Q810 HydrophobicContact CE-CG 4.23Å; M309-Q810 HydrophobicContact SD-CG 3.87Å
310	L	93.2	Very high	89.7	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	120.3	161.2	175.1	64.8	0	0	0	107	L279 R312 I716 F740 R808 T809 T811	L279-L310 HydrophobicContact CD1-CD1 4.34Å; L279-L310 HydrophobicContact CD1-CD2 3.98Å; L279-L310 HydrophobicContact CD2-CD2 4.3Å; L310-R312 HydrophobicContact CG-CG 4.38Å; L310-I716 HydrophobicContact CD1-CG2 4.33Å; L310-F740 WeakPolarHBondContact CA-O 3.14Å; L310-F740 HydrophobicContact CD1-CB 4.02Å; L310-F740 HydrophobicContact CD1-CD2 3.95Å; L310-F740 HydrophobicContact CD1-CG 4.33Å; L310-R808 VanDerWaalsContact O-CA 3.27Å; L310-R808 WeakPolarHBondContact O-CA 3.22Å; L310-T809 PolarHBondContact N-O 3.47Å; L310-T809 PolarHBondContact O-N 3.24Å; L310-T811 HydrophobicContact CB-CG2 3.61Å; L310-T811 HydrophobicContact CD2-CG2 4.06Å; L310-T811 HydrophobicContact CG-CG2 4.49Å
311	D	94.1	Very high	88.3	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	140.5	171.1	-68.5	-47	0	0	0	110.4	W313 N715 F740 D741 D742 K743 H805 R808	D311-W313 HydrophobicContact CB-CZ2 4.42Å; D311-N715 PolarHBondContact O-ND2 3.4Å; D311-F740 PolarHBondContact N-O 3.29Å; D311-D741 WeakPolarHBondContact OD2-CA 3.45Å; D311-D741 PolarHBondContact OD2-N 3.35Å; D311-D742 PolarHBondContact OD2-N 2.92Å; D311-D742 VanDerWaalsContact OD2-N 3.1Å; D311-K743 WeakPolarHBondContact OD1-CG 3.16Å; D311-K743 WeakPolarHBondContact OD2-CA 3.38Å; D311-K743 PolarHBondContact OD2-N 3.45Å; D311-H805 IonicContact OD1-NE2 3.66Å; D311-R808 WeakPolarHBondContact OD1-CD 3.15Å; D311-R808 VanDerWaalsContact OD1-CG 3.24Å; D311-R808 WeakPolarHBondContact OD1-CG 3.46Å
312	R	94.3	Very high	86.4	Confident	1 Å²	1	52 Å²	52	0%	0.004	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	140	-175.6	-65.2	177	62.5	-128.3	1.7	110.6	D258 L310 V636 N638 K806 N807 T809	D258-R312 IonicContact OD1-CZ 3.08Å; D258-R312 IonicContact OD1-NH1 3.98Å; D258-R312 PolarHBondContact OD1-NH1 3.29Å; D258-R312 IonicContact OD2-CZ 3.62Å; D258-R312 VanDerWaalsContact OD2-CZ 3.25Å; D258-R312 IonicContact OD2-NH1 3.4Å; D258-R312 PolarHBondContact OD2-NH1 2.86Å; D258-R312 IonicContact OD2-NH2 3.03Å; D258-R312 PolarHBondContact OD2-NH2 2.82Å; L310-R312 HydrophobicContact CG-CG 4.38Å; R312-V636 HydrophobicContact CB-CG1 4.22Å; R312-N638 PolarHBondContact NE-OD1 3.24Å; R312-K806 WeakPolarHBondContact O-CA 3.43Å; R312-K806 WeakPolarHBondContact O-CB 3.49Å; R312-K806 PolarHBondContact O-N 3.32Å; R312-N807 PolarHBondContact N-O 2.91Å; R312-N807 PolarHBondContact NH1-OD1 3.37Å; R312-N807 PolarHBondContact O-N 2.85Å; R312-T809 WeakPolarHBondContact CD-OG1 3.47Å
313	W	95.4	Very high	83.9	Confident	1 Å²	1	56.9 Å²	56.9	0%	0.004	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	128.2	-158.3	-61.4	88.1	0	0	0	111.4	D311 V636 M637 N715 L745 R773 I803 I804 H805	D311-W313 HydrophobicContact CB-CZ2 4.42Å; W313-V636 CarbonylContact O-C 3.59Å; W313-V636 WeakPolarHBondContact O-CA 3.5Å; W313-M637 HydrophobicContact CB-CB 4.23Å; W313-M637 HydrophobicContact CB-CE 3.59Å; W313-M637 HydrophobicContact CD2-CE 4.48Å; W313-M637 HydrophobicContact CG-CE 3.69Å; W313-M637 PolarHBondContact N-O 3.41Å; W313-M637 PolarHBondContact O-N 3.17Å; W313-N715 VanDerWaalsContact NE1-CG 3.33Å; W313-N715 PolarHBondContact NE1-OD1 3.17Å; W313-L745 HydrophobicContact CD2-CD1 3.88Å; W313-L745 HydrophobicContact CD2-CD2 3.86Å; W313-L745 HydrophobicContact CD2-CG 4Å; W313-L745 HydrophobicContact CE3-CD1 3.6Å; W313-L745 HydrophobicContact CE3-CD2 4.41Å; W313-L745 HydrophobicContact CE3-CG 4.06Å; W313-L745 HydrophobicContact CG-CD2 4.19Å; W313-L745 HydrophobicContact CH2-CD1 4.12Å; W313-L745 HydrophobicContact CH2-CD2 4.45Å; W313-L745 HydrophobicContact CH2-CG 3.8Å; W313-L745 HydrophobicContact CZ2-CD1 4.34Å; W313-L745 HydrophobicContact CZ2-CD2 3.88Å; W313-L745 HydrophobicContact CZ2-CG 3.71Å; W313-L745 HydrophobicContact CZ3-CD1 3.74Å; W313-L745 HydrophobicContact CZ3-CG 3.97Å; W313-R773 VanDerWaalsContact CZ3-O 3.31Å; W313-R773 WeakPolarHBondContact CZ3-O 3.43Å; W313-I803 HydrophobicContact CB-CG2 4.09Å; W313-I803 HydrophobicContact CE3-CG2 4.27Å; W313-I804 CarbonylContact C-O 3.58Å; W313-I804 WeakPolarHBondContact CA-O 3.47Å; W313-I804 VanDerWaalsContact CE3-C 3.4Å; W313-H805 VanDerWaalsContact CE3-CA 3.45Å; W313-H805 HydrophobicContact CE3-CB 3.94Å; W313-H805 HydrophobicContact CH2-CB 3.99Å; W313-H805 HydrophobicContact CZ3-CB 3.64Å
314	S	95.1	Very high	81.5	Confident	5 Å²	5	63.4 Å²	63.4	4%	0.035	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	132.5	175	-172.3	0	0	0	0	109.9	M316 E633 I803 I804	S314-M316 PolarHBondContact OG-SD 3.43Å; S314-M316 VanDerWaalsContact OG-SD 3.36Å; S314-E633 VanDerWaalsContact CB-OE1 3.29Å; S314-E633 WeakPolarHBondContact CB-OE1 3.47Å; S314-E633 VanDerWaalsContact OG-CD 3.32Å; S314-E633 WeakPolarHBondContact OG-CG 3.44Å; S314-E633 PolarHBondContact OG-OE1 3.4Å; S314-I803 WeakPolarHBondContact O-CA 3.34Å; S314-I804 PolarHBondContact N-O 2.79Å; S314-I804 PolarHBondContact O-N 3.29Å; S314-I804 VanDerWaalsContact O-N 3.13Å
315	I	95	Very high	79	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	93.4	173.6	-52.8	-61.5	0	0	0	107.4	V317 K634 C635 M637 F641 V789 I801 I803	I315-V317 HydrophobicContact CG2-CG2 4.49Å; I315-K634 PolarHBondContact O-N 3.47Å; I315-C635 PolarHBondContact N-O 2.85Å; I315-M637 HydrophobicContact CD1-CB 3.92Å; I315-M637 HydrophobicContact CD1-SD 4.48Å; I315-M637 HydrophobicContact CG1-CB 4.1Å; I315-F641 HydrophobicContact CD1-CD2 4.16Å; I315-V789 HydrophobicContact CG1-CG2 4.15Å; I315-I801 HydrophobicContact CG2-CG2 3.94Å; I315-I803 HydrophobicContact CD1-CB 4.3Å; I315-I803 HydrophobicContact CD1-CD1 3.98Å; I315-I803 HydrophobicContact CD1-CG1 3.74Å; I315-I803 HydrophobicContact CD1-CG2 3.91Å
316	M	93.8	Very high	76.3	Confident	28 Å²	28	70 Å²	70	14%	0.138	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	133.4	179	-60.8	-61.9	-76.7	0	0	109.9	S314 Y631 T632 E633 I801 K802 I804	S314-M316 PolarHBondContact OG-SD 3.43Å; S314-M316 VanDerWaalsContact OG-SD 3.36Å; M316-Y631 HydrophobicContact CB-CD1 4.03Å; M316-Y631 HydrophobicContact CB-CG 4.5Å; M316-T632 CarbonylContact C-O 3.47Å; M316-T632 WeakPolarHBondContact CA-O 3.28Å; M316-E633 VanDerWaalsContact SD-CA 3.59Å; M316-E633 HydrophobicContact SD-CB 3.68Å; M316-E633 HydrophobicContact SD-CG 4.37Å; M316-I801 CarbonylContact O-C 3.27Å; M316-I801 WeakPolarHBondContact O-CA 3.41Å; M316-K802 HydrophobicContact CB-CB 4.29Å; M316-K802 WeakPolarHBondContact CB-O 3.48Å; M316-K802 PolarHBondContact N-O 3.11Å; M316-K802 PolarHBondContact O-N 2.93Å; M316-I804 HydrophobicContact CG-CD1 3.9Å; M316-I804 HydrophobicContact CG-CG1 4.22Å
317	V	93.1	Very high	73.6	Confident	1 Å²	1	72.3 Å²	72.3	1%	0.006	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	131.4	-179	178.4	0	0	0	0	110.3	I315 E319 T632 K634 Y800 I801	I315-V317 HydrophobicContact CG2-CG2 4.49Å; V317-E319 HydrophobicContact CG1-CG 4.18Å; V317-T632 PolarHBondContact N-O 3.07Å; V317-T632 PolarHBondContact O-N 3.44Å; V317-T632 PolarHBondContact O-OG1 2.71Å; V317-K634 HydrophobicContact CG2-CB 3.92Å; V317-K634 HydrophobicContact CG2-CG 4.42Å; V317-Y800 WeakPolarHBondContact CA-O 3.47Å; V317-I801 HydrophobicContact CG2-CG2 4.4Å
318	Y	90.4	Very high	70.9	Confident	90 Å²	90	73.9 Å²	73.9	35%	0.353	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	114.1	169.6	171.8	-131.1	0	0	0	109.5	T320 C630 G799 Y800	Y318-T320 HydrophobicContact CE1-CG2 4.28Å; Y318-C630 HydrophobicContact CD2-CB 4.03Å; Y318-C630 WeakPolarHBondContact CD2-O 3.2Å; Y318-C630 HydrophobicContact CE2-CB 4.07Å; Y318-C630 HydrophobicContact CG-CB 4.4Å; Y318-G799 WeakPolarHBondContact O-CA 3.43Å; Y318-Y800 AromaticContact CD1-CD2 3.66Å; Y318-Y800 HydrophobicContact CD1-CD2 3.66Å; Y318-Y800 HydrophobicContact CD1-CE2 4.23Å; Y318-Y800 HydrophobicContact CE1-CD2 4.23Å; Y318-Y800 HydrophobicContact CE1-CE2 4.35Å; Y318-Y800 PolarHBondContact N-O 2.94Å; Y318-Y800 PolarHBondContact O-N 2.59Å
319	E	87	Confident	67.9	Low	92 Å²	92	74.6 Å²	74.6	43%	0.43	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	116.9	-177.7	-60.9	-178.9	172.3	0	0	110.3	V317 K321 P797	V317-E319 HydrophobicContact CG1-CG 4.18Å; E319-K321 PolarHBondContact O-N 2.98Å; E319-K321 VanDerWaalsContact O-N 3.17Å; E319-P797 HydrophobicContact CG-CG 4.06Å
320	T	78	Confident	64.8	Low	27 Å²	27	77.9 Å²	77.9	17%	0.166	41%	0.409	C	S	.	.			trans	-80.3	101.2	178.5	46.5	0	0	0	0	110.1	Y318 F322 P798 G799 Y800	Y318-T320 HydrophobicContact CE1-CG2 4.28Å; T320-F322 PolarHBondContact O-N 2.96Å; T320-F322 VanDerWaalsContact OG1-CE2 3.23Å; T320-F322 WeakPolarHBondContact OG1-CE2 3.35Å; T320-P798 PolarHBondContact N-O 3.34Å; T320-P798 PolarHBondContact OG1-O 2.94Å; T320-G799 WeakPolarHBondContact OG1-CA 3.44Å; T320-G799 PolarHBondContact OG1-N 2.78Å; T320-Y800 HydrophobicContact CG2-CD2 3.8Å; T320-Y800 HydrophobicContact CG2-CE2 3.43Å; T320-Y800 VanDerWaalsContact CG2-CE2 3.43Å
321	K	55.2	Low	62	Low	190 Å²	190	84.3 Å²	84.3	83%	0.826	45%	0.447	S	S	*	.			trans	-68.4	81.2	162.1	-66.1	-178.4	-177.8	177.4	0	109.2	E319 P323	E319-K321 PolarHBondContact O-N 2.98Å; E319-K321 VanDerWaalsContact O-N 3.17Å; K321-P323 VanDerWaalsContact O-CD 3.25Å; K321-P323 WeakPolarHBondContact O-CD 3.38Å
322	F	46	Very low	58.8	Low	133 Å²	133	90.4 Å²	90.4	58%	0.583	49%	0.485	S	S	*	.			trans	-55.5	118.9	171.2	-80.4	-78.7	0	0	0	109.1	T320 R324 P798	T320-F322 PolarHBondContact O-N 2.96Å; T320-F322 VanDerWaalsContact OG1-CE2 3.23Å; T320-F322 WeakPolarHBondContact OG1-CE2 3.35Å; F322-R324 PolarHBondContact O-N 2.91Å; F322-P798 HydrophobicContact CE2-CB 4.49Å
323	P	34.8	Very low	56.2	Low	104 Å²	104	99.2 Å²	99.2	68%	0.675	53%	0.526	S	S	*	.			trans	-64.4	123.8	166.4	-13.6	29	0	0	0	106.8	K321 Q325	K321-P323 VanDerWaalsContact O-CD 3.25Å; K321-P323 WeakPolarHBondContact O-CD 3.38Å; P323-Q325 PolarHBondContact O-N 3.07Å
324	R	35.9	Very low	52.9	Low	194 Å²	194	106.6 Å²	106.6	73%	0.732	57%	0.566	S	S	*	*			trans	-54	114.5	172.2	-75.9	-175.9	175.5	174.5	-1.2	107.9	F322 H326	F322-R324 PolarHBondContact O-N 2.91Å; R324-H326 VanDerWaalsContact C-N 3.32Å; R324-H326 PolarHBondContact O-N 3.33Å
325	Q	31.1	Very low	50.3	Low	164 Å²	164	112.8 Å²	112.8	77%	0.766	61%	0.608	S	S	*	*			trans	-71	94.7	175.2	-72.2	-168.4	-1.5	0	0	108.2	P323 S327	P323-Q325 PolarHBondContact O-N 3.07Å; Q325-S327 VanDerWaalsContact C-N 3.27Å; Q325-S327 PolarHBondContact O-N 3.07Å
326	H	30.1	Very low	47.5	Very low	169 Å²	169	117.9 Å²	117.9	78%	0.782	64%	0.643	S	S	*	*			trans	-66.3	93.1	163.3	-72	-79.6	0	0	0	107.8	R324 A328	R324-H326 VanDerWaalsContact C-N 3.32Å; R324-H326 PolarHBondContact O-N 3.33Å; H326-A328 VanDerWaalsContact C-N 3.25Å; H326-A328 PolarHBondContact O-N 2.93Å
327	S	31.5	Very low	44.8	Very low	112 Å²	112	121.9 Å²	121.9	78%	0.783	67%	0.665	S	S	*	*			trans	-63.2	83.4	176.4	-63.8	0	0	0	0	110.6	Q325 S329	Q325-S327 VanDerWaalsContact C-N 3.27Å; Q325-S327 PolarHBondContact O-N 3.07Å; S327-S329 PolarHBondContact O-N 2.7Å
328	A	31.9	Very low	42.1	Very low	104 Å²	104	128.7 Å²	128.7	86%	0.86	70%	0.701	S	S	*	*			trans	-72.9	96.6	-177.8	0	0	0	0	0	110.9	H326	H326-A328 VanDerWaalsContact C-N 3.25Å; H326-A328 PolarHBondContact O-N 2.93Å
329	S	27	Very low	39.9	Very low	96 Å²	96	128 Å²	128	67%	0.671	71%	0.709	S	S	*	*			trans	-134.1	116.7	163.7	-163.8	0	0	0	0	111.5	S327	S327-S329 PolarHBondContact O-N 2.7Å
330	T	28.1	Very low	38	Very low	125 Å²	125	128.8 Å²	128.8	77%	0.767	71%	0.713	S	S	*	*			trans	47.1	100.9	145.8	54.9	0	0	0	0	118.8	T332	T330-T332 PolarHBondContact O-N 2.95Å
331	V	35	Very low	36.6	Very low	134 Å²	134	131.7 Å²	131.7	81%	0.812	73%	0.731	S	S	*	*			trans	-31.4	120.5	159.5	179.9	0	0	0	0	114.6
332	T	27.1	Very low	36	Very low	129 Å²	129	127.2 Å²	127.2	79%	0.791	71%	0.713	S	S	*	*			trans	-135	130.5	137.5	46.4	0	0	0	0	107.5	T330 D334	T330-T332 PolarHBondContact O-N 2.95Å; T332-D334 PolarHBondContact O-N 3.09Å
333	E	39	Very low	36.3	Very low	185 Å²	185	124.3 Å²	124.3	86%	0.864	70%	0.701	S	S	*	*			trans	-80.2	109.5	174.6	-65.5	178.6	126.2	0	0	109.6
334	D	25.3	Very low	37.3	Very low	157 Å²	157	122.7 Å²	122.7	84%	0.84	69%	0.686	S	S	*	*			trans	-151.3	140.5	160.6	-101.3	-43.7	0	0	0	109	T332	T332-D334 PolarHBondContact O-N 3.09Å
335	C	40.4	Very low	38.1	Very low	135 Å²	135	117.9 Å²	117.9	91%	0.912	67%	0.674	S	S	*	*			trans	-103.4	122.1	-170.5	-66.7	0	0	0	0	112.3
336	S	37.6	Very low	39.3	Very low	107 Å²	107	113.9 Å²	113.9	75%	0.748	66%	0.661	S	S	*	*			trans	-149.4	155.8	167.6	54.5	0	0	0	0	113	D338	S336-D338 VanDerWaalsContact C-N 3.29Å; S336-D338 PolarHBondContact O-N 3.26Å
337	D	37.3	Very low	40.9	Very low	112 Å²	112	107.6 Å²	107.6	60%	0.599	63%	0.631	S	S	*	*	S	Bend	trans	-57.3	4.2	-152	-58.5	-76.1	0	0	0	120.8	S339 E340 K391	D337-S339 PolarHBondContact O-N 3.5Å; D337-E340 PolarHBondContact O-N 3.07Å; D337-K391 IonicContact OD1-NZ 2.73Å
338	D	35.1	Very low	42	Very low	143 Å²	143	107.3 Å²	107.3	77%	0.765	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-4.5	-171.8	-150.7	35.1	0	0	0	114.7	S336	S336-D338 VanDerWaalsContact C-N 3.29Å; S336-D338 PolarHBondContact O-N 3.26Å
339	S	44	Very low	43.4	Very low	75 Å²	75	108.3 Å²	108.3	52%	0.524	61%	0.608	S	S	.	*	H	α-helix	trans	-79.2	-24.1	179.6	-172.1	0	0	0	0	114.3	D337 Q343	D337-S339 PolarHBondContact O-N 3.5Å; S339-Q343 WeakPolarHBondContact O-CG 3.41Å; S339-Q343 PolarHBondContact O-NE2 3.26Å; S339-Q343 PolarHBondContact OG-NE2 2.98Å
340	E	48.3	Very low	45.5	Very low	110 Å²	110	105.5 Å²	105.5	51%	0.514	59%	0.589	S	S	.	*	H	α-helix	trans	-78.5	-39.8	-171.7	-60.4	-159.5	153.6	0	0	112.6	D337 Q343 I344	D337-E340 PolarHBondContact O-N 3.07Å; E340-Q343 PolarHBondContact O-N 3.09Å; E340-I344 PolarHBondContact O-N 2.81Å
341	V	47.5	Very low	47.4	Very low	88 Å²	88	100.4 Å²	100.4	53%	0.533	56%	0.557	S	S	.	*	H	α-helix	trans	-64.5	-44	178	-177.6	0	0	0	0	111.2	Q343 I344	V341-Q343 PolarHBondContact O-N 2.79Å; V341-I344 PolarHBondContact O-N 2.88Å; V341-I344 VanDerWaalsContact O-N 3.16Å
342	Q	43.3	Very low	48.8	Very low	95 Å²	95	96.4 Å²	96.4	44%	0.444	54%	0.538	S	S	.	.	H	α-helix	trans	-65.1	-26.9	-179.4	-175.8	57.9	101.5	0	0	112.5
343	Q	52.4	Low	50.8	Low	73 Å²	73	92.3 Å²	92.3	34%	0.341	52%	0.518	S	S	.	.	H	α-helix	trans	-70.1	-43.6	173.3	-74.6	175.6	50.7	0	0	111.8	S339 E340 V341 L345 T346 Y347	S339-Q343 WeakPolarHBondContact O-CG 3.41Å; S339-Q343 PolarHBondContact O-NE2 3.26Å; S339-Q343 PolarHBondContact OG-NE2 2.98Å; E340-Q343 PolarHBondContact O-N 3.09Å; V341-Q343 PolarHBondContact O-N 2.79Å; Q343-L345 VanDerWaalsContact C-N 3.31Å; Q343-L345 PolarHBondContact O-N 3.17Å; Q343-T346 WeakPolarHBondContact O-CB 3.43Å; Q343-T346 PolarHBondContact O-N 3.23Å; Q343-T346 PolarHBondContact O-OG1 2.9Å; Q343-Y347 HydrophobicContact CB-CE2 4.45Å; Q343-Y347 VanDerWaalsContact O-CD2 3.29Å; Q343-Y347 WeakPolarHBondContact O-CD2 3.49Å; Q343-Y347 PolarHBondContact O-N 3.48Å
344	I	55.7	Low	52.3	Low	70 Å²	70	85.1 Å²	85.1	36%	0.359	48%	0.484	S	S	.	.	H	α-helix	trans	-53.9	-44.2	-175.5	-70.3	168.6	0	0	0	112.3	E340 V341 T346 Y347 E348 F381	E340-I344 PolarHBondContact O-N 2.81Å; V341-I344 PolarHBondContact O-N 2.88Å; V341-I344 VanDerWaalsContact O-N 3.16Å; I344-T346 VanDerWaalsContact C-N 3.25Å; I344-T346 PolarHBondContact O-N 3.45Å; I344-Y347 WeakPolarHBondContact O-CB 3.44Å; I344-Y347 PolarHBondContact O-N 3.2Å; I344-E348 PolarHBondContact O-N 2.73Å; I344-F381 HydrophobicContact CG2-CE2 4.27Å
345	L	52.4	Low	54	Low	92 Å²	92	78.3 Å²	78.3	48%	0.482	45%	0.447	S	S	.	.	H	α-helix	trans	-60	-32.8	177.6	-66.2	170.9	0	0	0	112.9	Q343 Y347 E348 D349	Q343-L345 VanDerWaalsContact C-N 3.31Å; Q343-L345 PolarHBondContact O-N 3.17Å; L345-Y347 VanDerWaalsContact C-N 3.31Å; L345-Y347 PolarHBondContact O-N 3.34Å; L345-E348 WeakPolarHBondContact O-CB 3.3Å; L345-E348 PolarHBondContact O-N 2.78Å; L345-D349 PolarHBondContact O-N 3.35Å
346	T	57.2	Low	55.2	Low	81 Å²	81	75.6 Å²	75.6	50%	0.497	43%	0.427	S	S	.	.	H	α-helix	trans	-73	-22.5	176.4	70.4	0	0	0	0	113.3	Q343 I344 S350	Q343-T346 WeakPolarHBondContact O-CB 3.43Å; Q343-T346 PolarHBondContact O-N 3.23Å; Q343-T346 PolarHBondContact O-OG1 2.9Å; I344-T346 VanDerWaalsContact C-N 3.25Å; I344-T346 PolarHBondContact O-N 3.45Å; T346-S350 WeakPolarHBondContact O-CB 3.36Å; T346-S350 PolarHBondContact O-N 2.75Å
347	Y	62.2	Low	56.7	Low	36 Å²	36	75.4 Å²	75.4	14%	0.141	41%	0.412	C	S	.	.	H	α-helix	trans	-71.8	-34.1	168.6	-70.8	-98	0	0	0	111.1	Q343 I344 L345 S350 V351 T377 D380 F381 R384	Q343-Y347 HydrophobicContact CB-CE2 4.45Å; Q343-Y347 VanDerWaalsContact O-CD2 3.29Å; Q343-Y347 WeakPolarHBondContact O-CD2 3.49Å; Q343-Y347 PolarHBondContact O-N 3.48Å; I344-Y347 WeakPolarHBondContact O-CB 3.44Å; I344-Y347 PolarHBondContact O-N 3.2Å; L345-Y347 VanDerWaalsContact C-N 3.31Å; L345-Y347 PolarHBondContact O-N 3.34Å; Y347-S350 PolarHBondContact O-N 2.8Å; Y347-V351 VanDerWaalsContact O-CB 3.28Å; Y347-V351 WeakPolarHBondContact O-CB 3.47Å; Y347-V351 WeakPolarHBondContact O-CG2 3.41Å; Y347-V351 PolarHBondContact O-N 2.83Å; Y347-T377 HydrophobicContact CD1-CG2 3.69Å; Y347-T377 HydrophobicContact CE1-CG2 4.35Å; Y347-D380 HydrophobicContact CE1-CB 4.37Å; Y347-D380 PolarHBondContact OH-OD2 3.18Å; Y347-F381 HydrophobicContact CD1-CB 4.14Å; Y347-F381 HydrophobicContact CG-CD2 4.48Å; Y347-R384 PolarHBondContact OH-NE 3.25Å; Y347-R384 PolarHBondContact OH-NH2 3.17Å; Y347-R384 VanDerWaalsContact OH-NH2 3.14Å
348	E	55.6	Low	58.1	Low	107 Å²	107	70.9 Å²	70.9	50%	0.5	39%	0.388	S	S	.	.	H	α-helix	trans	-63.2	-53.9	177.1	-173.2	177.8	-167.8	0	0	111.7	I344 L345 S350 V351 A352	I344-E348 PolarHBondContact O-N 2.73Å; L345-E348 WeakPolarHBondContact O-CB 3.3Å; L345-E348 PolarHBondContact O-N 2.78Å; E348-S350 VanDerWaalsContact C-N 3.27Å; E348-S350 PolarHBondContact O-N 3.21Å; E348-V351 PolarHBondContact O-N 1.99Å; E348-A352 WeakPolarHBondContact O-CB 3.45Å; E348-A352 PolarHBondContact O-N 3.01Å
349	D	61.3	Low	59.1	Low	125 Å²	125	67.2 Å²	67.2	67%	0.668	37%	0.368	S	S	*	.	H	α-helix	trans	-55.3	-43.2	177.4	-85.4	-33	0	0	0	111.8	L345 A352 A353	L345-D349 PolarHBondContact O-N 3.35Å; D349-A352 PolarHBondContact O-N 2.81Å; D349-A353 VanDerWaalsContact O-CB 3.27Å; D349-A353 WeakPolarHBondContact O-CB 3.28Å; D349-A353 PolarHBondContact O-N 3.22Å
350	S	70.4	Confident	59.6	Low	37 Å²	37	68.3 Å²	68.3	26%	0.259	37%	0.372	S	S	.	.	H	α-helix	trans	-63.2	-49.2	177.2	-175.5	0	0	0	0	112	T346 Y347 E348 A352 A353 H354	T346-S350 WeakPolarHBondContact O-CB 3.36Å; T346-S350 PolarHBondContact O-N 2.75Å; Y347-S350 PolarHBondContact O-N 2.8Å; E348-S350 VanDerWaalsContact C-N 3.27Å; E348-S350 PolarHBondContact O-N 3.21Å; S350-A352 PolarHBondContact O-N 2.92Å; S350-A353 PolarHBondContact O-N 2.99Å; S350-H354 WeakPolarHBondContact O-CB 2.51Å; S350-H354 PolarHBondContact O-CD2 3.08Å; S350-H354 VanDerWaalsContact O-CD2 3.25Å; S350-H354 PolarHBondContact O-N 2.84Å
351	V	68.6	Low	60.7	Low	18 Å²	18	64.4 Å²	64.4	11%	0.109	36%	0.356	C	S	.	.	H	α-helix	trans	-60.6	-43.8	177.3	164.2	0	0	0	0	111	Y347 E348 L355 L374 T377 V378 I496	Y347-V351 VanDerWaalsContact O-CB 3.28Å; Y347-V351 WeakPolarHBondContact O-CB 3.47Å; Y347-V351 WeakPolarHBondContact O-CG2 3.41Å; Y347-V351 PolarHBondContact O-N 2.83Å; E348-V351 PolarHBondContact O-N 1.99Å; V351-L355 HydrophobicContact CG1-CD1 3.73Å; V351-L355 HydrophobicContact CG1-CG 4.4Å; V351-L355 VanDerWaalsContact O-CB 3.27Å; V351-L355 WeakPolarHBondContact O-CB 3.45Å; V351-L355 VanDerWaalsContact O-CG 3.29Å; V351-L355 WeakPolarHBondContact O-CG 3.35Å; V351-L355 PolarHBondContact O-N 2.98Å; V351-L374 HydrophobicContact CB-CD1 4.11Å; V351-L374 HydrophobicContact CG1-CD1 3.99Å; V351-L374 HydrophobicContact CG2-CD1 3.83Å; V351-T377 HydrophobicContact CG2-CG2 4Å; V351-V378 HydrophobicContact CG2-CG2 4.31Å; V351-I496 HydrophobicContact CG1-CD1 4.18Å
352	A	63.5	Low	60.8	Low	49 Å²	49	65.9 Å²	65.9	41%	0.405	36%	0.362	S	S	.	.	H	α-helix	trans	-64.4	-44.2	177.9	0	0	0	0	0	112.1	E348 D349 S350 T356	E348-A352 WeakPolarHBondContact O-CB 3.45Å; E348-A352 PolarHBondContact O-N 3.01Å; D349-A352 PolarHBondContact O-N 2.81Å; S350-A352 PolarHBondContact O-N 2.92Å; A352-T356 WeakPolarHBondContact O-CB 3.45Å; A352-T356 PolarHBondContact O-N 2.79Å; A352-T356 PolarHBondContact O-OG1 3.2Å
353	A	69.8	Low	61.7	Low	44 Å²	44	67.3 Å²	67.3	36%	0.364	37%	0.368	S	S	.	.	H	α-helix	trans	-64.5	-43.4	177.4	0	0	0	0	0	112.3	D349 S350 T356 K357	D349-A353 VanDerWaalsContact O-CB 3.27Å; D349-A353 WeakPolarHBondContact O-CB 3.28Å; D349-A353 PolarHBondContact O-N 3.22Å; S350-A353 PolarHBondContact O-N 2.99Å; A353-T356 PolarHBondContact O-N 3.04Å; A353-K357 WeakPolarHBondContact O-CG 3.49Å; A353-K357 PolarHBondContact O-N 3.13Å
354	H	70	Confident	62	Low	33 Å²	33	67.7 Å²	67.7	15%	0.153	37%	0.37	C	S	.	.	H	α-helix	trans	-72	-39.7	178.5	-79	-73.2	0	0	0	112.8	S350 T356 K357 I358 L374	S350-H354 WeakPolarHBondContact O-CB 2.51Å; S350-H354 PolarHBondContact O-CD2 3.08Å; S350-H354 VanDerWaalsContact O-CD2 3.25Å; S350-H354 PolarHBondContact O-N 2.84Å; H354-T356 VanDerWaalsContact C-N 3.3Å; H354-T356 PolarHBondContact O-N 3.09Å; H354-K357 PolarHBondContact O-N 3.21Å; H354-I358 WeakPolarHBondContact O-CD1 3.49Å; H354-I358 VanDerWaalsContact O-CG1 3.25Å; H354-I358 WeakPolarHBondContact O-CG1 3.35Å; H354-I358 PolarHBondContact O-N 2.95Å; H354-L374 HydrophobicContact CB-CB 4.17Å; H354-L374 HydrophobicContact CB-CD1 4.47Å
355	L	62.4	Low	62.4	Low	14 Å²	14	68.3 Å²	68.3	7%	0.073	38%	0.38	C	S	.	.	H	α-helix	trans	-60.2	-39.5	171	-78.5	170.6	0	0	0	112	V351 I358 L359 L374 K493	V351-L355 HydrophobicContact CG1-CD1 3.73Å; V351-L355 HydrophobicContact CG1-CG 4.4Å; V351-L355 VanDerWaalsContact O-CB 3.27Å; V351-L355 WeakPolarHBondContact O-CB 3.45Å; V351-L355 VanDerWaalsContact O-CG 3.29Å; V351-L355 WeakPolarHBondContact O-CG 3.35Å; V351-L355 PolarHBondContact O-N 2.98Å; L355-I358 PolarHBondContact O-N 3.11Å; L355-L359 WeakPolarHBondContact O-CG 3.46Å; L355-L359 PolarHBondContact O-N 3.07Å; L355-L374 HydrophobicContact CD2-CD2 3.65Å; L355-L374 HydrophobicContact CG-CD1 4.48Å; L355-L374 HydrophobicContact CG-CD2 3.92Å; L355-K493 HydrophobicContact CD1-CB 4.42Å; L355-K493 HydrophobicContact CD1-CG 4.34Å
356	T	64.5	Low	63.2	Low	79 Å²	79	66.1 Å²	66.1	49%	0.485	37%	0.37	S	S	.	.	H	α-helix	trans	-64	-47.9	176.9	-57.9	0	0	0	0	110.8	A352 A353 H354 I358 L359 T360	A352-T356 WeakPolarHBondContact O-CB 3.45Å; A352-T356 PolarHBondContact O-N 2.79Å; A352-T356 PolarHBondContact O-OG1 3.2Å; A353-T356 PolarHBondContact O-N 3.04Å; H354-T356 VanDerWaalsContact C-N 3.3Å; H354-T356 PolarHBondContact O-N 3.09Å; T356-I358 VanDerWaalsContact C-N 3.28Å; T356-I358 PolarHBondContact O-N 2.9Å; T356-L359 PolarHBondContact O-N 2.9Å; T356-T360 HydrophobicContact CG2-CG2 4.22Å; T356-T360 PolarHBondContact O-N 2.84Å; T356-T360 PolarHBondContact O-OG1 3.17Å
357	K	69.7	Low	63.8	Low	102 Å²	102	62.9 Å²	62.9	44%	0.443	35%	0.351	S	S	.	.	H	α-helix	trans	-58.2	-36.3	175.8	-72.1	169.1	-177.8	172.3	0	113.2	A353 H354 L359 S361	A353-K357 WeakPolarHBondContact O-CG 3.49Å; A353-K357 PolarHBondContact O-N 3.13Å; H354-K357 PolarHBondContact O-N 3.21Å; K357-L359 VanDerWaalsContact C-N 3.33Å; K357-S361 WeakPolarHBondContact O-CB 3.41Å; K357-S361 PolarHBondContact O-N 2.91Å; K357-S361 VanDerWaalsContact O-N 3.12Å
358	I	67.2	Low	63.9	Low	18 Å²	18	63.3 Å²	63.3	9%	0.092	36%	0.355	C	S	.	.	H	α-helix	trans	-67.2	-32.1	176	-71.5	162.4	0	0	0	112.2	H354 L355 T356 V367 A371 L374	H354-I358 WeakPolarHBondContact O-CD1 3.49Å; H354-I358 VanDerWaalsContact O-CG1 3.25Å; H354-I358 WeakPolarHBondContact O-CG1 3.35Å; H354-I358 PolarHBondContact O-N 2.95Å; L355-I358 PolarHBondContact O-N 3.11Å; T356-I358 VanDerWaalsContact C-N 3.28Å; T356-I358 PolarHBondContact O-N 2.9Å; I358-V367 HydrophobicContact CG2-CG1 4.3Å; I358-A371 HydrophobicContact CD1-CB 3.96Å; I358-A371 HydrophobicContact CG1-CB 4.42Å; I358-L374 HydrophobicContact CD1-CD2 3.69Å
359	L	55.8	Low	64.6	Low	65 Å²	65	61.1 Å²	61.1	34%	0.34	35%	0.352	S	S	.	.	H	α-helix	trans	-87.7	-34.8	-177.5	-68.5	169.2	0	0	0	113.1	L355 T356 K357 M486	L355-L359 WeakPolarHBondContact O-CG 3.46Å; L355-L359 PolarHBondContact O-N 3.07Å; T356-L359 PolarHBondContact O-N 2.9Å; K357-L359 VanDerWaalsContact C-N 3.33Å; L359-M486 HydrophobicContact CD2-CG 4.29Å
360	T	54.9	Low	65.2	Low	99 Å²	99	55.5 Å²	55.5	61%	0.607	32%	0.322	S	S	*	.	H	α-helix	trans	-99.7	-13.6	-173.8	63.3	0	0	0	0	115.1	T356	T356-T360 HydrophobicContact CG2-CG2 4.22Å; T356-T360 PolarHBondContact O-N 2.84Å; T356-T360 PolarHBondContact O-OG1 3.17Å
361	S	70.3	Confident	65.1	Low	27 Å²	27	53.9 Å²	53.9	19%	0.189	31%	0.311	C	S	.	.			trans	-89.8	125.9	176.9	-167.2	0	0	0	0	111.9	K357 Q363 V367	K357-S361 WeakPolarHBondContact O-CB 3.41Å; K357-S361 PolarHBondContact O-N 2.91Å; K357-S361 VanDerWaalsContact O-N 3.12Å; S361-Q363 VanDerWaalsContact C-N 3.3Å; S361-Q363 PolarHBondContact OG-N 2.8Å; S361-V367 VanDerWaalsContact O-CG2 3.28Å; S361-V367 WeakPolarHBondContact O-CG2 3.29Å
362	D	50.8	Low	65.2	Low	120 Å²	120	58.5 Å²	58.5	64%	0.642	33%	0.329	S	S	*	.			trans	-86.6	1.3	171.3	-59.7	-54.6	0	0	0	113	R482	D362-R482 IonicContact OD1-CZ 2.76Å; D362-R482 IonicContact OD1-NH1 2.72Å; D362-R482 PolarHBondContact OD1-NH1 2.93Å; D362-R482 IonicContact OD1-NH2 2.67Å; D362-R482 PolarHBondContact OD1-NH2 2.94Å
363	Q	61.5	Low	65.8	Low	124 Å²	124	59.4 Å²	59.4	58%	0.579	33%	0.33	S	S	*	.			trans	-90.3	109.5	175.7	-68.8	-172.3	-0.5	0	0	111.5	S361 S365 V366 V367	S361-Q363 VanDerWaalsContact C-N 3.3Å; S361-Q363 PolarHBondContact OG-N 2.8Å; Q363-S365 PolarHBondContact O-N 3.26Å; Q363-S365 VanDerWaalsContact O-N 3.13Å; Q363-V366 HydrophobicContact CB-CB 4.14Å; Q363-V366 HydrophobicContact CB-CG2 3.87Å; Q363-V366 PolarHBondContact O-N 3.24Å; Q363-V367 PolarHBondContact O-N 2.97Å
364	H	57.7	Low	66	Low	82 Å²	82	57.3 Å²	57.3	38%	0.38	31%	0.312	S	S	.	.	H	α-helix	trans	-53	-35.9	-179.7	-87.4	-104.1	0	0	0	114.2	V367 I368 F479	H364-V367 PolarHBondContact O-N 2.91Å; H364-I368 WeakPolarHBondContact O-CB 3.27Å; H364-I368 VanDerWaalsContact O-CG1 3.23Å; H364-I368 WeakPolarHBondContact O-CG1 3.35Å; H364-I368 PolarHBondContact O-N 2.86Å; H364-F479 AromaticContact NE2-CZ 3.46Å; H364-F479 WeakPolarHBondContact NE2-CZ 3.28Å
365	S	64.1	Low	65.8	Low	82 Å²	82	55.8 Å²	55.8	57%	0.573	31%	0.305	S	S	*	.	H	α-helix	trans	-64	-38.7	176.2	50	0	0	0	0	112.9	Q363 S369	Q363-S365 PolarHBondContact O-N 3.26Å; Q363-S365 VanDerWaalsContact O-N 3.13Å; S365-S369 WeakPolarHBondContact O-CB 3.48Å; S365-S369 PolarHBondContact O-N 3.07Å; S365-S369 PolarHBondContact O-OG 3.11Å
366	V	70.6	Confident	66.3	Low	46 Å²	46	60.2 Å²	60.2	28%	0.279	33%	0.326	S	S	.	.	H	α-helix	trans	-73.9	-38.2	177.3	-179.6	0	0	0	0	110.8	Q363 S369 S370	Q363-V366 HydrophobicContact CB-CB 4.14Å; Q363-V366 HydrophobicContact CB-CG2 3.87Å; Q363-V366 PolarHBondContact O-N 3.24Å; V366-S369 WeakPolarHBondContact CA-OG 3.42Å; V366-S369 PolarHBondContact O-OG 3.25Å; V366-S370 WeakPolarHBondContact O-CB 3.48Å; V366-S370 PolarHBondContact O-N 3.38Å; V366-S370 PolarHBondContact O-OG 3.37Å
367	V	68.6	Low	66.8	Low	13 Å²	13	57.5 Å²	57.5	8%	0.079	31%	0.309	C	S	.	.	H	α-helix	trans	-63.7	-50.2	174.1	174.6	0	0	0	0	110.8	I358 S361 Q363 H364 S370 A371 L420	I358-V367 HydrophobicContact CG2-CG1 4.3Å; S361-V367 VanDerWaalsContact O-CG2 3.28Å; S361-V367 WeakPolarHBondContact O-CG2 3.29Å; Q363-V367 PolarHBondContact O-N 2.97Å; H364-V367 PolarHBondContact O-N 2.91Å; V367-S370 PolarHBondContact O-N 3.15Å; V367-A371 VanDerWaalsContact O-CB 3.26Å; V367-A371 WeakPolarHBondContact O-CB 3.49Å; V367-A371 PolarHBondContact O-N 3.39Å; V367-L420 HydrophobicContact CG1-CD2 4.49Å
368	I	64.9	Low	66.9	Low	45 Å²	45	52.9 Å²	52.9	23%	0.231	29%	0.289	C	S	.	.	H	α-helix	trans	-66.6	-40.3	-178.9	-68.5	166.2	0	0	0	111.8	H364 K372 L420	H364-I368 WeakPolarHBondContact O-CB 3.27Å; H364-I368 VanDerWaalsContact O-CG1 3.23Å; H364-I368 WeakPolarHBondContact O-CG1 3.35Å; H364-I368 PolarHBondContact O-N 2.86Å; I368-K372 HydrophobicContact CG2-CD 4.24Å; I368-K372 WeakPolarHBondContact O-CB 3.42Å; I368-K372 WeakPolarHBondContact O-CG 3.31Å; I368-K372 PolarHBondContact O-N 2.9Å; I368-L420 HydrophobicContact CG1-CD2 4.36Å
369	S	70.6	Confident	67.1	Low	62 Å²	62	56.3 Å²	56.3	43%	0.434	30%	0.304	S	S	.	.	H	α-helix	trans	-67.9	-44.3	175.5	53.4	0	0	0	0	111.9	S365 V366 A371 K372 V373	S365-S369 WeakPolarHBondContact O-CB 3.48Å; S365-S369 PolarHBondContact O-N 3.07Å; S365-S369 PolarHBondContact O-OG 3.11Å; V366-S369 WeakPolarHBondContact CA-OG 3.42Å; V366-S369 PolarHBondContact O-OG 3.25Å; S369-A371 VanDerWaalsContact C-N 3.32Å; S369-A371 PolarHBondContact O-N 2.99Å; S369-K372 PolarHBondContact O-N 3.31Å; S369-V373 WeakPolarHBondContact O-CG2 3.41Å; S369-V373 PolarHBondContact O-N 3.18Å
370	S	74.5	Confident	67.9	Low	7 Å²	7	56 Å²	56	5%	0.049	30%	0.303	C	S	.	.	H	α-helix	trans	-61.9	-38.5	175.3	-61.4	0	0	0	0	112.4	V366 V367 L374	V366-S370 WeakPolarHBondContact O-CB 3.48Å; V366-S370 PolarHBondContact O-N 3.38Å; V366-S370 PolarHBondContact O-OG 3.37Å; V367-S370 PolarHBondContact O-N 3.15Å; S370-L374 VanDerWaalsContact O-CB 3.23Å; S370-L374 WeakPolarHBondContact O-CB 3.32Å; S370-L374 PolarHBondContact O-N 2.95Å
371	A	67.8	Low	68.7	Low	2 Å²	2	52.4 Å²	52.4	2%	0.017	28%	0.278	C	S	.	.	H	α-helix	trans	-67.7	-40.8	175.4	0	0	0	0	0	112.4	I358 V367 S369 L374 C375 L420	I358-A371 HydrophobicContact CD1-CB 3.96Å; I358-A371 HydrophobicContact CG1-CB 4.42Å; V367-A371 VanDerWaalsContact O-CB 3.26Å; V367-A371 WeakPolarHBondContact O-CB 3.49Å; V367-A371 PolarHBondContact O-N 3.39Å; S369-A371 VanDerWaalsContact C-N 3.32Å; S369-A371 PolarHBondContact O-N 2.99Å; A371-L374 PolarHBondContact O-N 3.04Å; A371-C375 PolarHBondContact O-N 3.45Å; A371-C375 PolarHBondContact O-SG 3.38Å; A371-L420 HydrophobicContact CB-CD1 3.46Å; A371-L420 VanDerWaalsContact CB-CD1 3.46Å
372	K	69.3	Low	68.8	Low	115 Å²	115	52.6 Å²	52.6	50%	0.5	28%	0.278	S	S	.	.	H	α-helix	trans	-62.8	-46.2	174.9	-76.5	175.5	178.8	-178.2	0	111.9	I368 S369 C375 E376	I368-K372 HydrophobicContact CG2-CD 4.24Å; I368-K372 WeakPolarHBondContact O-CB 3.42Å; I368-K372 WeakPolarHBondContact O-CG 3.31Å; I368-K372 PolarHBondContact O-N 2.9Å; S369-K372 PolarHBondContact O-N 3.31Å; K372-C375 PolarHBondContact O-N 3.21Å; K372-E376 PolarHBondContact O-N 3.09Å; K372-E376 VanDerWaalsContact O-N 3.15Å
373	V	76.5	Confident	69.7	Low	68 Å²	68	49.5 Å²	49.5	41%	0.412	27%	0.269	S	S	.	.	H	α-helix	trans	-59.4	-50.4	175.2	174.7	0	0	0	0	110.4	S369 C375 E376 T377	S369-V373 WeakPolarHBondContact O-CG2 3.41Å; S369-V373 PolarHBondContact O-N 3.18Å; V373-C375 PolarHBondContact O-N 2.95Å; V373-E376 PolarHBondContact O-N 2.9Å; V373-E376 VanDerWaalsContact O-N 3.09Å; V373-T377 PolarHBondContact O-N 3.01Å; V373-T377 PolarHBondContact O-OG1 2.98Å
374	L	73.8	Confident	69.9	Low	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-53.9	-37.6	175.6	177.5	64.9	0	0	0	112.6	V351 H354 L355 I358 S370 A371 V378	V351-L374 HydrophobicContact CB-CD1 4.11Å; V351-L374 HydrophobicContact CG1-CD1 3.99Å; V351-L374 HydrophobicContact CG2-CD1 3.83Å; H354-L374 HydrophobicContact CB-CB 4.17Å; H354-L374 HydrophobicContact CB-CD1 4.47Å; L355-L374 HydrophobicContact CD2-CD2 3.65Å; L355-L374 HydrophobicContact CG-CD1 4.48Å; L355-L374 HydrophobicContact CG-CD2 3.92Å; I358-L374 HydrophobicContact CD1-CD2 3.69Å; S370-L374 VanDerWaalsContact O-CB 3.23Å; S370-L374 WeakPolarHBondContact O-CB 3.32Å; S370-L374 PolarHBondContact O-N 2.95Å; A371-L374 PolarHBondContact O-N 3.04Å; L374-V378 HydrophobicContact CD1-CG2 4.1Å; L374-V378 HydrophobicContact CG-CG2 4.49Å; L374-V378 WeakPolarHBondContact O-CB 3.49Å; L374-V378 VanDerWaalsContact O-CG2 3.25Å; L374-V378 WeakPolarHBondContact O-CG2 3.46Å; L374-V378 PolarHBondContact O-N 3.42Å
375	C	67.2	Low	70.5	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.007	25%	0.246	C	C	.	.	H	α-helix	trans	-69	-40	178	-67.4	0	0	0	0	113	A371 K372 V373 K379 L413 L417	A371-C375 PolarHBondContact O-N 3.45Å; A371-C375 PolarHBondContact O-SG 3.38Å; K372-C375 PolarHBondContact O-N 3.21Å; V373-C375 PolarHBondContact O-N 2.95Å; C375-K379 WeakPolarHBondContact O-CB 3.32Å; C375-K379 WeakPolarHBondContact O-CD 3.48Å; C375-K379 WeakPolarHBondContact O-CG 3.25Å; C375-K379 PolarHBondContact O-N 3.12Å; C375-L413 HydrophobicContact CB-CD1 4.27Å; C375-L413 HydrophobicContact CB-CD2 4.19Å; C375-L413 HydrophobicContact CB-CG 4.29Å; C375-L413 VanDerWaalsContact SG-CD1 3.53Å; C375-L417 HydrophobicContact CB-CD1 4.09Å; C375-L417 HydrophobicContact CB-CD2 4.28Å; C375-L417 HydrophobicContact CB-CG 4.42Å; C375-L417 VanDerWaalsContact SG-CD2 3.56Å; C375-L417 VanDerWaalsContact SG-CG 3.54Å
376	E	71.9	Confident	70.5	Confident	107 Å²	107	42.8 Å²	42.8	50%	0.5	23%	0.233	S	C	.	.	H	α-helix	trans	-69.6	-39.4	173.9	-56.7	-43.8	124.7	0	0	111.6	K372 V373 V378 K379 D380	K372-E376 PolarHBondContact O-N 3.09Å; K372-E376 VanDerWaalsContact O-N 3.15Å; V373-E376 PolarHBondContact O-N 2.9Å; V373-E376 VanDerWaalsContact O-N 3.09Å; E376-V378 PolarHBondContact O-N 2.63Å; E376-K379 VanDerWaalsContact CD-NZ 3.35Å; E376-K379 PolarHBondContact O-N 3.45Å; E376-K379 IonicContact OE1-NZ 2.72Å; E376-K379 PolarHBondContact OE1-NZ 3.35Å; E376-K379 WeakPolarHBondContact OE2-CD 3.14Å; E376-K379 IonicContact OE2-NZ 2.8Å; E376-K379 PolarHBondContact OE2-NZ 3.48Å; E376-D380 PolarHBondContact O-N 2.9Å
377	T	75.9	Confident	70.2	Confident	22 Å²	22	47.8 Å²	47.8	14%	0.135	25%	0.251	C	S	.	.	H	α-helix	trans	-57.4	-44.8	172.8	-56.1	0	0	0	0	112	Y347 V351 V373 F381	Y347-T377 HydrophobicContact CD1-CG2 3.69Å; Y347-T377 HydrophobicContact CE1-CG2 4.35Å; V351-T377 HydrophobicContact CG2-CG2 4Å; V373-T377 PolarHBondContact O-N 3.01Å; V373-T377 PolarHBondContact O-OG1 2.98Å; T377-F381 WeakPolarHBondContact O-CB 3.47Å; T377-F381 PolarHBondContact O-N 2.97Å
378	V	72.2	Confident	69.8	Low	5 Å²	5	49 Å²	49	3%	0.03	26%	0.262	C	S	.	.	H	α-helix	trans	-72.4	-34.1	178.3	172.5	0	0	0	0	112.2	V351 L374 E376 V382 L409 L413 I496	V351-V378 HydrophobicContact CG2-CG2 4.31Å; L374-V378 HydrophobicContact CD1-CG2 4.1Å; L374-V378 HydrophobicContact CG-CG2 4.49Å; L374-V378 WeakPolarHBondContact O-CB 3.49Å; L374-V378 VanDerWaalsContact O-CG2 3.25Å; L374-V378 WeakPolarHBondContact O-CG2 3.46Å; L374-V378 PolarHBondContact O-N 3.42Å; E376-V378 PolarHBondContact O-N 2.63Å; V378-V382 WeakPolarHBondContact O-CG2 3.46Å; V378-V382 PolarHBondContact O-N 3.31Å; V378-L409 HydrophobicContact CG1-CD1 4.24Å; V378-L409 HydrophobicContact CG1-CD2 4Å; V378-L409 HydrophobicContact CG1-CG 4.15Å; V378-L413 HydrophobicContact CB-CD1 4.33Å; V378-L413 HydrophobicContact CB-CD2 4.16Å; V378-L413 HydrophobicContact CG1-CD1 4.29Å; V378-L413 HydrophobicContact CG1-CD2 3.96Å; V378-I496 HydrophobicContact CG2-CD1 3.93Å
379	K	71.3	Confident	69.6	Low	91 Å²	91	48.8 Å²	48.8	40%	0.396	26%	0.259	S	S	.	.	H	α-helix	trans	-64.7	-46.3	173.5	-75.5	164.6	-177.8	175	0	112.2	C375 E376 V382 A383 L413	C375-K379 WeakPolarHBondContact O-CB 3.32Å; C375-K379 WeakPolarHBondContact O-CD 3.48Å; C375-K379 WeakPolarHBondContact O-CG 3.25Å; C375-K379 PolarHBondContact O-N 3.12Å; E376-K379 VanDerWaalsContact CD-NZ 3.35Å; E376-K379 PolarHBondContact O-N 3.45Å; E376-K379 IonicContact OE1-NZ 2.72Å; E376-K379 PolarHBondContact OE1-NZ 3.35Å; E376-K379 WeakPolarHBondContact OE2-CD 3.14Å; E376-K379 IonicContact OE2-NZ 2.8Å; E376-K379 PolarHBondContact OE2-NZ 3.48Å; K379-V382 PolarHBondContact O-N 2.9Å; K379-A383 WeakPolarHBondContact O-CB 3.47Å; K379-A383 PolarHBondContact O-N 3.09Å; K379-L413 HydrophobicContact CG-CD2 4.28Å
380	D	72.4	Confident	68.9	Low	59 Å²	59	52.9 Å²	52.9	32%	0.316	27%	0.271	S	S	.	.	H	α-helix	trans	-65.2	-41.3	178.8	-174.1	38	0	0	0	111	Y347 E376 A383 R384	Y347-D380 HydrophobicContact CE1-CB 4.37Å; Y347-D380 PolarHBondContact OH-OD2 3.18Å; E376-D380 PolarHBondContact O-N 2.9Å; D380-A383 PolarHBondContact O-N 2.97Å; D380-R384 VanDerWaalsContact CG-NE 3.27Å; D380-R384 VanDerWaalsContact O-CG 3.32Å; D380-R384 WeakPolarHBondContact O-CG 3.44Å; D380-R384 PolarHBondContact O-N 3Å; D380-R384 IonicContact OD1-CZ 2.69Å; D380-R384 IonicContact OD1-NE 3.35Å; D380-R384 PolarHBondContact OD1-NE 3.2Å; D380-R384 IonicContact OD1-NH2 2.87Å; D380-R384 PolarHBondContact OD1-NH2 3.1Å; D380-R384 IonicContact OD2-CZ 2.66Å; D380-R384 IonicContact OD2-NE 3.51Å; D380-R384 PolarHBondContact OD2-NE 2.7Å; D380-R384 VanDerWaalsContact OD2-NE 3.08Å; D380-R384 IonicContact OD2-NH2 2.77Å; D380-R384 PolarHBondContact OD2-NH2 2.95Å
381	F	71.3	Confident	67.9	Low	22 Å²	22	58.9 Å²	58.9	10%	0.096	30%	0.297	C	S	.	.	H	α-helix	trans	-56.1	-51.6	170.9	176.9	-103.5	0	0	0	112.3	I344 Y347 T377 A383 R384 V385 I499 I500	I344-F381 HydrophobicContact CG2-CE2 4.27Å; Y347-F381 HydrophobicContact CD1-CB 4.14Å; Y347-F381 HydrophobicContact CG-CD2 4.48Å; T377-F381 WeakPolarHBondContact O-CB 3.47Å; T377-F381 PolarHBondContact O-N 2.97Å; F381-A383 VanDerWaalsContact C-N 3.32Å; F381-A383 PolarHBondContact O-N 3.36Å; F381-R384 PolarHBondContact O-N 2.91Å; F381-V385 HydrophobicContact CD1-CG2 4.43Å; F381-V385 HydrophobicContact CD2-CG2 4.23Å; F381-V385 HydrophobicContact CE1-CG2 4.05Å; F381-V385 HydrophobicContact CE2-CG2 3.82Å; F381-V385 HydrophobicContact CZ-CG2 3.73Å; F381-V385 WeakPolarHBondContact O-CG2 3.2Å; F381-V385 PolarHBondContact O-N 3.39Å; F381-I499 HydrophobicContact CE1-CG2 4.11Å; F381-I499 HydrophobicContact CZ-CG2 4.46Å; F381-I500 HydrophobicContact CZ-CG1 4.45Å
382	V	71.8	Confident	67.3	Low	31 Å²	31	63.1 Å²	63.1	19%	0.188	32%	0.319	C	S	.	.	H	α-helix	trans	-62.7	-37.1	178.3	169.3	0	0	0	0	112.1	V378 K379 R384 G386 C406 L409	V378-V382 WeakPolarHBondContact O-CG2 3.46Å; V378-V382 PolarHBondContact O-N 3.31Å; K379-V382 PolarHBondContact O-N 2.9Å; V382-R384 VanDerWaalsContact C-N 3.33Å; V382-R384 PolarHBondContact O-N 3.22Å; V382-G386 PolarHBondContact O-N 3.42Å; V382-C406 HydrophobicContact CG1-CB 4.01Å; V382-L409 HydrophobicContact CG2-CD2 3.6Å; V382-L409 HydrophobicContact CG2-CG 4.38Å
383	A	69.5	Low	66.2	Low	55 Å²	55	63.4 Å²	63.4	46%	0.455	33%	0.331	S	S	.	.	H	α-helix	trans	-67.6	-31.4	176.9	0	0	0	0	0	113.1	K379 D380 F381 K387	K379-A383 WeakPolarHBondContact O-CB 3.47Å; K379-A383 PolarHBondContact O-N 3.09Å; D380-A383 PolarHBondContact O-N 2.97Å; F381-A383 VanDerWaalsContact C-N 3.32Å; F381-A383 PolarHBondContact O-N 3.36Å; A383-K387 WeakPolarHBondContact O-CG 3.49Å; A383-K387 PolarHBondContact O-N 2.89Å
384	R	67.3	Low	65.1	Low	108 Å²	108	69.6 Å²	69.6	41%	0.408	36%	0.355	S	S	.	.	H	α-helix	trans	-78.6	-46.5	175.9	-69.8	169.4	-169.7	-125.8	14.6	112.2	Y347 D380 F381 V382 G386 K387 A388	Y347-R384 PolarHBondContact OH-NE 3.25Å; Y347-R384 PolarHBondContact OH-NH2 3.17Å; Y347-R384 VanDerWaalsContact OH-NH2 3.14Å; D380-R384 VanDerWaalsContact CG-NE 3.27Å; D380-R384 VanDerWaalsContact O-CG 3.32Å; D380-R384 WeakPolarHBondContact O-CG 3.44Å; D380-R384 PolarHBondContact O-N 3Å; D380-R384 IonicContact OD1-CZ 2.69Å; D380-R384 IonicContact OD1-NE 3.35Å; D380-R384 PolarHBondContact OD1-NE 3.2Å; D380-R384 IonicContact OD1-NH2 2.87Å; D380-R384 PolarHBondContact OD1-NH2 3.1Å; D380-R384 IonicContact OD2-CZ 2.66Å; D380-R384 IonicContact OD2-NE 3.51Å; D380-R384 PolarHBondContact OD2-NE 2.7Å; D380-R384 VanDerWaalsContact OD2-NE 3.08Å; D380-R384 IonicContact OD2-NH2 2.77Å; D380-R384 PolarHBondContact OD2-NH2 2.95Å; F381-R384 PolarHBondContact O-N 2.91Å; V382-R384 VanDerWaalsContact C-N 3.33Å; V382-R384 PolarHBondContact O-N 3.22Å; R384-G386 VanDerWaalsContact C-N 3.26Å; R384-G386 PolarHBondContact O-N 2.69Å; R384-K387 PolarHBondContact O-N 3.05Å; R384-K387 VanDerWaalsContact O-N 3.14Å; R384-A388 PolarHBondContact O-N 3.35Å
385	V	68.4	Low	64.4	Low	9 Å²	9	73.6 Å²	73.6	6%	0.055	38%	0.377	C	S	.	.	H	α-helix	trans	-59.2	-39.9	174.8	174.7	0	0	0	0	110.8	F381 A388 Y389 M402	F381-V385 HydrophobicContact CD1-CG2 4.43Å; F381-V385 HydrophobicContact CD2-CG2 4.23Å; F381-V385 HydrophobicContact CE1-CG2 4.05Å; F381-V385 HydrophobicContact CE2-CG2 3.82Å; F381-V385 HydrophobicContact CZ-CG2 3.73Å; F381-V385 WeakPolarHBondContact O-CG2 3.2Å; F381-V385 PolarHBondContact O-N 3.39Å; V385-A388 PolarHBondContact O-N 3.27Å; V385-Y389 HydrophobicContact CG1-CD2 4.07Å; V385-Y389 HydrophobicContact CG1-CE2 4.24Å; V385-Y389 WeakPolarHBondContact O-CD2 3.38Å; V385-Y389 PolarHBondContact O-N 2.81Å; V385-Y389 VanDerWaalsContact O-N 3.17Å; V385-M402 HydrophobicContact CG1-CG 4.34Å; V385-M402 HydrophobicContact CG1-SD 4.42Å
386	G	65	Low	63.9	Low	31 Å²	31	80.7 Å²	80.7	32%	0.32	41%	0.413	S	S	.	.	H	α-helix	trans	-56.7	-51.6	172.3	0	0	0	0	0	112.7	V382 R384 A388 Y389 E390	V382-G386 PolarHBondContact O-N 3.42Å; R384-G386 VanDerWaalsContact C-N 3.26Å; R384-G386 PolarHBondContact O-N 2.69Å; G386-A388 VanDerWaalsContact C-N 3.32Å; G386-A388 PolarHBondContact O-N 3.48Å; G386-Y389 PolarHBondContact O-N 3.48Å; G386-E390 WeakPolarHBondContact O-CG 3.42Å; G386-E390 PolarHBondContact O-N 3.05Å
387	K	64.3	Low	63.5	Low	150 Å²	150	83.2 Å²	83.2	65%	0.652	43%	0.425	S	S	*	.	H	α-helix	trans	-62.9	-33	178.8	-76.4	178.6	175	-174.8	0	114.2	A383 R384 K391	A383-K387 WeakPolarHBondContact O-CG 3.49Å; A383-K387 PolarHBondContact O-N 2.89Å; R384-K387 PolarHBondContact O-N 3.05Å; R384-K387 VanDerWaalsContact O-N 3.14Å; K387-K391 PolarHBondContact O-N 3.36Å
388	A	61.3	Low	62.9	Low	38 Å²	38	85.2 Å²	85.2	31%	0.314	43%	0.433	S	S	.	.	H	α-helix	trans	-66.2	-44.6	175.2	0	0	0	0	0	111.3	R384 V385 G386 K391	R384-A388 PolarHBondContact O-N 3.35Å; V385-A388 PolarHBondContact O-N 3.27Å; G386-A388 VanDerWaalsContact C-N 3.32Å; G386-A388 PolarHBondContact O-N 3.48Å; A388-K391 VanDerWaalsContact O-CB 3.27Å; A388-K391 WeakPolarHBondContact O-CB 3.19Å; A388-K391 PolarHBondContact O-N 3.34Å; A388-K391 VanDerWaalsContact O-N 3.14Å
389	Y	59.3	Low	62.4	Low	41 Å²	41	86.9 Å²	86.9	16%	0.161	45%	0.445	C	S	.	.	H	α-helix	trans	-74.1	-22.4	176.9	-83.8	-89.5	0	0	0	114	V385 G386 K391 M402 A506	V385-Y389 HydrophobicContact CG1-CD2 4.07Å; V385-Y389 HydrophobicContact CG1-CE2 4.24Å; V385-Y389 WeakPolarHBondContact O-CD2 3.38Å; V385-Y389 PolarHBondContact O-N 2.81Å; V385-Y389 VanDerWaalsContact O-N 3.17Å; G386-Y389 PolarHBondContact O-N 3.48Å; Y389-K391 PolarHBondContact O-N 2.75Å; Y389-M402 HydrophobicContact CD2-CG 4.12Å; Y389-M402 HydrophobicContact CE2-CE 3.74Å; Y389-M402 HydrophobicContact CE2-CG 4.11Å; Y389-M402 HydrophobicContact CG-CG 4.46Å; Y389-A506 WeakPolarHBondContact OH-CB 3.44Å
390	E	55.3	Low	62.3	Low	148 Å²	148	87.8 Å²	87.8	69%	0.692	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-13	167.4	-75	176.6	163.6	0	0	113.3	G386	G386-E390 WeakPolarHBondContact O-CG 3.42Å; G386-E390 PolarHBondContact O-N 3.05Å
391	K	53.8	Low	62.2	Low	134 Å²	134	86.5 Å²	86.5	58%	0.583	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-33.5	-179.3	-140.3	-177.4	178.5	-166.7	0	112.3	D337 K387 A388 Y389 T393	D337-K391 IonicContact OD1-NZ 2.73Å; K387-K391 PolarHBondContact O-N 3.36Å; A388-K391 VanDerWaalsContact O-CB 3.27Å; A388-K391 WeakPolarHBondContact O-CB 3.19Å; A388-K391 PolarHBondContact O-N 3.34Å; A388-K391 VanDerWaalsContact O-N 3.14Å; Y389-K391 PolarHBondContact O-N 2.75Å; K391-T393 PolarHBondContact O-N 2.84Å
392	N	55.4	Low	62.2	Low	90 Å²	90	85.7 Å²	85.7	48%	0.481	45%	0.445	S	S	.	.			trans	-92.4	66.7	-178.5	-75	-4.4	0	0	0	112.1	E394 Q510	N392-E394 PolarHBondContact O-N 3.44Å; N392-Q510 PolarHBondContact ND2-NE2 3.48Å
393	T	47	Very low	62.1	Low	122 Å²	122	87.2 Å²	87.2	75%	0.748	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	46	-172.4	-41.2	0	0	0	0	114.2	K391	K391-T393 PolarHBondContact O-N 2.84Å
394	E	53.8	Low	62.3	Low	198 Å²	198	90.1 Å²	90.1	93%	0.925	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.4	-16.5	176.9	-64.8	-164.9	158.3	0	0	114.3	N392	N392-E394 PolarHBondContact O-N 3.44Å
395	N	58.3	Low	62.6	Low	84 Å²	84	88 Å²	88	45%	0.449	46%	0.457	S	S	.	.			trans	-124.6	90.3	176.4	-151.8	-4.2	0	0	0	113.2	E397 E398 S399	N395-E397 PolarHBondContact O-N 2.84Å; N395-E398 HydrophobicContact CB-CB 4.48Å; N395-E398 WeakPolarHBondContact ND2-CG 3.4Å; N395-E398 PolarHBondContact ND2-OE2 3.17Å; N395-S399 PolarHBondContact O-N 3.5Å
396	L	57.6	Low	62.8	Low	149 Å²	149	88.3 Å²	88.3	78%	0.78	46%	0.459	S	S	*	.	H	α-helix	trans	-67.1	-38.9	-169.7	-164.9	71.4	0	0	0	113.2	S399 E400	L396-S399 PolarHBondContact O-N 3.07Å; L396-E400 PolarHBondContact O-N 2.89Å
397	E	62.4	Low	63.1	Low	160 Å²	160	88.5 Å²	88.5	75%	0.748	46%	0.462	S	S	*	.	H	α-helix	trans	-70.3	-37.4	-176.4	-60	-164.8	156.7	0	0	112.3	N395 E400 A401	N395-E397 PolarHBondContact O-N 2.84Å; E397-E400 PolarHBondContact O-N 2.94Å; E397-A401 VanDerWaalsContact O-CB 3.29Å; E397-A401 WeakPolarHBondContact O-CB 3.38Å; E397-A401 PolarHBondContact O-N 3.5Å
398	E	62.8	Low	63.7	Low	65 Å²	65	84.7 Å²	84.7	30%	0.304	45%	0.45	S	S	.	.	H	α-helix	trans	-68.2	-40.3	176.3	-67.2	-164.9	120.6	0	0	112.2	N395 A401 M402	N395-E398 HydrophobicContact CB-CB 4.48Å; N395-E398 WeakPolarHBondContact ND2-CG 3.4Å; N395-E398 PolarHBondContact ND2-OE2 3.17Å; E398-A401 PolarHBondContact O-N 3.22Å; E398-M402 WeakPolarHBondContact O-CB 3.35Å; E398-M402 PolarHBondContact O-N 2.81Å
399	S	62.3	Low	64.2	Low	40 Å²	40	82.9 Å²	82.9	28%	0.28	44%	0.436	S	S	.	.	H	α-helix	trans	-62.3	-44.1	174.8	-169	0	0	0	0	111	N395 L396 A401 M402 A403	N395-S399 PolarHBondContact O-N 3.5Å; L396-S399 PolarHBondContact O-N 3.07Å; S399-A401 PolarHBondContact O-N 2.96Å; S399-M402 PolarHBondContact O-N 3.49Å; S399-A403 WeakPolarHBondContact O-CB 3.42Å; S399-A403 PolarHBondContact O-N 3.34Å
400	E	69.6	Low	64.8	Low	110 Å²	110	87.2 Å²	87.2	51%	0.514	46%	0.455	S	S	.	.	H	α-helix	trans	-65.7	-38.3	174.9	-150.9	-152.5	164	0	0	112.2	L396 E397 A403 K404	L396-E400 PolarHBondContact O-N 2.89Å; E397-E400 PolarHBondContact O-N 2.94Å; E400-A403 PolarHBondContact O-N 3.28Å; E400-K404 VanDerWaalsContact CD-CE 3.43Å; E400-K404 WeakPolarHBondContact O-CB 3.24Å; E400-K404 WeakPolarHBondContact O-CD 3.38Å; E400-K404 VanDerWaalsContact O-CG 3.26Å; E400-K404 WeakPolarHBondContact O-CG 3.42Å; E400-K404 PolarHBondContact O-N 3.49Å; E400-K404 WeakPolarHBondContact OE1-CE 3.4Å; E400-K404 IonicContact OE1-NZ 3.4Å; E400-K404 PolarHBondContact OE1-NZ 3.16Å; E400-K404 IonicContact OE2-NZ 3.75Å; E400-K404 PolarHBondContact OE2-NZ 3.25Å
401	A	70.9	Confident	65.8	Low	32 Å²	32	86.1 Å²	86.1	26%	0.264	45%	0.45	S	S	.	.	H	α-helix	trans	-66.9	-35.5	175.5	0	0	0	0	0	112.6	E397 E398 S399 K405	E397-A401 VanDerWaalsContact O-CB 3.29Å; E397-A401 WeakPolarHBondContact O-CB 3.38Å; E397-A401 PolarHBondContact O-N 3.5Å; E398-A401 PolarHBondContact O-N 3.22Å; S399-A401 PolarHBondContact O-N 2.96Å; A401-K405 VanDerWaalsContact O-CD 3.31Å; A401-K405 WeakPolarHBondContact O-CD 3.29Å; A401-K405 VanDerWaalsContact O-CG 3.26Å; A401-K405 WeakPolarHBondContact O-CG 3.28Å; A401-K405 PolarHBondContact O-N 3.31Å
402	M	70	Confident	66.9	Low	4 Å²	4	83.5 Å²	83.5	2%	0.02	44%	0.439	C	S	.	.	H	α-helix	trans	-71.2	-44.6	173.8	-172.9	59.7	85.8	0	0	110.9	V385 Y389 E398 S399 K404 K405 C406 I499 H502	V385-M402 HydrophobicContact CG1-CG 4.34Å; V385-M402 HydrophobicContact CG1-SD 4.42Å; Y389-M402 HydrophobicContact CD2-CG 4.12Å; Y389-M402 HydrophobicContact CE2-CE 3.74Å; Y389-M402 HydrophobicContact CE2-CG 4.11Å; Y389-M402 HydrophobicContact CG-CG 4.46Å; E398-M402 WeakPolarHBondContact O-CB 3.35Å; E398-M402 PolarHBondContact O-N 2.81Å; S399-M402 PolarHBondContact O-N 3.49Å; M402-K404 VanDerWaalsContact C-N 3.31Å; M402-K404 PolarHBondContact O-N 2.86Å; M402-K405 PolarHBondContact O-N 3.14Å; M402-K405 VanDerWaalsContact O-N 3.07Å; M402-C406 WeakPolarHBondContact O-CB 3.39Å; M402-C406 PolarHBondContact O-N 2.91Å; M402-I499 HydrophobicContact SD-CG1 4.5Å; M402-I499 HydrophobicContact SD-CG2 4.06Å; M402-H502 HydrophobicContact CE-CB 4.25Å
403	A	69.5	Low	67.6	Low	63 Å²	63	79.3 Å²	79.3	52%	0.521	42%	0.417	S	S	.	.	H	α-helix	trans	-56.8	-43.3	175	0	0	0	0	0	112.1	S399 E400 C406 G407	S399-A403 WeakPolarHBondContact O-CB 3.42Å; S399-A403 PolarHBondContact O-N 3.34Å; E400-A403 PolarHBondContact O-N 3.28Å; A403-C406 PolarHBondContact O-N 2.89Å; A403-G407 PolarHBondContact O-N 3.37Å
404	K	75	Confident	68.8	Low	116 Å²	116	77.1 Å²	77.1	50%	0.504	40%	0.4	S	S	.	.	H	α-helix	trans	-59.7	-44.1	173.2	-74	163	-175.6	163.6	0	112.2	E400 M402 G407 V408	E400-K404 VanDerWaalsContact CD-CE 3.43Å; E400-K404 WeakPolarHBondContact O-CB 3.24Å; E400-K404 WeakPolarHBondContact O-CD 3.38Å; E400-K404 VanDerWaalsContact O-CG 3.26Å; E400-K404 WeakPolarHBondContact O-CG 3.42Å; E400-K404 PolarHBondContact O-N 3.49Å; E400-K404 WeakPolarHBondContact OE1-CE 3.4Å; E400-K404 IonicContact OE1-NZ 3.4Å; E400-K404 PolarHBondContact OE1-NZ 3.16Å; E400-K404 IonicContact OE2-NZ 3.75Å; E400-K404 PolarHBondContact OE2-NZ 3.25Å; M402-K404 VanDerWaalsContact C-N 3.31Å; M402-K404 PolarHBondContact O-N 2.86Å; K404-G407 PolarHBondContact O-N 2.86Å; K404-V408 WeakPolarHBondContact O-CG2 3.31Å; K404-V408 PolarHBondContact O-N 3.03Å; K404-V408 VanDerWaalsContact O-N 3.08Å
405	K	73.8	Confident	69.9	Low	63 Å²	63	70 Å²	70	27%	0.274	37%	0.372	S	S	.	.	H	α-helix	trans	-65.9	-45.4	177.6	-69	159.6	-168.9	145.1	0	112	A401 M402 G407 V408 L409 I499 H502	A401-K405 VanDerWaalsContact O-CD 3.31Å; A401-K405 WeakPolarHBondContact O-CD 3.29Å; A401-K405 VanDerWaalsContact O-CG 3.26Å; A401-K405 WeakPolarHBondContact O-CG 3.28Å; A401-K405 PolarHBondContact O-N 3.31Å; M402-K405 PolarHBondContact O-N 3.14Å; M402-K405 VanDerWaalsContact O-N 3.07Å; K405-G407 VanDerWaalsContact C-N 3.31Å; K405-G407 PolarHBondContact O-N 3.28Å; K405-V408 PolarHBondContact O-N 3.49Å; K405-L409 PolarHBondContact O-N 2.97Å; K405-I499 HydrophobicContact CB-CD1 4.26Å; K405-I499 HydrophobicContact CB-CG1 3.87Å; K405-H502 PolarHBondContact NZ-CD2 3.35Å; K405-H502 PolarHBondContact NZ-CE1 2.87Å; K405-H502 PolarHBondContact NZ-NE2 2.92Å
406	C	70.8	Confident	70.6	Confident	16 Å²	16	66.2 Å²	66.2	11%	0.108	35%	0.352	C	S	.	.	H	α-helix	trans	-61.9	-37	175.3	-74.5	0	0	0	0	112.4	V382 M402 A403 L409 K410	V382-C406 HydrophobicContact CG1-CB 4.01Å; M402-C406 WeakPolarHBondContact O-CB 3.39Å; M402-C406 PolarHBondContact O-N 2.91Å; A403-C406 PolarHBondContact O-N 2.89Å; C406-L409 PolarHBondContact O-N 3.23Å; C406-K410 WeakPolarHBondContact O-CB 3.48Å; C406-K410 PolarHBondContact O-N 3.35Å
407	G	71.7	Confident	71.1	Confident	36 Å²	36	60.6 Å²	60.6	37%	0.371	32%	0.322	S	S	.	.	H	α-helix	trans	-58.7	-51.6	170.2	0	0	0	0	0	112.4	A403 K404 K405 L409 K410 E411	A403-G407 PolarHBondContact O-N 3.37Å; K404-G407 PolarHBondContact O-N 2.86Å; K405-G407 VanDerWaalsContact C-N 3.31Å; K405-G407 PolarHBondContact O-N 3.28Å; G407-L409 VanDerWaalsContact C-N 3.33Å; G407-L409 PolarHBondContact O-N 3.4Å; G407-K410 WeakPolarHBondContact O-CB 3.26Å; G407-K410 PolarHBondContact O-N 3.01Å; G407-E411 PolarHBondContact O-N 3.08Å
408	V	76.9	Confident	71.7	Confident	69 Å²	69	59.1 Å²	59.1	42%	0.418	31%	0.314	S	S	.	.	H	α-helix	trans	-60.8	-40.3	176.7	173.2	0	0	0	0	111.9	K404 K405 K410 E411 K412	K404-V408 WeakPolarHBondContact O-CG2 3.31Å; K404-V408 PolarHBondContact O-N 3.03Å; K404-V408 VanDerWaalsContact O-N 3.08Å; K405-V408 PolarHBondContact O-N 3.49Å; V408-K410 PolarHBondContact O-N 3.22Å; V408-E411 PolarHBondContact O-N 3.19Å; V408-K412 WeakPolarHBondContact O-CG 3.39Å; V408-K412 PolarHBondContact O-N 3Å
409	L	72	Confident	72.2	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-59.3	-46.4	175.2	172.6	58.5	0	0	0	111.2	V378 V382 K405 C406 G407 K412 L413 L492 A495 I496 I499	V378-L409 HydrophobicContact CG1-CD1 4.24Å; V378-L409 HydrophobicContact CG1-CD2 4Å; V378-L409 HydrophobicContact CG1-CG 4.15Å; V382-L409 HydrophobicContact CG2-CD2 3.6Å; V382-L409 HydrophobicContact CG2-CG 4.38Å; K405-L409 PolarHBondContact O-N 2.97Å; C406-L409 PolarHBondContact O-N 3.23Å; G407-L409 VanDerWaalsContact C-N 3.33Å; G407-L409 PolarHBondContact O-N 3.4Å; L409-K412 PolarHBondContact O-N 3.42Å; L409-L413 PolarHBondContact O-N 2.89Å; L409-L492 HydrophobicContact CD1-CD1 3.57Å; L409-A495 HydrophobicContact CD1-CB 4.04Å; L409-I496 HydrophobicContact CD1-CD1 4.46Å; L409-I496 HydrophobicContact CD1-CG1 3.53Å; L409-I496 HydrophobicContact CD2-CG1 4.33Å; L409-I499 HydrophobicContact CB-CD1 3.69Å; L409-I499 HydrophobicContact CD2-CD1 3.5Å; L409-I499 VanDerWaalsContact CD2-CD1 3.5Å; L409-I499 HydrophobicContact CG-CD1 4.18Å
410	K	71.2	Confident	72.3	Confident	132 Å²	132	54.9 Å²	54.9	57%	0.574	29%	0.29	S	S	*	.	H	α-helix	trans	-60.7	-45	176.9	-172.2	177	178.5	-179	0	111.9	C406 G407 V408 K412 L413 D414	C406-K410 WeakPolarHBondContact O-CB 3.48Å; C406-K410 PolarHBondContact O-N 3.35Å; G407-K410 WeakPolarHBondContact O-CB 3.26Å; G407-K410 PolarHBondContact O-N 3.01Å; V408-K410 PolarHBondContact O-N 3.22Å; K410-K412 VanDerWaalsContact C-N 3.34Å; K410-K412 PolarHBondContact O-N 3.44Å; K410-L413 WeakPolarHBondContact O-CB 3.41Å; K410-L413 PolarHBondContact O-N 3.41Å; K410-L413 VanDerWaalsContact O-N 3.16Å; K410-D414 PolarHBondContact O-N 2.86Å
411	E	77	Confident	72.2	Confident	125 Å²	125	53.3 Å²	53.3	58%	0.584	29%	0.285	S	S	*	.	H	α-helix	trans	-59.3	-40.3	174.3	-70.8	-175.4	168.7	0	0	113.2	G407 V408 L413 S415	G407-E411 PolarHBondContact O-N 3.08Å; V408-E411 PolarHBondContact O-N 3.19Å; E411-L413 VanDerWaalsContact C-N 3.35Å; E411-S415 VanDerWaalsContact O-CB 3.29Å; E411-S415 WeakPolarHBondContact O-CB 3.4Å; E411-S415 PolarHBondContact O-N 3.07Å
412	K	76.1	Confident	72.1	Confident	78 Å²	78	56.1 Å²	56.1	34%	0.339	29%	0.293	S	S	.	.	H	α-helix	trans	-68	-36.2	176.4	-62	-39	176.7	-157.9	0	111.7	V408 L409 K410 S415 L416 L492	V408-K412 WeakPolarHBondContact O-CG 3.39Å; V408-K412 PolarHBondContact O-N 3Å; L409-K412 PolarHBondContact O-N 3.42Å; K410-K412 VanDerWaalsContact C-N 3.34Å; K410-K412 PolarHBondContact O-N 3.44Å; K412-S415 PolarHBondContact O-N 3.35Å; K412-L416 PolarHBondContact O-N 3.46Å; K412-L416 VanDerWaalsContact O-N 3.07Å; K412-L492 HydrophobicContact CB-CD1 4.09Å
413	L	71.8	Confident	71.8	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.016	30%	0.3	C	S	.	.	H	α-helix	trans	-65.7	-49	176.2	-165.5	71.9	0	0	0	111.3	C375 V378 K379 L409 K410 E411 S415 L416 L417 L492	C375-L413 HydrophobicContact CB-CD1 4.27Å; C375-L413 HydrophobicContact CB-CD2 4.19Å; C375-L413 HydrophobicContact CB-CG 4.29Å; C375-L413 VanDerWaalsContact SG-CD1 3.53Å; V378-L413 HydrophobicContact CB-CD1 4.33Å; V378-L413 HydrophobicContact CB-CD2 4.16Å; V378-L413 HydrophobicContact CG1-CD1 4.29Å; V378-L413 HydrophobicContact CG1-CD2 3.96Å; K379-L413 HydrophobicContact CG-CD2 4.28Å; L409-L413 PolarHBondContact O-N 2.89Å; K410-L413 WeakPolarHBondContact O-CB 3.41Å; K410-L413 PolarHBondContact O-N 3.41Å; K410-L413 VanDerWaalsContact O-N 3.16Å; E411-L413 VanDerWaalsContact C-N 3.35Å; L413-S415 VanDerWaalsContact C-N 3.29Å; L413-S415 PolarHBondContact O-N 2.9Å; L413-L416 WeakPolarHBondContact O-CB 3.39Å; L413-L416 PolarHBondContact O-N 3.44Å; L413-L416 VanDerWaalsContact O-N 3.12Å; L413-L417 PolarHBondContact O-N 2.78Å; L413-L492 HydrophobicContact CB-CD1 4.14Å; L413-L492 HydrophobicContact CD1-CD1 3.95Å; L413-L492 HydrophobicContact CD1-CD2 3.65Å; L413-L492 HydrophobicContact CD1-CG 4.46Å
414	D	72.5	Confident	71.3	Confident	75 Å²	75	56.6 Å²	56.6	40%	0.401	29%	0.289	S	S	.	.	H	α-helix	trans	-65.5	-32	177.9	-70.5	-28.6	0	0	0	111.7	K410 K418	K410-D414 PolarHBondContact O-N 2.86Å; D414-K418 VanDerWaalsContact O-CB 3.27Å; D414-K418 WeakPolarHBondContact O-CB 3.46Å; D414-K418 PolarHBondContact O-N 3.07Å
415	S	76.8	Confident	70.3	Confident	49 Å²	49	57.2 Å²	57.2	34%	0.343	29%	0.294	S	S	.	.	H	α-helix	trans	-66.4	-38.3	171.4	-166.8	0	0	0	0	113	E411 K412 L413 T419	E411-S415 VanDerWaalsContact O-CB 3.29Å; E411-S415 WeakPolarHBondContact O-CB 3.4Å; E411-S415 PolarHBondContact O-N 3.07Å; K412-S415 PolarHBondContact O-N 3.35Å; L413-S415 VanDerWaalsContact C-N 3.29Å; L413-S415 PolarHBondContact O-N 2.9Å; S415-T419 PolarHBondContact O-N 2.97Å; S415-T419 VanDerWaalsContact O-N 3.15Å; S415-T419 PolarHBondContact O-OG1 3.15Å
416	L	71.6	Confident	69.4	Low	4 Å²	4	58.1 Å²	58.1	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-68.7	-44.9	174.3	-175.8	65.2	0	0	0	111.2	K412 L413 K418 T419 L420 L485 R488 L492	K412-L416 PolarHBondContact O-N 3.46Å; K412-L416 VanDerWaalsContact O-N 3.07Å; L413-L416 WeakPolarHBondContact O-CB 3.39Å; L413-L416 PolarHBondContact O-N 3.44Å; L413-L416 VanDerWaalsContact O-N 3.12Å; L416-K418 PolarHBondContact O-N 2.86Å; L416-T419 VanDerWaalsContact O-CB 3.28Å; L416-T419 WeakPolarHBondContact O-CB 3.4Å; L416-T419 PolarHBondContact O-N 3.42Å; L416-L420 HydrophobicContact CG-CD1 4.24Å; L416-L420 PolarHBondContact O-N 2.75Å; L416-L485 HydrophobicContact CD1-CD1 3.7Å; L416-R488 HydrophobicContact CD1-CB 3.85Å; L416-L492 HydrophobicContact CD2-CD2 3.72Å
417	L	68.9	Low	68.5	Low	31 Å²	31	63.1 Å²	63.1	16%	0.162	34%	0.338	C	S	.	.	H	α-helix	trans	-59.6	-43.5	174.5	-79	170.5	0	0	0	112.4	C375 L413 T419 L420 N421	C375-L417 HydrophobicContact CB-CD1 4.09Å; C375-L417 HydrophobicContact CB-CD2 4.28Å; C375-L417 HydrophobicContact CB-CG 4.42Å; C375-L417 VanDerWaalsContact SG-CD2 3.56Å; C375-L417 VanDerWaalsContact SG-CG 3.54Å; L413-L417 PolarHBondContact O-N 2.78Å; L417-T419 VanDerWaalsContact C-N 3.29Å; L417-T419 PolarHBondContact O-N 3.31Å; L417-L420 PolarHBondContact O-N 2.95Å; L417-N421 WeakPolarHBondContact O-CB 3.48Å; L417-N421 PolarHBondContact O-N 3.39Å
418	K	75.2	Confident	67.3	Low	130 Å²	130	66.8 Å²	66.8	57%	0.565	35%	0.353	S	S	*	.	H	α-helix	trans	-59.3	-41.4	175.2	179.9	166.3	174.7	171.2	0	111.6	D414 L416 N421 E422	D414-K418 VanDerWaalsContact O-CB 3.27Å; D414-K418 WeakPolarHBondContact O-CB 3.46Å; D414-K418 PolarHBondContact O-N 3.07Å; L416-K418 PolarHBondContact O-N 2.86Å; K418-N421 PolarHBondContact O-N 2.98Å; K418-E422 WeakPolarHBondContact CE-OE1 2.99Å; K418-E422 HydrophobicContact CG-CG 4.37Å; K418-E422 WeakPolarHBondContact CG-OE1 3.29Å; K418-E422 IonicContact NZ-OE1 2.65Å; K418-E422 WeakPolarHBondContact O-CB 3.36Å; K418-E422 VanDerWaalsContact O-CG 3.25Å; K418-E422 WeakPolarHBondContact O-CG 3.32Å; K418-E422 PolarHBondContact O-N 3.27Å
419	T	71.9	Confident	65.6	Low	6 Å²	6	69.5 Å²	69.5	4%	0.037	37%	0.37	C	S	.	.	H	α-helix	trans	-59.2	-50.4	175.2	-49.1	0	0	0	0	111.9	S415 L416 L417 N421 E422 E423 L485 R488	S415-T419 PolarHBondContact O-N 2.97Å; S415-T419 VanDerWaalsContact O-N 3.15Å; S415-T419 PolarHBondContact O-OG1 3.15Å; L416-T419 VanDerWaalsContact O-CB 3.28Å; L416-T419 WeakPolarHBondContact O-CB 3.4Å; L416-T419 PolarHBondContact O-N 3.42Å; L417-T419 VanDerWaalsContact C-N 3.29Å; L417-T419 PolarHBondContact O-N 3.31Å; T419-N421 VanDerWaalsContact C-N 3.29Å; T419-N421 PolarHBondContact O-N 3.27Å; T419-E422 PolarHBondContact O-N 2.94Å; T419-E423 WeakPolarHBondContact O-CG 3.29Å; T419-E423 PolarHBondContact O-N 2.82Å; T419-L485 HydrophobicContact CG2-CD1 4.01Å; T419-R488 VanDerWaalsContact CG2-NH1 3.28Å; T419-R488 WeakPolarHBondContact OG1-CD 3.1Å; T419-R488 VanDerWaalsContact OG1-CZ 3.23Å; T419-R488 PolarHBondContact OG1-NE 3.5Å; T419-R488 PolarHBondContact OG1-NH1 3.05Å
420	L	65.4	Low	64	Low	9 Å²	9	76.7 Å²	76.7	5%	0.047	41%	0.407	C	S	.	.	H	α-helix	trans	-66.1	-33.1	-178.4	-70.2	162.6	0	0	0	111.8	V367 I368 A371 L416 L417 S424 L485	V367-L420 HydrophobicContact CG1-CD2 4.49Å; I368-L420 HydrophobicContact CG1-CD2 4.36Å; A371-L420 HydrophobicContact CB-CD1 3.46Å; A371-L420 VanDerWaalsContact CB-CD1 3.46Å; L416-L420 HydrophobicContact CG-CD1 4.24Å; L416-L420 PolarHBondContact O-N 2.75Å; L417-L420 PolarHBondContact O-N 2.95Å; L420-S424 WeakPolarHBondContact O-CB 3.46Å; L420-S424 PolarHBondContact O-N 3.3Å; L420-S424 PolarHBondContact O-OG 3.16Å; L420-L485 HydrophobicContact CD2-CD1 3.74Å; L420-L485 HydrophobicContact CD2-CD2 4.24Å; L420-L485 HydrophobicContact CG-CD1 3.97Å
421	N	67.4	Low	62.4	Low	77 Å²	77	75.7 Å²	75.7	41%	0.412	41%	0.414	S	S	.	.	H	α-helix	trans	-70.6	-43.2	172.9	-75.1	-21.4	0	0	0	111.6	L417 K418 T419 S424 Q425	L417-N421 WeakPolarHBondContact O-CB 3.48Å; L417-N421 PolarHBondContact O-N 3.39Å; K418-N421 PolarHBondContact O-N 2.98Å; T419-N421 VanDerWaalsContact C-N 3.29Å; T419-N421 PolarHBondContact O-N 3.27Å; N421-S424 WeakPolarHBondContact CA-OG 3.39Å; N421-S424 PolarHBondContact O-N 3.01Å; N421-S424 PolarHBondContact O-OG 2.86Å; N421-Q425 WeakPolarHBondContact O-CG 2.84Å; N421-Q425 PolarHBondContact O-N 3.34Å
422	E	68.3	Low	60.6	Low	92 Å²	92	76 Å²	76	43%	0.43	43%	0.427	S	S	.	.	H	α-helix	trans	-59.7	-44.4	173.9	-73.6	166.1	169.3	0	0	111.5	K418 T419 Q425 A426	K418-E422 WeakPolarHBondContact CE-OE1 2.99Å; K418-E422 HydrophobicContact CG-CG 4.37Å; K418-E422 WeakPolarHBondContact CG-OE1 3.29Å; K418-E422 IonicContact NZ-OE1 2.65Å; K418-E422 WeakPolarHBondContact O-CB 3.36Å; K418-E422 VanDerWaalsContact O-CG 3.25Å; K418-E422 WeakPolarHBondContact O-CG 3.32Å; K418-E422 PolarHBondContact O-N 3.27Å; T419-E422 PolarHBondContact O-N 2.94Å; E422-Q425 PolarHBondContact O-N 2.77Å; E422-A426 PolarHBondContact O-N 3.08Å; E422-A426 VanDerWaalsContact O-N 3.11Å
423	E	64	Low	58.6	Low	34 Å²	34	76.7 Å²	76.7	16%	0.159	45%	0.447	C	S	.	.	H	α-helix	trans	-62.2	-41.9	173.5	-74.5	-178	162.4	0	0	112.6	T419 A426 P481	T419-E423 WeakPolarHBondContact O-CG 3.29Å; T419-E423 PolarHBondContact O-N 2.82Å; E423-A426 PolarHBondContact O-N 3.26Å; E423-P481 VanDerWaalsContact OE1-CB 3.29Å; E423-P481 WeakPolarHBondContact OE1-CB 3.44Å; E423-P481 WeakPolarHBondContact OE1-CG 3.27Å
424	S	59.1	Low	56.9	Low	42 Å²	42	82.1 Å²	82.1	29%	0.294	48%	0.482	S	S	.	.	H	α-helix	trans	-70.5	-32.5	178.7	66	0	0	0	0	113.5	L420 N421 L427 T428	L420-S424 WeakPolarHBondContact O-CB 3.46Å; L420-S424 PolarHBondContact O-N 3.3Å; L420-S424 PolarHBondContact O-OG 3.16Å; N421-S424 WeakPolarHBondContact CA-OG 3.39Å; N421-S424 PolarHBondContact O-N 3.01Å; N421-S424 PolarHBondContact O-OG 2.86Å; S424-L427 PolarHBondContact O-N 3.17Å; S424-T428 PolarHBondContact O-OG1 3.01Å; S424-T428 VanDerWaalsContact O-OG1 3.14Å
425	Q	54.8	Low	55.4	Low	130 Å²	130	84.4 Å²	84.4	61%	0.607	50%	0.501	S	S	*	.	H	α-helix	trans	-74.5	-29.6	176.7	-71.9	174.5	11.2	0	0	112.4	N421 E422 L427 T428	N421-Q425 WeakPolarHBondContact O-CG 2.84Å; N421-Q425 PolarHBondContact O-N 3.34Å; E422-Q425 PolarHBondContact O-N 2.77Å; Q425-L427 PolarHBondContact O-N 3.49Å; Q425-T428 PolarHBondContact O-N 3.48Å
426	A	54.9	Low	53.9	Low	81 Å²	81	87.7 Å²	87.7	67%	0.669	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-17.6	174.5	0	0	0	0	0	113.7	E422 E423	E422-A426 PolarHBondContact O-N 3.08Å; E422-A426 VanDerWaalsContact O-N 3.11Å; E423-A426 PolarHBondContact O-N 3.26Å
427	L	51.2	Low	51.8	Low	122 Å²	122	94.4 Å²	94.4	64%	0.639	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-16.5	177.4	-67.2	168.5	0	0	0	113.8	S424 Q425	S424-L427 PolarHBondContact O-N 3.17Å; Q425-L427 PolarHBondContact O-N 3.49Å
428	T	46.3	Very low	50	Low	112 Å²	112	100.7 Å²	100.7	69%	0.687	60%	0.595	S	S	*	*	S	Bend	trans	-94.2	-0.9	-168.2	-30.8	0	0	0	0	114.1	S424 Q425 L430	S424-T428 PolarHBondContact O-OG1 3.01Å; S424-T428 VanDerWaalsContact O-OG1 3.14Å; Q425-T428 PolarHBondContact O-N 3.48Å; T428-L430 PolarHBondContact O-N 2.95Å
429	V	40.9	Very low	47.8	Very low	127 Å²	127	98.5 Å²	98.5	77%	0.77	60%	0.601	S	S	*	*			trans	-95.5	79.7	-175.9	-171.1	0	0	0	0	111.4
430	L	39.1	Very low	45.8	Very low	152 Å²	152	107.3 Å²	107.3	80%	0.796	64%	0.642	S	S	*	*			trans	-120.6	142.3	159.6	-77.8	169.9	0	0	0	109.3	T428	T428-L430 PolarHBondContact O-N 2.95Å
431	P	38.1	Very low	44	Very low	111 Å²	111	115.6 Å²	115.6	72%	0.721	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-70.2	152.5	176.4	30.3	-34.6	0	0	0	111.5
432	P	38.1	Very low	42	Very low	131 Å²	131	120.8 Å²	120.8	85%	0.851	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-71.6	143.1	-174.9	29.4	-35.6	0	0	0	112.9
433	A	34.5	Very low	40.1	Very low	92 Å²	92	125.6 Å²	125.6	76%	0.76	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-96.6	149.6	174	0	0	0	0	0	112.1
434	P	36	Very low	38.3	Very low	117 Å²	117	132.7 Å²	132.7	76%	0.76	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-72.7	164.5	168.9	31.2	-34.1	0	0	0	112.5
435	P	40	Very low	36.6	Very low	123 Å²	123	138.1 Å²	138.1	80%	0.799	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-77.4	166.7	-165.3	30.7	-36.9	0	0	0	115.6
436	P	46.9	Very low	35.3	Very low	119 Å²	119	139.9 Å²	139.9	77%	0.773	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-97.8	166.2	-162.3	38.7	-37.4	0	0	0	115.5
437	T	26.6	Very low	33.9	Very low	144 Å²	144	141.5 Å²	141.5	88%	0.883	79%	0.792	S	S	*	*			trans	-133	147.8	161.3	-48.2	0	0	0	0	109.2
438	I	31.8	Very low	32.6	Very low	163 Å²	163	141.3 Å²	141.3	84%	0.836	80%	0.796	S	S	*	*			trans	-107.9	133.8	-171.6	-61.8	163.2	0	0	0	110.9
439	A	28.6	Very low	31.6	Very low	84 Å²	84	140.7 Å²	140.7	69%	0.694	80%	0.796	S	S	*	*			trans	165	148.2	154.3	0	0	0	0	0	107.8
440	E	30.4	Very low	30.8	Very low	192 Å²	192	143.1 Å²	143.1	90%	0.897	80%	0.804	S	S	*	*			cis	-159.8	174.7	-27.5	-123.3	169.9	171.3	0	0	105.5
441	E	28.2	Very low	30.3	Very low	182 Å²	182	140 Å²	140	85%	0.85	80%	0.8	S	S	*	*			trans	-81.7	140.5	-172.7	-58.9	167.9	126.1	0	0	113.2
442	Q	25.3	Very low	31.2	Very low	186 Å²	186	139.9 Å²	139.9	87%	0.869	80%	0.8	S	S	*	*				-178.8	175.6	125.5	-98.6	166.9	12.7	0	0	114.4
443	E	26.6	Very low	30.8	Very low	193 Å²	193	140.7 Å²	140.7	90%	0.902	80%	0.796	S	S	*	*			trans	-83.6	172.8	-149.2	-61.8	169.4	116.7	0	0	117.1
444	E	27.2	Very low	30.5	Very low	183 Å²	183	143.1 Å²	143.1	86%	0.855	80%	0.795	S	S	*	*			trans	-76.7	158.4	179.8	-54	177.8	109.2	0	0	113.9
445	L	23.7	Very low	30	Very low	157 Å²	157	145.7 Å²	145.7	82%	0.822	80%	0.797	S	S	*	*			trans	-156.8	118.5	137	-138.4	83.1	0	0	0	114.4
446	E	27.3	Very low	29.9	Very low	167 Å²	167	145.3 Å²	145.3	78%	0.78	79%	0.794	S	S	*	*			trans	63.3	154.3	136.3	-87.2	-165.6	163.1	0	0	126.7
447	V	24.9	Very low	29	Very low	115 Å²	115	144.1 Å²	144.1	70%	0.697	80%	0.795	S	S	*	*			trans	99.2	104.5	135.8	151.5	0	0	0	0	123
448	V	24.1	Very low	29.5	Very low	117 Å²	117	143.3 Å²	143.3	71%	0.709	79%	0.791	S	S	*	*			trans	79.2	104.1	130.2	-179.3	0	0	0	0	123.6
449	S	25	Very low	30.3	Very low	100 Å²	100	141.3 Å²	141.3	70%	0.699	79%	0.789	S	S	*	*				52.1	148.8	117	-44.3	0	0	0	0	127.1
450	L	24	Very low	31.3	Very low	178 Å²	178	142 Å²	142	93%	0.932	79%	0.787	S	S	*	*			trans	88.4	159.7	148.6	-74.4	155.4	0	0	0	121.2
451	A	28.8	Very low	31.4	Very low	87 Å²	87	141.4 Å²	141.4	72%	0.719	78%	0.783	S	S	*	*			trans	-141.5	-156.9	-169.1	0	0	0	0	0	109.2
452	P	57.4	Low	32.2	Very low	108 Å²	108	138.1 Å²	138.1	70%	0.701	78%	0.778	S	S	*	*			cis	-140.8	-149.8	-6.4	34.1	-7.8	0	0	0	114.9
453	L	28.5	Very low	32.8	Very low	147 Å²	147	135 Å²	135	77%	0.77	77%	0.774	S	S	*	*			trans	88.4	150.5	162.5	-50.9	-179.2	0	0	0	118.2
454	L	28.4	Very low	32.8	Very low	143 Å²	143	132.4 Å²	132.4	75%	0.749	78%	0.775	S	S	*	*			cis	-154.7	-171.5	-0.1	-121.8	166.3	0	0	0	114.1
455	H	26.9	Very low	33.1	Very low	172 Å²	172	129 Å²	129	80%	0.796	77%	0.772	S	S	*	*			trans	-91.2	-175.1	-164.6	-74.5	-48.3	0	0	0	116.5
456	P	37.8	Very low	33.7	Very low	115 Å²	115	127.9 Å²	127.9	75%	0.747	77%	0.774	S	S	*	*			cis	-153.7	171.9	22.7	45.4	-22.9	0	0	0	123.9
457	A	26.8	Very low	33.9	Very low	94 Å²	94	131.3 Å²	131.3	78%	0.777	78%	0.78	S	S	*	*			trans	59.5	129.7	147.8	0	0	0	0	0	123.9
458	P	38.4	Very low	34.1	Very low	126 Å²	126	130.3 Å²	130.3	82%	0.818	78%	0.783	S	S	*	*				-154	172.4	103.1	42.3	-26.1	0	0	0	117
459	P	48.8	Very low	34.3	Very low	121 Å²	121	131 Å²	131	79%	0.786	79%	0.788	S	S	*	*			trans	-137.7	-179.8	164.5	44.9	-31.1	0	0	0	114.1
460	P	49.2	Very low	34.6	Very low	99 Å²	99	131.6 Å²	131.6	64%	0.643	79%	0.79	S	S	*	*			cis	-135.6	165.7	-2.2	42.5	-26.1	0	0	0	118.1
461	H	32.6	Very low	35.1	Very low	179 Å²	179	128.9 Å²	128.9	83%	0.829	78%	0.782	S	S	*	*			trans	86.6	151	145.2	-68.3	-24.2	0	0	0	123.3
462	P	44.6	Very low	35.4	Very low	114 Å²	114	130.1 Å²	130.1	74%	0.74	78%	0.783	S	S	*	*			trans	-134	-160.4	-138.9	49.1	-32	0	0	0	113.2
463	P	37.9	Very low	34.2	Very low	121 Å²	121	129.5 Å²	129.5	79%	0.786	78%	0.782	S	S	*	*			cis	-129.5	161.2	-5.7	40.6	-24.7	0	0	0	116.3
464	C	27.3	Very low	34.5	Very low	137 Å²	137	127.6 Å²	127.6	93%	0.926	79%	0.787	S	S	*	*			trans	-151.1	159.6	166.9	-133.4	0	0	0	0	112.3
465	S	33.1	Very low	34.9	Very low	112 Å²	112	124.9 Å²	124.9	78%	0.783	79%	0.785	S	S	*	*			trans	-76.6	154.6	-169.9	-61.8	0	0	0	0	114.4
466	P	35.9	Very low	35.4	Very low	133 Å²	133	121.3 Å²	121.3	86%	0.864	79%	0.786	S	S	*	*			trans	-79	148.7	-169.2	31.3	-36.4	0	0	0	114.7
467	R	30.8	Very low	35.4	Very low	240 Å²	240	120 Å²	120	91%	0.906	78%	0.784	S	S	*	*			trans	-110	140	171.7	178.5	178.2	177.3	176	-0.3	109.5
468	A	29.8	Very low	36.3	Very low	93 Å²	93	121.3 Å²	121.3	77%	0.769	78%	0.777	S	S	*	*			trans	-91.9	150.9	-175.3	0	0	0	0	0	114.2
469	T	28.3	Very low	36.8	Very low	132 Å²	132	121.4 Å²	121.4	81%	0.81	76%	0.764	S	S	*	*			trans	-154.1	160.3	164.7	44.8	0	0	0	0	108.8
470	P	31.4	Very low	36.7	Very low	113 Å²	113	124.9 Å²	124.9	73%	0.734	77%	0.767	S	S	*	*				-104	164.7	-52.8	37.9	-28.7	0	0	0	111.2
471	P	35	Very low	36.9	Very low	120 Å²	120	122.2 Å²	122.2	78%	0.779	75%	0.75	S	S	*	*			trans	-76.6	146.2	171.7	32.1	-34	0	0	0	112.1
472	P	34.3	Very low	38.1	Very low	114 Å²	114	118 Å²	118	74%	0.74	73%	0.727	S	S	*	*			trans	-77.5	153.6	171.7	32.8	-35	0	0	0	112.4
473	S	31.7	Very low	38.7	Very low	95 Å²	95	119.9 Å²	119.9	66%	0.664	73%	0.725	S	S	*	*			trans	22.2	102	160	59.5	0	0	0	0	117.8	A475	S473-A475 PolarHBondContact O-N 3.39Å
474	A	34.8	Very low	39.8	Very low	107 Å²	107	118.9 Å²	118.9	88%	0.884	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	33.1	177.5	0	0	0	0	0	115.2
475	A	38.6	Very low	41.5	Very low	85 Å²	85	113.3 Å²	113.3	70%	0.702	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.8	-15.3	178.8	0	0	0	0	0	113.7	S473	S473-A475 PolarHBondContact O-N 3.39Å
476	A	37.5	Very low	42.9	Very low	98 Å²	98	111.5 Å²	111.5	81%	0.81	65%	0.651	S	S	*	*	S	Bend	trans	-106.1	28.7	-169.3	0	0	0	0	0	114.6
477	A	37.3	Very low	44.3	Very low	86 Å²	86	111.1 Å²	111.1	71%	0.711	64%	0.642	S	S	*	*			trans	-130.8	8.8	-170.3	0	0	0	0	0	115.8
478	I	45.5	Very low	46.2	Very low	122 Å²	122	103 Å²	103	63%	0.626	61%	0.611	S	S	*	*			trans	-84.3	-25.1	-172.3	-64.5	176	0	0	0	112.9	K480	I478-K480 PolarHBondContact O-N 3.27Å
479	F	49.4	Very low	47.7	Very low	128 Å²	128	98.9 Å²	98.9	56%	0.561	58%	0.576	S	S	*	*			trans	-98.1	90.4	-177.5	-91.2	-89.6	0	0	0	114.3	H364 R482	H364-F479 AromaticContact NE2-CZ 3.46Å; H364-F479 WeakPolarHBondContact NE2-CZ 3.28Å; F479-R482 HydrophobicContact CD1-CB 4.06Å; F479-R482 HydrophobicContact CE1-CB 4.18Å
480	K	46	Very low	49.4	Very low	194 Å²	194	96.3 Å²	96.3	84%	0.843	56%	0.558	S	S	*	*	S	Bend	trans	-124.3	-15.6	154.2	-81	-168.9	172.3	-176.4	0	116.9	I478	I478-K480 PolarHBondContact O-N 3.27Å
481	P	53.1	Low	51.4	Low	43 Å²	43	93.3 Å²	93.3	28%	0.279	54%	0.539	S	S	.	.	S	Bend	trans	-88	-10	-174.9	36	-36.6	0	0	0	115.1	E423 E483 Q484 L485	E423-P481 VanDerWaalsContact OE1-CB 3.29Å; E423-P481 WeakPolarHBondContact OE1-CB 3.44Å; E423-P481 WeakPolarHBondContact OE1-CG 3.27Å; P481-E483 PolarHBondContact O-N 2.79Å; P481-E483 VanDerWaalsContact O-N 3.14Å; P481-Q484 CarbonylContact O-C 3.58Å; P481-Q484 WeakPolarHBondContact O-CA 3.25Å; P481-Q484 WeakPolarHBondContact O-CB 3.41Å; P481-Q484 PolarHBondContact O-N 3.4Å; P481-L485 PolarHBondContact O-N 3.49Å
482	R	57.1	Low	52.8	Low	91 Å²	91	87.6 Å²	87.6	34%	0.343	50%	0.502	S	S	.	.	H	α-helix	trans	-55.5	-35.7	-177.8	-166.3	177.8	-173.8	157.1	3.2	112.8	D362 F479 M486	D362-R482 IonicContact OD1-CZ 2.76Å; D362-R482 IonicContact OD1-NH1 2.72Å; D362-R482 PolarHBondContact OD1-NH1 2.93Å; D362-R482 IonicContact OD1-NH2 2.67Å; D362-R482 PolarHBondContact OD1-NH2 2.94Å; F479-R482 HydrophobicContact CD1-CB 4.06Å; F479-R482 HydrophobicContact CE1-CB 4.18Å; R482-M486 HydrophobicContact CG-CE 4.15Å; R482-M486 WeakPolarHBondContact O-CB 3.38Å; R482-M486 VanDerWaalsContact O-CG 3.28Å; R482-M486 WeakPolarHBondContact O-CG 3.39Å; R482-M486 PolarHBondContact O-N 2.86Å
483	E	56.8	Low	54.2	Low	153 Å²	153	87.9 Å²	87.9	72%	0.715	49%	0.492	S	S	*	.	H	α-helix	trans	-64.7	-42.1	172.5	-66	-174.8	165.3	0	0	112.4	P481 M486 L487	P481-E483 PolarHBondContact O-N 2.79Å; P481-E483 VanDerWaalsContact O-N 3.14Å; E483-M486 PolarHBondContact O-N 2.83Å; E483-L487 WeakPolarHBondContact O-CB 3.28Å; E483-L487 VanDerWaalsContact O-CG 3.24Å; E483-L487 WeakPolarHBondContact O-CG 3.18Å; E483-L487 PolarHBondContact O-N 2.75Å
484	Q	61.1	Low	56	Low	100 Å²	100	90.5 Å²	90.5	47%	0.467	49%	0.491	S	S	.	.	H	α-helix	trans	-68.6	-37.1	178.7	-170.5	171.3	3	0	0	111.8	P481 L487 R488	P481-Q484 CarbonylContact O-C 3.58Å; P481-Q484 WeakPolarHBondContact O-CA 3.25Å; P481-Q484 WeakPolarHBondContact O-CB 3.41Å; P481-Q484 PolarHBondContact O-N 3.4Å; Q484-L487 PolarHBondContact O-N 3.42Å; Q484-R488 WeakPolarHBondContact O-CG 3.32Å; Q484-R488 PolarHBondContact O-N 3.03Å
485	L	63.9	Low	57.4	Low	20 Å²	20	85.9 Å²	85.9	11%	0.105	45%	0.454	C	S	.	.	H	α-helix	trans	-65.7	-46.2	171.9	-168.4	72	0	0	0	111.2	L416 T419 L420 P481 L487 R488 A489	L416-L485 HydrophobicContact CD1-CD1 3.7Å; T419-L485 HydrophobicContact CG2-CD1 4.01Å; L420-L485 HydrophobicContact CD2-CD1 3.74Å; L420-L485 HydrophobicContact CD2-CD2 4.24Å; L420-L485 HydrophobicContact CG-CD1 3.97Å; P481-L485 PolarHBondContact O-N 3.49Å; L485-L487 PolarHBondContact O-N 2.96Å; L485-R488 PolarHBondContact O-N 3.06Å; L485-A489 WeakPolarHBondContact O-CB 3.07Å; L485-A489 PolarHBondContact O-N 2.81Å
486	M	62.5	Low	58.6	Low	74 Å²	74	82.6 Å²	82.6	37%	0.365	42%	0.424	S	S	.	.	H	α-helix	trans	-59.3	-41.9	173.6	-77.7	-177.4	-179.1	0	0	112.3	L359 R482 E483 N490	L359-M486 HydrophobicContact CD2-CG 4.29Å; R482-M486 HydrophobicContact CG-CE 4.15Å; R482-M486 WeakPolarHBondContact O-CB 3.38Å; R482-M486 VanDerWaalsContact O-CG 3.28Å; R482-M486 WeakPolarHBondContact O-CG 3.39Å; R482-M486 PolarHBondContact O-N 2.86Å; E483-M486 PolarHBondContact O-N 2.83Å; M486-N490 VanDerWaalsContact O-CB 3.29Å; M486-N490 WeakPolarHBondContact O-CB 3.48Å; M486-N490 PolarHBondContact O-N 2.56Å; M486-N490 PolarHBondContact O-ND2 3.09Å
487	L	65.8	Low	59.9	Low	126 Å²	126	85.9 Å²	85.9	66%	0.66	42%	0.415	S	S	*	.	H	α-helix	trans	-64.2	-42.1	177.4	-75.8	166.9	0	0	0	111.6	E483 Q484 L485 S491	E483-L487 WeakPolarHBondContact O-CB 3.28Å; E483-L487 VanDerWaalsContact O-CG 3.24Å; E483-L487 WeakPolarHBondContact O-CG 3.18Å; E483-L487 PolarHBondContact O-N 2.75Å; Q484-L487 PolarHBondContact O-N 3.42Å; L485-L487 PolarHBondContact O-N 2.96Å; L487-S491 WeakPolarHBondContact O-CB 3.49Å; L487-S491 PolarHBondContact O-N 2.88Å
488	R	70.1	Confident	61.2	Low	70 Å²	70	88.1 Å²	88.1	26%	0.264	41%	0.411	S	S	.	.	H	α-helix	trans	-67.4	-44	176.1	-73.5	176.3	169.2	145.6	-0.7	112.1	L416 T419 Q484 L485 N490 S491 L492	L416-R488 HydrophobicContact CD1-CB 3.85Å; T419-R488 VanDerWaalsContact CG2-NH1 3.28Å; T419-R488 WeakPolarHBondContact OG1-CD 3.1Å; T419-R488 VanDerWaalsContact OG1-CZ 3.23Å; T419-R488 PolarHBondContact OG1-NE 3.5Å; T419-R488 PolarHBondContact OG1-NH1 3.05Å; Q484-R488 WeakPolarHBondContact O-CG 3.32Å; Q484-R488 PolarHBondContact O-N 3.03Å; L485-R488 PolarHBondContact O-N 3.06Å; R488-N490 PolarHBondContact O-N 3.06Å; R488-S491 WeakPolarHBondContact O-CB 3.39Å; R488-S491 PolarHBondContact O-N 2.84Å; R488-L492 PolarHBondContact O-N 3.04Å
489	A	62.4	Low	62.1	Low	5 Å²	5	82.4 Å²	82.4	4%	0.041	38%	0.382	C	S	.	.	H	α-helix	trans	-62.7	-41.3	175.2	0	0	0	0	0	112.6	L485 L492 K493	L485-A489 WeakPolarHBondContact O-CB 3.07Å; L485-A489 PolarHBondContact O-N 2.81Å; A489-L492 PolarHBondContact O-N 3.3Å; A489-K493 PolarHBondContact O-N 3.18Å
490	N	63.5	Low	62.7	Low	78 Å²	78	78.1 Å²	78.1	42%	0.417	36%	0.364	S	S	.	.	H	α-helix	trans	-68.7	-32.2	174.7	-79.6	-61	0	0	0	112.5	M486 R488 K494	M486-N490 VanDerWaalsContact O-CB 3.29Å; M486-N490 WeakPolarHBondContact O-CB 3.48Å; M486-N490 PolarHBondContact O-N 2.56Å; M486-N490 PolarHBondContact O-ND2 3.09Å; R488-N490 PolarHBondContact O-N 3.06Å; N490-K494 WeakPolarHBondContact O-CG 3.36Å; N490-K494 PolarHBondContact O-N 2.53Å; N490-K494 VanDerWaalsContact O-N 3.17Å
491	S	72.7	Confident	63.6	Low	50 Å²	50	72.7 Å²	72.7	35%	0.35	34%	0.342	S	S	.	.	H	α-helix	trans	-66	-39	170.7	-172.3	0	0	0	0	112	L487 R488 K494 A495	L487-S491 WeakPolarHBondContact O-CB 3.49Å; L487-S491 PolarHBondContact O-N 2.88Å; R488-S491 WeakPolarHBondContact O-CB 3.39Å; R488-S491 PolarHBondContact O-N 2.84Å; S491-K494 PolarHBondContact O-N 3.28Å; S491-A495 PolarHBondContact O-N 2.86Å; S491-A495 VanDerWaalsContact O-N 3.16Å
492	L	65.3	Low	63.8	Low	0 Å²	0	73 Å²	73	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-66.1	-47.4	176.1	-176.7	68	0	0	0	111.2	L409 K412 L413 L416 R488 A489 K494 A495 I496	L409-L492 HydrophobicContact CD1-CD1 3.57Å; K412-L492 HydrophobicContact CB-CD1 4.09Å; L413-L492 HydrophobicContact CB-CD1 4.14Å; L413-L492 HydrophobicContact CD1-CD1 3.95Å; L413-L492 HydrophobicContact CD1-CD2 3.65Å; L413-L492 HydrophobicContact CD1-CG 4.46Å; L416-L492 HydrophobicContact CD2-CD2 3.72Å; R488-L492 PolarHBondContact O-N 3.04Å; A489-L492 PolarHBondContact O-N 3.3Å; L492-K494 PolarHBondContact O-N 3.08Å; L492-A495 PolarHBondContact O-N 3.32Å; L492-I496 HydrophobicContact CG-CD1 4.1Å; L492-I496 WeakPolarHBondContact O-CG1 3.4Å; L492-I496 PolarHBondContact O-N 2.8Å
493	K	63.9	Low	63.9	Low	120 Å²	120	69.9 Å²	69.9	52%	0.522	33%	0.331	S	S	.	.	H	α-helix	trans	-55.3	-38.3	176.2	-175.4	174.2	-179.3	174.6	0	112.4	L355 A489 R497	L355-K493 HydrophobicContact CD1-CB 4.42Å; L355-K493 HydrophobicContact CD1-CG 4.34Å; A489-K493 PolarHBondContact O-N 3.18Å; K493-R497 PolarHBondContact O-N 3.01Å
494	K	68.5	Low	64	Low	150 Å²	150	67.4 Å²	67.4	65%	0.652	32%	0.319	S	S	*	.	H	α-helix	trans	-68.1	-43.4	174.6	-74.7	-179.5	178.2	-173.9	0	112.8	N490 S491 L492 R497 Q498	N490-K494 WeakPolarHBondContact O-CG 3.36Å; N490-K494 PolarHBondContact O-N 2.53Å; N490-K494 VanDerWaalsContact O-N 3.17Å; S491-K494 PolarHBondContact O-N 3.28Å; L492-K494 PolarHBondContact O-N 3.08Å; K494-R497 PolarHBondContact O-N 3.41Å; K494-Q498 WeakPolarHBondContact O-CG 3.26Å; K494-Q498 PolarHBondContact O-N 3.37Å
495	A	65.2	Low	63.9	Low	11 Å²	11	67.4 Å²	67.4	9%	0.091	32%	0.318	C	S	.	.	H	α-helix	trans	-63.9	-41.8	178.8	0	0	0	0	0	112.3	L409 S491 L492 Q498 I499	L409-A495 HydrophobicContact CD1-CB 4.04Å; S491-A495 PolarHBondContact O-N 2.86Å; S491-A495 VanDerWaalsContact O-N 3.16Å; L492-A495 PolarHBondContact O-N 3.32Å; A495-Q498 PolarHBondContact O-N 3.39Å; A495-I499 PolarHBondContact O-N 3.36Å
496	I	62.7	Low	63.7	Low	15 Å²	15	67.2 Å²	67.2	8%	0.077	32%	0.318	C	S	.	.	H	α-helix	trans	-59.7	-50.4	174.7	-65.9	171.4	0	0	0	110.2	V351 V378 L409 L492 Q498 I499 I500	V351-I496 HydrophobicContact CG1-CD1 4.18Å; V378-I496 HydrophobicContact CG2-CD1 3.93Å; L409-I496 HydrophobicContact CD1-CD1 4.46Å; L409-I496 HydrophobicContact CD1-CG1 3.53Å; L409-I496 HydrophobicContact CD2-CG1 4.33Å; L492-I496 HydrophobicContact CG-CD1 4.1Å; L492-I496 WeakPolarHBondContact O-CG1 3.4Å; L492-I496 PolarHBondContact O-N 2.8Å; I496-Q498 VanDerWaalsContact C-N 3.27Å; I496-Q498 PolarHBondContact O-N 3.1Å; I496-I499 PolarHBondContact O-N 3.3Å; I496-I500 HydrophobicContact CG2-CD1 3.77Å; I496-I500 HydrophobicContact CG2-CG1 4.43Å; I496-I500 PolarHBondContact O-N 2.88Å
497	R	64.6	Low	63.2	Low	168 Å²	168	66.5 Å²	66.5	63%	0.634	32%	0.318	S	S	*	.	H	α-helix	trans	-61.9	-32.8	-179.2	-161.9	174.4	-166.5	-93.5	0.3	113	K493 K494 I499 E501	K493-R497 PolarHBondContact O-N 3.01Å; K494-R497 PolarHBondContact O-N 3.41Å; R497-I499 VanDerWaalsContact C-N 3.31Å; R497-I499 PolarHBondContact O-N 3.31Å; R497-E501 IonicContact NH1-OE2 2.67Å; R497-E501 VanDerWaalsContact O-CB 3.24Å; R497-E501 WeakPolarHBondContact O-CB 3.39Å; R497-E501 PolarHBondContact O-N 3.18Å
498	Q	64.4	Low	62.7	Low	133 Å²	133	65.8 Å²	65.8	62%	0.621	32%	0.315	S	S	*	.	H	α-helix	trans	-72.2	-19.1	176	-75.7	179.5	-44.2	0	0	114.5	K494 A495 I496	K494-Q498 WeakPolarHBondContact O-CG 3.26Å; K494-Q498 PolarHBondContact O-N 3.37Å; A495-Q498 PolarHBondContact O-N 3.39Å; I496-Q498 VanDerWaalsContact C-N 3.27Å; I496-Q498 PolarHBondContact O-N 3.1Å
499	I	64.8	Low	62	Low	2 Å²	2	67.9 Å²	67.9	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-85.4	-45.7	171.4	-73.7	158.7	0	0	0	109.6	F381 M402 K405 L409 A495 I496 R497 E501 H502 T503	F381-I499 HydrophobicContact CE1-CG2 4.11Å; F381-I499 HydrophobicContact CZ-CG2 4.46Å; M402-I499 HydrophobicContact SD-CG1 4.5Å; M402-I499 HydrophobicContact SD-CG2 4.06Å; K405-I499 HydrophobicContact CB-CD1 4.26Å; K405-I499 HydrophobicContact CB-CG1 3.87Å; L409-I499 HydrophobicContact CB-CD1 3.69Å; L409-I499 HydrophobicContact CD2-CD1 3.5Å; L409-I499 VanDerWaalsContact CD2-CD1 3.5Å; L409-I499 HydrophobicContact CG-CD1 4.18Å; A495-I499 PolarHBondContact O-N 3.36Å; I496-I499 PolarHBondContact O-N 3.3Å; R497-I499 VanDerWaalsContact C-N 3.31Å; R497-I499 PolarHBondContact O-N 3.31Å; I499-E501 PolarHBondContact O-N 2.86Å; I499-H502 WeakPolarHBondContact O-CB 3.23Å; I499-H502 PolarHBondContact O-N 3Å; I499-T503 PolarHBondContact O-N 3.44Å; I499-T503 PolarHBondContact O-OG1 3.03Å
500	I	61.8	Low	61.3	Low	37 Å²	37	72.1 Å²	72.1	19%	0.19	35%	0.347	C	S	.	.	H	α-helix	trans	-55.7	-52.1	175.3	-64.3	171.8	0	0	0	110.5	F381 I496 H502 T503 E504	F381-I500 HydrophobicContact CZ-CG1 4.45Å; I496-I500 HydrophobicContact CG2-CD1 3.77Å; I496-I500 HydrophobicContact CG2-CG1 4.43Å; I496-I500 PolarHBondContact O-N 2.88Å; I500-H502 PolarHBondContact O-N 3.46Å; I500-T503 PolarHBondContact O-N 2.93Å; I500-T503 VanDerWaalsContact O-N 3.08Å; I500-E504 HydrophobicContact CG2-CG 4.11Å; I500-E504 WeakPolarHBondContact CG2-OE1 3.42Å; I500-E504 WeakPolarHBondContact O-CB 3.46Å; I500-E504 VanDerWaalsContact O-CG 3.3Å; I500-E504 WeakPolarHBondContact O-CG 3.43Å; I500-E504 PolarHBondContact O-N 2.99Å
501	E	64.6	Low	60.6	Low	81 Å²	81	72.2 Å²	72.2	38%	0.379	35%	0.347	S	S	.	.	H	α-helix	trans	-66.1	-0	178.9	-153.1	-159.4	121.5	0	0	114.4	R497 I499 E504 K505	R497-E501 IonicContact NH1-OE2 2.67Å; R497-E501 VanDerWaalsContact O-CB 3.24Å; R497-E501 WeakPolarHBondContact O-CB 3.39Å; R497-E501 PolarHBondContact O-N 3.18Å; I499-E501 PolarHBondContact O-N 2.86Å; E501-E504 WeakPolarHBondContact CA-OE2 3.49Å; E501-K505 WeakPolarHBondContact O-CD 3.42Å; E501-K505 WeakPolarHBondContact O-CE 3.46Å; E501-K505 WeakPolarHBondContact O-CG 3.44Å; E501-K505 PolarHBondContact O-NZ 3.25Å; E501-K505 IonicContact OE1-NZ 3.93Å; E501-K505 PolarHBondContact OE1-NZ 2.73Å
502	H	59.2	Low	59.5	Low	50 Å²	50	72 Å²	72	23%	0.231	35%	0.348	C	S	.	.	H	α-helix	trans	-110.9	-34.6	174.1	-161.6	-73.6	0	0	0	112	M402 K405 I499 I500 A506	M402-H502 HydrophobicContact CE-CB 4.25Å; K405-H502 PolarHBondContact NZ-CD2 3.35Å; K405-H502 PolarHBondContact NZ-CE1 2.87Å; K405-H502 PolarHBondContact NZ-NE2 2.92Å; I499-H502 WeakPolarHBondContact O-CB 3.23Å; I499-H502 PolarHBondContact O-N 3Å; I500-H502 PolarHBondContact O-N 3.46Å; H502-A506 WeakPolarHBondContact O-CB 3.49Å; H502-A506 PolarHBondContact O-N 2.91Å; H502-A506 VanDerWaalsContact O-N 3.07Å
503	T	59.3	Low	58.6	Low	25 Å²	25	77.5 Å²	77.5	15%	0.153	37%	0.374	C	S	.	.	H	α-helix	trans	-68.6	-42.4	169.1	-56.6	0	0	0	0	110.8	I499 I500 K505 A506 V507	I499-T503 PolarHBondContact O-N 3.44Å; I499-T503 PolarHBondContact O-OG1 3.03Å; I500-T503 PolarHBondContact O-N 2.93Å; I500-T503 VanDerWaalsContact O-N 3.08Å; T503-K505 VanDerWaalsContact C-N 3.35Å; T503-K505 PolarHBondContact O-N 2.77Å; T503-A506 PolarHBondContact O-N 3.43Å; T503-V507 WeakPolarHBondContact O-CB 3.17Å; T503-V507 WeakPolarHBondContact O-CG2 3.32Å; T503-V507 PolarHBondContact O-N 3.09Å
504	E	58.1	Low	57.7	Low	100 Å²	100	76 Å²	76	47%	0.467	38%	0.375	S	S	.	.	H	α-helix	trans	-53.2	-50.7	172.5	-73.5	170.1	162.9	0	0	111	I500 E501 V507 D508	I500-E504 HydrophobicContact CG2-CG 4.11Å; I500-E504 WeakPolarHBondContact CG2-OE1 3.42Å; I500-E504 WeakPolarHBondContact O-CB 3.46Å; I500-E504 VanDerWaalsContact O-CG 3.3Å; I500-E504 WeakPolarHBondContact O-CG 3.43Å; I500-E504 PolarHBondContact O-N 2.99Å; E501-E504 WeakPolarHBondContact CA-OE2 3.49Å; E504-V507 PolarHBondContact O-N 2.68Å; E504-D508 PolarHBondContact O-N 2.91Å
505	K	59.2	Low	56.4	Low	101 Å²	101	75 Å²	75	44%	0.439	37%	0.373	S	S	.	.	H	α-helix	trans	-65.3	-42.4	179.9	-69.3	179.3	-168.5	123	0	112.8	E501 T503 V507 D508 E509	E501-K505 WeakPolarHBondContact O-CD 3.42Å; E501-K505 WeakPolarHBondContact O-CE 3.46Å; E501-K505 WeakPolarHBondContact O-CG 3.44Å; E501-K505 PolarHBondContact O-NZ 3.25Å; E501-K505 IonicContact OE1-NZ 3.93Å; E501-K505 PolarHBondContact OE1-NZ 2.73Å; T503-K505 VanDerWaalsContact C-N 3.35Å; T503-K505 PolarHBondContact O-N 2.77Å; K505-V507 VanDerWaalsContact C-N 3.27Å; K505-V507 PolarHBondContact O-N 2.91Å; K505-D508 PolarHBondContact O-N 2.98Å; K505-E509 WeakPolarHBondContact O-CB 3.23Å; K505-E509 PolarHBondContact O-N 2.71Å
506	A	58.7	Low	55.2	Low	15 Å²	15	81 Å²	81	12%	0.124	40%	0.399	C	S	.	.	H	α-helix	trans	-61.8	-37	176	0	0	0	0	0	112	Y389 H502 T503 Q510	Y389-A506 WeakPolarHBondContact OH-CB 3.44Å; H502-A506 WeakPolarHBondContact O-CB 3.49Å; H502-A506 PolarHBondContact O-N 2.91Å; H502-A506 VanDerWaalsContact O-N 3.07Å; T503-A506 PolarHBondContact O-N 3.43Å; A506-Q510 WeakPolarHBondContact O-CB 3.32Å; A506-Q510 WeakPolarHBondContact O-CG 3.24Å; A506-Q510 PolarHBondContact O-N 2.94Å
507	V	53.2	Low	53.8	Low	60 Å²	60	86.7 Å²	86.7	36%	0.364	43%	0.425	S	S	.	.	H	α-helix	trans	-70.9	-43	174.9	170.3	0	0	0	0	111.6	T503 E504 K505 E509 Q510 N511	T503-V507 WeakPolarHBondContact O-CB 3.17Å; T503-V507 WeakPolarHBondContact O-CG2 3.32Å; T503-V507 PolarHBondContact O-N 3.09Å; E504-V507 PolarHBondContact O-N 2.68Å; K505-V507 VanDerWaalsContact C-N 3.27Å; K505-V507 PolarHBondContact O-N 2.91Å; V507-E509 VanDerWaalsContact C-N 3.29Å; V507-E509 PolarHBondContact O-N 2.92Å; V507-Q510 PolarHBondContact O-N 3.32Å; V507-N511 VanDerWaalsContact O-CB 3.29Å; V507-N511 WeakPolarHBondContact O-CB 3.45Å; V507-N511 VanDerWaalsContact O-CG 3.23Å; V507-N511 PolarHBondContact O-N 3.05Å; V507-N511 PolarHBondContact O-ND2 3.36Å
508	D	53.8	Low	52.6	Low	110 Å²	110	83.5 Å²	83.5	59%	0.588	42%	0.424	S	S	*	.	H	α-helix	trans	-60.6	-38.2	173.5	-78.6	-21.8	0	0	0	112	E504 K505 N511 A512	E504-D508 PolarHBondContact O-N 2.91Å; K505-D508 PolarHBondContact O-N 2.98Å; D508-N511 PolarHBondContact O-N 3.45Å; D508-A512 WeakPolarHBondContact O-CB 3.26Å; D508-A512 PolarHBondContact O-N 3.12Å
509	E	57	Low	51.3	Low	115 Å²	115	85.4 Å²	85.4	54%	0.537	43%	0.43	S	S	.	.	H	α-helix	trans	-75.7	-38.9	-178.5	-162.1	144.1	-138.6	0	0	111.5	K505 V507 A512 Q513	K505-E509 WeakPolarHBondContact O-CB 3.23Å; K505-E509 PolarHBondContact O-N 2.71Å; V507-E509 VanDerWaalsContact C-N 3.29Å; V507-E509 PolarHBondContact O-N 2.92Å; E509-A512 PolarHBondContact O-N 3.47Å; E509-Q513 VanDerWaalsContact O-CG 3.3Å; E509-Q513 WeakPolarHBondContact O-CG 3.42Å; E509-Q513 PolarHBondContact O-N 2.95Å
510	Q	46.2	Very low	49.7	Very low	93 Å²	93	89.7 Å²	89.7	44%	0.435	46%	0.46	S	S	.	.	H	α-helix	trans	-63.2	-41.8	167.1	-75.6	-171.3	-41.5	0	0	112	N392 A506 V507 A512 Q513 T514	N392-Q510 PolarHBondContact ND2-NE2 3.48Å; A506-Q510 WeakPolarHBondContact O-CB 3.32Å; A506-Q510 WeakPolarHBondContact O-CG 3.24Å; A506-Q510 PolarHBondContact O-N 2.94Å; V507-Q510 PolarHBondContact O-N 3.32Å; Q510-A512 VanDerWaalsContact C-N 3.33Å; Q510-A512 PolarHBondContact O-N 3.43Å; Q510-Q513 PolarHBondContact O-N 3.41Å; Q510-T514 PolarHBondContact O-N 3.19Å; Q510-T514 PolarHBondContact O-OG1 3.11Å
511	N	50.6	Low	48.4	Very low	80 Å²	80	93.2 Å²	93.2	43%	0.428	48%	0.484	S	S	.	.	H	α-helix	trans	-61.6	-39.5	174.3	-79.1	-39.7	0	0	0	112	V507 D508 T514 Q515	V507-N511 VanDerWaalsContact O-CB 3.29Å; V507-N511 WeakPolarHBondContact O-CB 3.45Å; V507-N511 VanDerWaalsContact O-CG 3.23Å; V507-N511 PolarHBondContact O-N 3.05Å; V507-N511 PolarHBondContact O-ND2 3.36Å; D508-N511 PolarHBondContact O-N 3.45Å; N511-T514 PolarHBondContact O-N 3.05Å; N511-Q515 WeakPolarHBondContact O-CG 3.27Å; N511-Q515 PolarHBondContact O-N 3.38Å
512	A	49.2	Very low	46.9	Very low	45 Å²	45	92.7 Å²	92.7	37%	0.372	50%	0.5	S	S	.	.	H	α-helix	trans	-64.9	-42.2	175.2	0	0	0	0	0	112.1	D508 E509 Q510 Q515 Q516	D508-A512 WeakPolarHBondContact O-CB 3.26Å; D508-A512 PolarHBondContact O-N 3.12Å; E509-A512 PolarHBondContact O-N 3.47Å; Q510-A512 VanDerWaalsContact C-N 3.33Å; Q510-A512 PolarHBondContact O-N 3.43Å; A512-Q515 PolarHBondContact O-N 3.26Å; A512-Q516 WeakPolarHBondContact O-CG 3.15Å; A512-Q516 PolarHBondContact O-N 3.22Å
513	Q	45.2	Very low	45.5	Very low	117 Å²	117	101.3 Å²	101.3	55%	0.547	53%	0.531	S	S	.	.	H	α-helix	trans	-63.5	-43.5	174.3	-69.3	168.7	17.6	0	0	111.7	E509 Q510 Q515 Q516 H517	E509-Q513 VanDerWaalsContact O-CG 3.3Å; E509-Q513 WeakPolarHBondContact O-CG 3.42Å; E509-Q513 PolarHBondContact O-N 2.95Å; Q510-Q513 PolarHBondContact O-N 3.41Å; Q513-Q515 VanDerWaalsContact C-N 3.35Å; Q513-Q515 PolarHBondContact O-N 3.46Å; Q513-Q516 PolarHBondContact O-N 3.08Å; Q513-H517 PolarHBondContact O-N 3.19Å
514	T	45.5	Very low	43.8	Very low	87 Å²	87	105.4 Å²	105.4	53%	0.534	56%	0.56	S	S	.	*	H	α-helix	trans	-60.4	-42.1	174.8	-58.5	0	0	0	0	111.7	Q510 N511 H517 V518	Q510-T514 PolarHBondContact O-N 3.19Å; Q510-T514 PolarHBondContact O-OG1 3.11Å; N511-T514 PolarHBondContact O-N 3.05Å; T514-H517 PolarHBondContact O-N 3.13Å; T514-V518 WeakPolarHBondContact O-CG2 3.34Å; T514-V518 PolarHBondContact O-N 3.12Å; T514-V518 VanDerWaalsContact O-N 3.1Å
515	Q	42.4	Very low	42.3	Very low	130 Å²	130	109.8 Å²	109.8	61%	0.607	58%	0.58	S	S	*	*	H	α-helix	trans	-63.8	-40.8	175.2	-73.3	177.8	23.9	0	0	112.4	N511 A512 Q513 H517 V518 F519	N511-Q515 WeakPolarHBondContact O-CG 3.27Å; N511-Q515 PolarHBondContact O-N 3.38Å; A512-Q515 PolarHBondContact O-N 3.26Å; Q513-Q515 VanDerWaalsContact C-N 3.35Å; Q513-Q515 PolarHBondContact O-N 3.46Å; Q515-H517 VanDerWaalsContact C-N 3.35Å; Q515-H517 PolarHBondContact O-N 3.36Å; Q515-V518 PolarHBondContact O-N 3.1Å; Q515-F519 WeakPolarHBondContact O-CD2 3.48Å; Q515-F519 PolarHBondContact O-N 2.96Å; Q515-F519 VanDerWaalsContact O-N 3.16Å
516	Q	39.7	Very low	40.8	Very low	138 Å²	138	114 Å²	114	65%	0.645	60%	0.602	S	S	*	*	H	α-helix	trans	-62.4	-40.7	174.6	-72.1	-178.3	6.1	0	0	112.1	A512 Q513 V518 F519 S520	A512-Q516 WeakPolarHBondContact O-CG 3.15Å; A512-Q516 PolarHBondContact O-N 3.22Å; Q513-Q516 PolarHBondContact O-N 3.08Å; Q516-V518 VanDerWaalsContact C-N 3.34Å; Q516-V518 PolarHBondContact O-N 3.1Å; Q516-F519 PolarHBondContact O-N 3.49Å; Q516-S520 PolarHBondContact O-N 2.85Å; Q516-S520 VanDerWaalsContact O-N 3.16Å; Q516-S520 PolarHBondContact O-OG 3.12Å
517	H	33	Very low	39.3	Very low	134 Å²	134	121.9 Å²	121.9	62%	0.62	64%	0.636	S	S	*	*	H	α-helix	trans	-63	-39	177.1	-162.2	-96.4	0	0	0	112.3	Q513 T514 Q515 F519 S520 V521	Q513-H517 PolarHBondContact O-N 3.19Å; T514-H517 PolarHBondContact O-N 3.13Å; Q515-H517 VanDerWaalsContact C-N 3.35Å; Q515-H517 PolarHBondContact O-N 3.36Å; H517-F519 VanDerWaalsContact C-N 3.35Å; H517-F519 PolarHBondContact O-N 2.95Å; H517-S520 PolarHBondContact O-N 2.73Å; H517-V521 PolarHBondContact O-N 2.98Å
518	V	39.4	Very low	38.1	Very low	100 Å²	100	125.3 Å²	125.3	61%	0.606	66%	0.657	S	S	*	*	H	α-helix	trans	-63.6	-37	174.5	172	0	0	0	0	112.2	T514 Q515 Q516	T514-V518 WeakPolarHBondContact O-CG2 3.34Å; T514-V518 PolarHBondContact O-N 3.12Å; T514-V518 VanDerWaalsContact O-N 3.1Å; Q515-V518 PolarHBondContact O-N 3.1Å; Q516-V518 VanDerWaalsContact C-N 3.34Å; Q516-V518 PolarHBondContact O-N 3.1Å
519	F	36.2	Very low	36.7	Very low	173 Å²	173	123.3 Å²	123.3	76%	0.759	66%	0.663	S	S	*	*	H	α-helix	trans	-71.3	-28.7	176.7	-89.4	-76.9	0	0	0	113.9	Q515 Q516 H517	Q515-F519 WeakPolarHBondContact O-CD2 3.48Å; Q515-F519 PolarHBondContact O-N 2.96Å; Q515-F519 VanDerWaalsContact O-N 3.16Å; Q516-F519 PolarHBondContact O-N 3.49Å; H517-F519 VanDerWaalsContact C-N 3.35Å; H517-F519 PolarHBondContact O-N 2.95Å
520	S	31.2	Very low	35.2	Very low	92 Å²	92	125.5 Å²	125.5	64%	0.643	68%	0.677	S	S	*	*	H	α-helix	trans	-74.1	-31.4	178.3	-68	0	0	0	0	113.9	Q516 H517 G522	Q516-S520 PolarHBondContact O-N 2.85Å; Q516-S520 VanDerWaalsContact O-N 3.16Å; Q516-S520 PolarHBondContact O-OG 3.12Å; H517-S520 PolarHBondContact O-N 2.73Å; S520-G522 VanDerWaalsContact C-N 3.31Å; S520-G522 PolarHBondContact O-N 2.87Å
521	V	34.3	Very low	34.3	Very low	112 Å²	112	126 Å²	126	68%	0.679	69%	0.686	S	S	*	*	H	α-helix	trans	-73.5	-22.4	-179.3	175.9	0	0	0	0	112.6	H517 R523	H517-V521 PolarHBondContact O-N 2.98Å; V521-R523 PolarHBondContact O-N 3.44Å
522	G	34	Very low	33.1	Very low	70 Å²	70	129.2 Å²	129.2	72%	0.722	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	5.3	-172.6	0	0	0	0	0	117.1	S520	S520-G522 VanDerWaalsContact C-N 3.31Å; S520-G522 PolarHBondContact O-N 2.87Å
523	R	28.6	Very low	32	Very low	231 Å²	231	134.6 Å²	134.6	87%	0.872	72%	0.716	S	S	*	*	S	Bend	trans	-148.3	39.4	-163	-144.8	-170.2	-179.3	-161.9	-1.6	119.5	V521	V521-R523 PolarHBondContact O-N 3.44Å
524	S	25	Very low	31	Very low	111 Å²	111	137.6 Å²	137.6	78%	0.776	73%	0.73	S	S	*	*			trans	-161.9	98.9	160.7	39.3	0	0	0	0	116.1
525	E	27.1	Very low	30.1	Very low	191 Å²	191	141.3 Å²	141.3	89%	0.893	74%	0.741	S	S	*	*	S	Bend	trans	-118.1	148.9	141.4	-74	-162.1	127.1	0	0	108.9
526	Q	26.3	Very low	29.2	Very low	191 Å²	191	143.9 Å²	143.9	89%	0.893	75%	0.753	S	S	*	*	S	Bend	trans	67.6	50	172.3	-56.1	-171.1	-3.5	0	0	118.3
527	Q	28.1	Very low	28.5	Very low	180 Å²	180	146 Å²	146	84%	0.841	76%	0.763	S	S	*	*				27.7	132.1	111.6	-156	-173.5	11.5	0	0	120.3
528	V	27	Very low	28.2	Very low	131 Å²	131	147 Å²	147	79%	0.794	77%	0.773	S	S	*	*				167.7	116.5	112.2	161.6	0	0	0	0	112.5
529	G	25.9	Very low	27.6	Very low	69 Å²	69	145.3 Å²	145.3	71%	0.711	78%	0.776	S	S	*	*			trans	68.9	149.1	152.5	0	0	0	0	0	119.4
530	L	24.4	Very low	27.2	Very low	161 Å²	161	145.6 Å²	145.6	84%	0.843	78%	0.78	S	S	*	*			cis	-147.7	139	-9	-79.3	167.4	0	0	0	105.5
531	V	26.8	Very low	27	Very low	102 Å²	102	149.3 Å²	149.3	62%	0.618	79%	0.787	S	S	*	*				60.1	113.2	71.6	-176.3	0	0	0	0	113.7
532	E	26.9	Very low	26.6	Very low	149 Å²	149	149.7 Å²	149.7	70%	0.696	79%	0.785	S	S	*	*			cis	-131	-122.8	-24.9	-137.5	69	-91.3	0	0	111.6
533	E	25.4	Very low	26.3	Very low	158 Å²	158	153.9 Å²	153.9	74%	0.738	78%	0.783	S	S	*	*			cis	-142.6	148.6	-0.3	-68.9	92	-110.1	0	0	107.7
534	E	23.8	Very low	26	Very low	180 Å²	180	148.2 Å²	148.2	84%	0.841	78%	0.779	S	S	*	*				46.5	143	89.7	-61	-178.5	166.8	0	0	116.6
535	E	25.7	Very low	25.9	Very low	164 Å²	164	148.2 Å²	148.2	77%	0.766	78%	0.779	S	S	*	*			cis	-158.7	150.1	22.8	-154.6	172.1	-144.3	0	0	113.9
536	E	24.3	Very low	25.8	Very low	184 Å²	184	146.6 Å²	146.6	86%	0.86	78%	0.775	S	S	*	*			trans	42	169.3	153.3	-73.4	-168	173	0	0	128
537	E	25.6	Very low	25.6	Very low	184 Å²	184	145.7 Å²	145.7	86%	0.86	77%	0.771	S	S	*	*			trans	-82.8	-173.1	-179.7	-55.1	176.2	121.9	0	0	110.9
538	D	25.5	Very low	25.3	Very low	154 Å²	154	141.9 Å²	141.9	82%	0.824	76%	0.764	S	S	*	*			cis	-161.6	-177.5	15.3	-164.8	-0.5	0	0	0	109.4
539	G	27.1	Very low	25	Very low	64 Å²	64	139.9 Å²	139.9	66%	0.66	76%	0.756	S	S	*	*			trans	124.3	67.1	153.4	0	0	0	0	0	120.4
540	E	27.4	Very low	24.9	Very low	180 Å²	180	145.9 Å²	145.9	84%	0.841	76%	0.763	S	S	*	*			trans	48.5	153.2	133.3	-79.9	-165.3	144.1	0	0	127.1
541	E	27	Very low	24.9	Very low	170 Å²	170	143.1 Å²	143.1	79%	0.794	76%	0.757	S	S	*	*			trans	64.9	72	154.3	-63.2	-150.7	138.7	0	0	124.2
542	D	26.4	Very low	24.7	Very low	119 Å²	119	143.2 Å²	143.2	64%	0.636	76%	0.762	S	S	*	*				66.2	146.6	101.9	-151.6	14.6	0	0	0	124.5
543	K	27.3	Very low	24.5	Very low	159 Å²	159	144.8 Å²	144.8	69%	0.691	77%	0.767	S	S	*	*			trans	59.6	99.9	159.7	-83.8	149.2	-160.3	148.9	0	123.2
544	S	23.2	Very low	24.5	Very low	111 Å²	111	143.9 Å²	143.9	78%	0.776	76%	0.763	S	S	*	*				62.1	141.8	121.6	73.1	0	0	0	0	120.5
545	S	22.5	Very low	24.5	Very low	111 Å²	111	145.8 Å²	145.8	78%	0.776	76%	0.762	S	S	*	*			cis	-163.4	170.1	43.9	56.1	0	0	0	0	115.7
546	L	25	Very low	24.5	Very low	157 Å²	157	142.8 Å²	142.8	82%	0.822	76%	0.76	S	S	*	*			trans	-42	147.8	170.2	-56	148.2	0	0	0	113.3
547	Q	22.1	Very low	24.5	Very low	173 Å²	173	139.4 Å²	139.4	81%	0.808	76%	0.756	S	S	*	*				-167.9	158.8	60.5	-85.9	-171.5	-12.9	0	0	113.8
548	S	21.5	Very low	24.3	Very low	99 Å²	99	142.9 Å²	142.9	69%	0.692	76%	0.761	S	S	*	*			trans	33.4	146.1	135.1	119.1	0	0	0	0	121.5
549	S	21.9	Very low	24.2	Very low	90 Å²	90	146.3 Å²	146.3	63%	0.629	76%	0.763	S	S	*	*			cis	-169.1	158.3	22.2	-96.1	0	0	0	0	112.5
550	F	23.8	Very low	24	Very low	194 Å²	194	150.3 Å²	150.3	85%	0.851	77%	0.768	S	S	*	*			trans	29.6	151.3	146.4	-71	-105	0	0	0	122.8
551	S	24.2	Very low	23.8	Very low	103 Å²	103	145.8 Å²	145.8	72%	0.72	76%	0.757	S	S	*	*			cis	173.9	141	-16.7	172.4	0	0	0	0	110.3
552	S	21.6	Very low	23.7	Very low	104 Å²	104	147.3 Å²	147.3	73%	0.727	76%	0.761	S	S	*	*			trans	-159.5	128.6	151.9	69.3	0	0	0	0	115.9
553	K	23.9	Very low	23.5	Very low	182 Å²	182	147.8 Å²	147.8	79%	0.791	77%	0.768	S	S	*	*				41.3	143.2	127.1	-60.6	177.8	-177.7	171	0	120.5
554	Q	24.5	Very low	23.8	Very low	139 Å²	139	146.5 Å²	146.5	65%	0.65	78%	0.776	S	S	*	*			cis	-170.6	151.9	0.4	-122.4	178.6	-51.4	0	0	114.5
555	R	25.1	Very low	23.7	Very low	220 Å²	220	146.9 Å²	146.9	83%	0.83	78%	0.777	S	S	*	*			trans	66.5	160.4	146.3	-83.2	-173.7	167.2	171.5	-3.8	119.6
556	S	24.2	Very low	23.8	Very low	102 Å²	102	148.3 Å²	148.3	71%	0.713	77%	0.772	S	S	*	*			cis	-174.3	173.1	-11.8	45.6	0	0	0	0	110.9
557	S	24.5	Very low	23.8	Very low	113 Å²	113	148.3 Å²	148.3	79%	0.79	77%	0.765	S	S	*	*			cis	161.7	127.9	-33.3	-177.2	0	0	0	0	109.6
558	R	22.8	Very low	23.9	Very low	256 Å²	256	147.2 Å²	147.2	97%	0.966	76%	0.764	S	S	*	*			trans	-150.7	169.6	173.7	-103.5	169.9	-161.4	-155.8	3.8	113.1
559	R	23.1	Very low	24	Very low	226 Å²	226	149.4 Å²	149.4	85%	0.853	77%	0.766	S	S	*	*			trans	-159.5	168	-154.7	-171.1	-162.8	-94.7	-160.1	-5.9	112.6
560	L	23.2	Very low	24.1	Very low	148 Å²	148	152.5 Å²	152.5	78%	0.775	77%	0.771	S	S	*	*			trans	103.7	157.3	154.7	-59.2	169.3	0	0	0	117.5
561	S	23	Very low	24.2	Very low	85 Å²	85	152.6 Å²	152.6	59%	0.594	77%	0.771	S	S	*	*			cis	175.6	157.6	-37.4	59.9	0	0	0	0	113.3
562	K	23.4	Very low	24.2	Very low	202 Å²	202	151.7 Å²	151.7	88%	0.878	78%	0.778	S	S	*	*			trans	119.7	164.7	150.5	-70	179.7	179.2	-177.3	0	120
563	T	23.3	Very low	24.2	Very low	130 Å²	130	150 Å²	150	80%	0.798	78%	0.777	S	S	*	*			trans	-123.1	178.7	-170.5	59.8	0	0	0	0	111.4
564	P	32.8	Very low	24.2	Very low	132 Å²	132	149.2 Å²	149.2	86%	0.857	78%	0.78	S	S	*	*				-149.2	-147.8	79.9	40.5	-18.2	0	0	0	115.5
565	C	21.6	Very low	24.3	Very low	118 Å²	118	149.6 Å²	149.6	80%	0.797	79%	0.786	S	S	*	*			trans	-141.4	162.3	-159.2	176.8	0	0	0	0	112.6
566	E	24.3	Very low	25	Very low	142 Å²	142	144.8 Å²	144.8	66%	0.664	78%	0.783	S	S	*	*			trans	176.8	147.8	134.9	-101.9	-167	150.8	0	0	118.2
567	K	25	Very low	25	Very low	156 Å²	156	143.1 Å²	143.1	68%	0.678	78%	0.782	S	S	*	*			trans	65	157.2	143.7	-70.7	167.8	179.3	149	0	122.4
568	L	24.2	Very low	25	Very low	150 Å²	150	143.1 Å²	143.1	79%	0.785	78%	0.782	S	S	*	*			cis	-172.6	169.2	-34.8	-144.1	140	0	0	0	110.9
569	I	24.6	Very low	25.1	Very low	145 Å²	145	136.5 Å²	136.5	74%	0.744	78%	0.775	S	S	*	*			trans	96.5	107.3	157.4	-56.4	179.9	0	0	0	122.4
570	H	23.6	Very low	25.2	Very low	156 Å²	156	130.1 Å²	130.1	72%	0.722	77%	0.771	S	S	*	*			trans	33.1	138.8	135.7	-76.7	-48.2	0	0	0	129.7
571	K	25.9	Very low	25.2	Very low	196 Å²	196	128.5 Å²	128.5	85%	0.852	77%	0.772	S	S	*	*				53.7	132.8	129.4	-70.7	178.1	173.2	-179.9	0	122.9
572	G	23.7	Very low	25.3	Very low	84 Å²	84	132.4 Å²	132.4	87%	0.866	79%	0.785	S	S	*	*			trans	-176.1	152.3	151.7	0	0	0	0	0	111.7
573	G	22.2	Very low	25.6	Very low	69 Å²	69	128.2 Å²	128.2	71%	0.711	78%	0.778	S	S	*	*			trans	172.1	172.9	176.3	0	0	0	0	0	114.7
574	L	24.1	Very low	25.6	Very low	165 Å²	165	128 Å²	128	86%	0.864	78%	0.777	S	S	*	*			trans	71.1	151.5	-175.6	-47.8	179.6	0	0	0	114.4
575	L	25.4	Very low	25.1	Very low	146 Å²	146	129.7 Å²	129.7	76%	0.764	77%	0.773	S	S	*	*			cis	-146.6	-122.5	-17.5	-107.2	168.8	0	0	0	110.5
576	P	40.6	Very low	25.2	Very low	120 Å²	120	130.8 Å²	130.8	78%	0.779	78%	0.776	S	S	*	*				-133.7	-179.8	-111.5	43.4	-26.8	0	0	0	118.2
577	G	23.4	Very low	25.1	Very low	67 Å²	67	127.7 Å²	127.7	69%	0.691	78%	0.783	S	S	*	*			trans	129.6	143.9	151.8	0	0	0	0	0	114.6
578	S	25.2	Very low	25.2	Very low	113 Å²	113	126 Å²	126	79%	0.79	79%	0.791	S	S	*	*			cis	-159.2	152.7	-10	-97.7	0	0	0	0	111.5
579	S	25.3	Very low	25.2	Very low	116 Å²	116	129 Å²	129	81%	0.811	79%	0.791	S	S	*	*				27.3	139.7	129.8	-43.1	0	0	0	0	120.2
580	A	24.8	Very low	25.4	Very low	92 Å²	92	127.5 Å²	127.5	76%	0.76	79%	0.785	S	S	*	*			cis	-164.5	-166.7	-1.5	0	0	0	0	0	107.9
581	S	23.5	Very low	25.5	Very low	115 Å²	115	128.6 Å²	128.6	80%	0.804	80%	0.796	S	S	*	*			cis	-157.8	-173.3	17.2	-40.4	0	0	0	0	112.3
582	L	24.2	Very low	25.5	Very low	166 Å²	166	126.7 Å²	126.7	87%	0.869	79%	0.792	S	S	*	*			trans	-92.6	158.8	169.4	-65.8	170.4	0	0	0	110.8
583	P	30.6	Very low	25.8	Very low	114 Å²	114	127.9 Å²	127.9	74%	0.74	78%	0.784	S	S	*	*				-155	154.3	68.4	40	-18.1	0	0	0	121.1
584	V	22.7	Very low	26	Very low	127 Å²	127	133 Å²	133	77%	0.77	79%	0.792	S	S	*	*			trans	67.8	138.1	137.8	177	0	0	0	0	123.1
585	H	22.8	Very low	26.2	Very low	166 Å²	166	131.6 Å²	131.6	77%	0.769	79%	0.785	S	S	*	*			trans	-32.7	156.1	174.7	-41.4	148.8	0	0	0	118.1
586	T	22.7	Very low	26.3	Very low	141 Å²	141	131.5 Å²	131.5	87%	0.865	79%	0.785	S	S	*	*				-166.4	164.4	52.3	45.2	0	0	0	0	112.8
587	G	21.6	Very low	25.7	Very low	78 Å²	78	132.1 Å²	132.1	80%	0.804	79%	0.787	S	S	*	*			trans	126.4	114.4	154.5	0	0	0	0	0	116.2
588	S	27.2	Very low	25.8	Very low	120 Å²	120	137.6 Å²	137.6	84%	0.839	79%	0.791	S	S	*	*			trans	-69.5	143.1	178.2	177.2	0	0	0	0	113.6
589	R	26.1	Very low	25.9	Very low	212 Å²	212	140.1 Å²	140.1	80%	0.8	79%	0.794	S	S	*	*			trans	-170.4	149.5	134.9	-104.3	175.1	80.7	157.2	9.5	114.4
590	D	27	Very low	25.8	Very low	115 Å²	115	142 Å²	142	62%	0.615	80%	0.795	S	S	*	*			trans	50.2	98.7	150.6	-50.4	-20	0	0	0	120
591	N	27.2	Very low	25.7	Very low	178 Å²	178	148.6 Å²	148.6	95%	0.952	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-76.3	125.9	166.1	-91.1	-21.9	0	0	0	111.7
592	M	25.5	Very low	25.8	Very low	157 Å²	157	148.7 Å²	148.7	77%	0.773	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-103.2	128.2	177.3	-126.8	-70.6	-68.9	0	0	110.5
593	P	29.7	Very low	25.8	Very low	108 Å²	108	144.7 Å²	144.7	70%	0.701	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-70.9	145	172.1	29.3	-34	0	0	0	111.4
594	M	26.1	Very low	25.5	Very low	177 Å²	177	145.9 Å²	145.9	87%	0.872	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-90.4	135.9	-169.1	-60.9	174.6	67.4	0	0	112.8
595	L	29	Very low	25.7	Very low	135 Å²	135	148.3 Å²	148.3	71%	0.707	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-103.7	123.3	160.5	-73.6	170.3	0	0	0	108.8
596	N	27.1	Very low	25.8	Very low	145 Å²	145	146.7 Å²	146.7	78%	0.775	81%	0.813	S	S	*	*			trans	-105	106.4	-172.8	-172.3	5.9	0	0	0	111.2
597	T	28.5	Very low	25.9	Very low	132 Å²	132	145.5 Å²	145.5	81%	0.81	81%	0.811	S	S	*	*			trans	-96	103	-172.1	-45.2	0	0	0	0	112.1
598	K	25	Very low	26	Very low	182 Å²	182	147.5 Å²	147.5	79%	0.791	81%	0.812	S	S	*	*			trans	-143.1	92.3	170.4	-85.5	-170.1	175.7	175.7	0	114.1
599	I	26.8	Very low	26.2	Very low	166 Å²	166	144.6 Å²	144.6	85%	0.851	79%	0.792	S	S	*	*			trans	-130.7	137.3	148.5	-61.6	-177.5	0	0	0	106.4
600	L	24.9	Very low	26.6	Very low	156 Å²	156	140.1 Å²	140.1	82%	0.817	79%	0.788	S	S	*	*			trans	-91.6	137.8	-174	-71.6	90.7	0	0	0	112.4
601	Y	21.2	Very low	26.9	Very low	231 Å²	231	140.5 Å²	140.5	91%	0.906	79%	0.789	S	S	*	*			trans	-84	145.1	158.6	-89.5	-93.8	0	0	0	111.1
602	P	26.3	Very low	27.1	Very low	117 Å²	117	137 Å²	137	76%	0.76	77%	0.774	S	S	*	*			trans	-119	133.2	155	34.7	-23.4	0	0	0	112.7
603	G	24	Very low	27.2	Very low	82 Å²	82	139.9 Å²	139.9	85%	0.845	78%	0.776	S	S	*	*			trans	78.4	102.5	151	0	0	0	0	0	118.6
604	T	25.3	Very low	27.1	Very low	139 Å²	139	141.3 Å²	141.3	85%	0.853	78%	0.777	S	S	*	*			trans	-71.7	132	160.5	46.8	0	0	0	0	111.8
605	L	26.4	Very low	27.4	Very low	177 Å²	177	140.1 Å²	140.1	93%	0.927	77%	0.773	S	S	*	*			trans	-130.6	158.3	155.3	-85.5	174.2	0	0	0	110
606	T	24.5	Very low	27.5	Very low	133 Å²	133	139 Å²	139	82%	0.816	77%	0.772	S	S	*	*			trans	-112.7	157.4	-161.8	52.2	0	0	0	0	113.7
607	S	24.1	Very low	27.7	Very low	116 Å²	116	138.9 Å²	138.9	81%	0.811	77%	0.772	S	S	*	*			trans	112.4	130.1	159.1	-164.4	0	0	0	0	116.3
608	S	24.7	Very low	27.6	Very low	119 Å²	119	136.2 Å²	136.2	83%	0.832	76%	0.763	S	S	*	*			trans	63.8	140.9	170	-147.4	0	0	0	0	117.3
609	S	31.3	Very low	27.8	Very low	60 Å²	60	135.1 Å²	135.1	42%	0.42	77%	0.766	S	S	.	*			cis	-130.3	170.5	2.6	78.5	0	0	0	0	112	I611	S609-I611 VanDerWaalsContact C-N 3.27Å; S609-I611 PolarHBondContact O-N 3.29Å; S609-I611 PolarHBondContact OG-N 3.3Å
610	V	33.4	Very low	28.1	Very low	118 Å²	118	131.5 Å²	131.5	72%	0.715	75%	0.753	S	S	*	*	S	Bend	trans	-71	-21.8	-179.3	-179.8	0	0	0	0	112.7	T612 R613	V610-T612 VanDerWaalsContact C-N 3.33Å; V610-T612 PolarHBondContact O-N 3.47Å; V610-R613 PolarHBondContact O-N 3.18Å; V610-R613 VanDerWaalsContact O-N 3.1Å
611	I	35.1	Very low	28.3	Very low	123 Å²	123	132.2 Å²	132.2	63%	0.631	75%	0.75	S	S	*	*	G	3₁₀ helix	trans	-61.7	-38.8	-169.6	-60.9	172.3	0	0	0	111.9	S609 R613 L614	S609-I611 VanDerWaalsContact C-N 3.27Å; S609-I611 PolarHBondContact O-N 3.29Å; S609-I611 PolarHBondContact OG-N 3.3Å; I611-R613 PolarHBondContact O-N 3.11Å; I611-R613 VanDerWaalsContact O-N 3.14Å; I611-L614 PolarHBondContact O-N 3.16Å
612	T	30	Very low	28.7	Very low	105 Å²	105	126.8 Å²	126.8	64%	0.644	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-66.2	-15.6	-179.4	-42.9	0	0	0	0	113.7	V610	V610-T612 VanDerWaalsContact C-N 3.33Å; V610-T612 PolarHBondContact O-N 3.47Å
613	R	28.9	Very low	28.9	Very low	217 Å²	217	126 Å²	126	82%	0.819	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-88.4	-7.8	177.5	-78.2	-168.5	170.5	-164.5	-3.5	114.9	V610 I611	V610-R613 PolarHBondContact O-N 3.18Å; V610-R613 VanDerWaalsContact O-N 3.1Å; I611-R613 PolarHBondContact O-N 3.11Å; I611-R613 VanDerWaalsContact O-N 3.14Å
614	L	27.6	Very low	29.3	Very low	137 Å²	137	128.8 Å²	128.8	72%	0.717	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-16.1	178.2	-76	164.9	0	0	0	113.7	I611	I611-L614 PolarHBondContact O-N 3.16Å
615	L	30.9	Very low	30	Very low	152 Å²	152	126.1 Å²	126.1	80%	0.796	73%	0.729	S	S	*	*	S	Bend	trans	-95.4	12.7	-179.2	-70.4	169.9	0	0	0	114.4
616	V	32.3	Very low	30.9	Very low	111 Å²	111	124.4 Å²	124.4	67%	0.673	72%	0.721	S	S	*	*	S	Bend	trans	-112.6	-19.1	179.3	-179.3	0	0	0	0	112.5
617	N	30.6	Very low	32.2	Very low	144 Å²	144	122.1 Å²	122.1	77%	0.77	70%	0.704	S	S	*	*	S	Bend	trans	-116.1	64.8	-178.6	-73.8	18.2	0	0	0	111
618	A	26.7	Very low	33.9	Very low	75 Å²	75	119.9 Å²	119.9	62%	0.62	68%	0.682	S	S	*	*			trans	-142.3	83.7	170.6	0	0	0	0	0	109.6	P620	A618-P620 WeakPolarHBondContact O-CD 3.16Å
619	D	29.4	Very low	35.6	Very low	160 Å²	160	121.3 Å²	121.3	86%	0.856	68%	0.68	S	S	*	*			trans	-93.9	92	167.2	-79	-45.1	0	0	0	110.2
620	P	32	Very low	37.7	Very low	90 Å²	90	121.3 Å²	121.3	58%	0.584	68%	0.679	S	S	*	*			trans	-79.7	128	154.4	33.2	-30.6	0	0	0	108.8	A618	A618-P620 WeakPolarHBondContact O-CD 3.16Å
621	F	29.5	Very low	40.1	Very low	170 Å²	170	117.4 Å²	117.4	75%	0.746	65%	0.652	S	S	*	*			trans	74.1	70	175.4	-49.7	-72.3	0	0	0	116.9	C623	F621-C623 PolarHBondContact O-N 3.41Å
622	S	30.7	Very low	42.7	Very low	118 Å²	118	115.4 Å²	115.4	83%	0.825	65%	0.645	S	S	*	*			trans	-61.8	80.4	145.3	172.8	0	0	0	0	110.5
623	C	30.7	Very low	45.6	Very low	99 Å²	99	114.7 Å²	114.7	67%	0.669	64%	0.635	S	S	*	*			trans	-90.2	131.5	162.4	-64.1	0	0	0	0	108.6	F621 A625	F621-C623 PolarHBondContact O-N 3.41Å; C623-A625 PolarHBondContact O-N 2.64Å
624	D	30.8	Very low	48.5	Very low	141 Å²	141	109.6 Å²	109.6	75%	0.754	62%	0.618	S	S	*	*			trans	-56.8	121.4	-172.9	-66.2	-70.9	0	0	0	112.9	D626 N627	D624-D626 PolarHBondContact O-N 3.03Å; D624-N627 PolarHBondContact O-N 3.03Å
625	A	40.9	Very low	51.5	Low	84 Å²	84	104.4 Å²	104.4	69%	0.694	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	-10.1	-167.5	0	0	0	0	0	115.4	C623	C623-A625 PolarHBondContact O-N 2.64Å
626	D	45.8	Very low	54.5	Low	140 Å²	140	98.1 Å²	98.1	75%	0.749	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	2.6	-176.3	-77.1	-44.4	0	0	0	114.4	D624 M628	D624-D626 PolarHBondContact O-N 3.03Å; D626-M628 VanDerWaalsContact C-N 3.34Å; D626-M628 PolarHBondContact O-N 3.22Å
627	N	51.1	Low	57.4	Low	85 Å²	85	92.8 Å²	92.8	46%	0.455	53%	0.529	S	S	.	.			trans	-73.9	85.1	179.6	-158.9	48.7	0	0	0	111.9	D624 D629 C630	D624-N627 PolarHBondContact O-N 3.03Å; N627-D629 PolarHBondContact O-N 2.79Å; N627-C630 PolarHBondContact O-N 3.08Å
628	M	58.9	Low	60.4	Low	70 Å²	70	86.3 Å²	86.3	35%	0.345	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-64.4	-22.3	-174	-68.2	-85.7	66.6	0	0	113.9	D626 C630 Y631 K802	D626-M628 VanDerWaalsContact C-N 3.34Å; D626-M628 PolarHBondContact O-N 3.22Å; M628-C630 PolarHBondContact O-N 3.48Å; M628-Y631 HydrophobicContact CE-CD2 3.52Å; M628-Y631 HydrophobicContact CE-CE2 3.86Å; M628-Y631 HydrophobicContact CE-CG 4.01Å; M628-Y631 PolarHBondContact O-N 2.89Å; M628-K802 HydrophobicContact CE-CD 4.15Å
629	D	61	Low	63.5	Low	149 Å²	149	82.9 Å²	82.9	80%	0.797	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-58.9	-19.3	179.5	-62.8	-10.5	0	0	0	114	N627	N627-D629 PolarHBondContact O-N 2.79Å
630	C	76.3	Confident	66.6	Low	59 Å²	59	76.3 Å²	76.3	40%	0.399	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-81.5	-15.6	175.4	-61.6	0	0	0	0	114	Y318 N627 M628	Y318-C630 HydrophobicContact CD2-CB 4.03Å; Y318-C630 WeakPolarHBondContact CD2-O 3.2Å; Y318-C630 HydrophobicContact CE2-CB 4.07Å; Y318-C630 HydrophobicContact CG-CB 4.4Å; N627-C630 PolarHBondContact O-N 3.08Å; M628-C630 PolarHBondContact O-N 3.48Å
631	Y	83.8	Confident	69.5	Low	36 Å²	36	72 Å²	72	14%	0.141	40%	0.401	C	S	.	.			trans	-97.6	137.8	-175.9	-73.5	-101	0	0	0	112.2	M316 M628 K802	M316-Y631 HydrophobicContact CB-CD1 4.03Å; M316-Y631 HydrophobicContact CB-CG 4.5Å; M628-Y631 HydrophobicContact CE-CD2 3.52Å; M628-Y631 HydrophobicContact CE-CE2 3.86Å; M628-Y631 HydrophobicContact CE-CG 4.01Å; M628-Y631 PolarHBondContact O-N 2.89Å; Y631-K802 HydrophobicContact CD1-CB 4.38Å; Y631-K802 HydrophobicContact CE1-CB 3.96Å; Y631-K802 HydrophobicContact CE1-CD 4.46Å
632	T	88.8	Confident	72.5	Confident	82 Å²	82	64 Å²	64	50%	0.503	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	133.3	175.8	59.9	0	0	0	0	111	M316 V317 K634	M316-T632 CarbonylContact C-O 3.47Å; M316-T632 WeakPolarHBondContact CA-O 3.28Å; V317-T632 PolarHBondContact N-O 3.07Å; V317-T632 PolarHBondContact O-N 3.44Å; V317-T632 PolarHBondContact O-OG1 2.71Å; T632-K634 PolarHBondContact O-N 2.8Å
633	E	90.6	Very high	75.5	Confident	90 Å²	90	58.4 Å²	58.4	42%	0.421	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	117.2	169.8	179.9	168.3	-121.4	0	0	109.2	S314 M316 K806	S314-E633 VanDerWaalsContact CB-OE1 3.29Å; S314-E633 WeakPolarHBondContact CB-OE1 3.47Å; S314-E633 VanDerWaalsContact OG-CD 3.32Å; S314-E633 WeakPolarHBondContact OG-CG 3.44Å; S314-E633 PolarHBondContact OG-OE1 3.4Å; M316-E633 VanDerWaalsContact SD-CA 3.59Å; M316-E633 HydrophobicContact SD-CB 3.68Å; M316-E633 HydrophobicContact SD-CG 4.37Å; E633-K806 WeakPolarHBondContact OE1-CD 3.03Å; E633-K806 WeakPolarHBondContact OE1-CE 3.08Å; E633-K806 IonicContact OE1-NZ 2.64Å; E633-K806 PolarHBondContact OE1-NZ 2.72Å; E633-K806 IonicContact OE2-NZ 2.87Å; E633-K806 PolarHBondContact OE2-NZ 3.44Å
634	K	90.1	Very high	78.3	Confident	109 Å²	109	53.7 Å²	53.7	47%	0.474	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	-43.8	-179.5	-163	70	170.2	-164.4	0	112.2	I315 V317 T632 W794	I315-K634 PolarHBondContact O-N 3.47Å; V317-K634 HydrophobicContact CG2-CB 3.92Å; V317-K634 HydrophobicContact CG2-CG 4.42Å; T632-K634 PolarHBondContact O-N 2.8Å; K634-W794 HydrophobicContact CG-CZ2 4.15Å
635	C	91.1	Very high	80.9	Confident	28 Å²	28	47 Å²	47	19%	0.189	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.3	174.5	179.2	59.7	0	0	0	0	111.3	I315	I315-C635 PolarHBondContact N-O 2.85Å
636	V	93.3	Very high	83	Confident	20 Å²	20	43.6 Å²	43.6	12%	0.121	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	116.7	174.7	-175.7	0	0	0	0	109.9	R312 W313 N638 K806	R312-V636 HydrophobicContact CB-CG1 4.22Å; W313-V636 CarbonylContact O-C 3.59Å; W313-V636 WeakPolarHBondContact O-CA 3.5Å; V636-N638 PolarHBondContact O-ND2 3.32Å; V636-K806 HydrophobicContact CG1-CD 4.2Å; V636-K806 HydrophobicContact CG2-CD 3.71Å; V636-K806 VanDerWaalsContact CG2-NZ 3.31Å
637	M	94.3	Very high	85	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	135.9	174.8	175.6	-175.8	73.3	0	0	111.1	W313 I315 F641 L745 V789 I803	W313-M637 HydrophobicContact CB-CB 4.23Å; W313-M637 HydrophobicContact CB-CE 3.59Å; W313-M637 HydrophobicContact CD2-CE 4.48Å; W313-M637 HydrophobicContact CG-CE 3.69Å; W313-M637 PolarHBondContact N-O 3.41Å; W313-M637 PolarHBondContact O-N 3.17Å; I315-M637 HydrophobicContact CD1-CB 3.92Å; I315-M637 HydrophobicContact CD1-SD 4.48Å; I315-M637 HydrophobicContact CG1-CB 4.1Å; M637-F641 HydrophobicContact SD-CB 3.52Å; M637-F641 VanDerWaalsContact SD-CB 3.52Å; M637-F641 PolarHBondContact SD-N 3.05Å; M637-L745 HydrophobicContact CE-CD1 4.2Å; M637-L745 HydrophobicContact CE-CD2 3.62Å; M637-V789 HydrophobicContact CB-CG1 3.7Å; M637-V789 HydrophobicContact CG-CG1 4.18Å; M637-I803 HydrophobicContact CE-CG2 3.9Å
638	N	92.9	Very high	86.8	Confident	7 Å²	7	34.9 Å²	34.9	4%	0.037	18%	0.181	C	C	.	.	S	Bend	trans	-124	-31.1	179.7	-42.7	-91.9	0	0	0	111.1	R312 V636 N715 D790	R312-N638 PolarHBondContact NE-OD1 3.24Å; V636-N638 PolarHBondContact O-ND2 3.32Å; N638-N715 PolarHBondContact O-ND2 3.3Å; N638-D790 WeakPolarHBondContact CA-OD2 3.46Å; N638-D790 WeakPolarHBondContact CB-OD2 3.36Å; N638-D790 PolarHBondContact N-OD2 3.05Å; N638-D790 PolarHBondContact ND2-OD2 2.86Å
639	N	92.3	Very high	88.1	Confident	3 Å²	3	32.3 Å²	32.3	2%	0.016	17%	0.168	C	C	.	.	S	Bend	trans	-111	-62.4	179.8	-60.2	-16.5	0	0	0	112	D247 N715 I716 D790	D247-N639 VanDerWaalsContact CG-ND2 3.33Å; D247-N639 PolarHBondContact OD1-ND2 3.31Å; N639-N715 PolarHBondContact O-N 3.13Å; N639-I716 HydrophobicContact CB-CD1 3.68Å; N639-I716 HydrophobicContact CB-CG1 3.97Å; N639-I716 PolarHBondContact O-N 2.87Å; N639-D790 WeakPolarHBondContact CA-OD1 3.47Å; N639-D790 VanDerWaalsContact CB-OD1 3.28Å; N639-D790 WeakPolarHBondContact CB-OD1 3.37Å; N639-D790 PolarHBondContact N-OD1 3.34Å; N639-D790 PolarHBondContact N-OD2 2.92Å
640	Y	93	Very high	89.3	Confident	23 Å²	23	25.5 Å²	25.5	9%	0.09	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.4	158.1	-177.9	66.7	-85.2	0	0	0	113.9	V713 Y719 Q788 D790	Y640-V713 CarbonylContact C-O 3.56Å; Y640-V713 VanDerWaalsContact CA-O 3.29Å; Y640-V713 WeakPolarHBondContact CA-O 3.22Å; Y640-V713 WeakPolarHBondContact CB-O 3.38Å; Y640-Y719 HydrophobicContact CD1-CD2 4.19Å; Y640-Y719 AromaticContact CD2-CD2 3.61Å; Y640-Y719 HydrophobicContact CD2-CD2 3.61Å; Y640-Y719 AromaticContact CD2-CE2 3.31Å; Y640-Y719 HydrophobicContact CD2-CE2 3.31Å; Y640-Y719 HydrophobicContact CE1-CD2 4.43Å; Y640-Y719 AromaticContact CE2-CD2 3.83Å; Y640-Y719 HydrophobicContact CE2-CD2 3.83Å; Y640-Y719 AromaticContact CE2-CE2 3.44Å; Y640-Y719 HydrophobicContact CE2-CE2 3.44Å; Y640-Y719 VanDerWaalsContact CE2-CE2 3.44Å; Y640-Y719 AromaticContact CE2-CZ 3.97Å; Y640-Y719 AromaticContact CG-CD2 3.81Å; Y640-Y719 HydrophobicContact CG-CD2 3.81Å; Y640-Y719 AromaticContact CG-CE2 3.99Å; Y640-Y719 HydrophobicContact CG-CE2 3.99Å; Y640-Q788 PolarHBondContact OH-NE2 3.4Å; Y640-D790 PolarHBondContact N-OD1 3.4Å; Y640-D790 PolarHBondContact O-N 3.1Å; Y640-D790 VanDerWaalsContact O-N 3.12Å
641	F	94.5	Very high	89.9	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	143	171.2	166.7	-74.4	0	0	0	108.5	I315 M637 I643 V713 I777 V787 Q788 V789 I801 I803	I315-F641 HydrophobicContact CD1-CD2 4.16Å; M637-F641 HydrophobicContact SD-CB 3.52Å; M637-F641 VanDerWaalsContact SD-CB 3.52Å; M637-F641 PolarHBondContact SD-N 3.05Å; F641-I643 HydrophobicContact CE1-CB 3.95Å; F641-I643 HydrophobicContact CE1-CG2 4.03Å; F641-I643 HydrophobicContact CZ-CB 4.29Å; F641-V713 HydrophobicContact CB-CB 4.29Å; F641-V713 HydrophobicContact CD1-CB 4.33Å; F641-V713 HydrophobicContact CD1-CG2 4.17Å; F641-V713 PolarHBondContact N-O 3.08Å; F641-V713 PolarHBondContact O-N 2.75Å; F641-I777 HydrophobicContact CD1-CD1 4.38Å; F641-I777 HydrophobicContact CE1-CD1 3.53Å; F641-I777 HydrophobicContact CZ-CD1 3.9Å; F641-V787 HydrophobicContact CD2-CG1 4.13Å; F641-V787 HydrophobicContact CE2-CG1 3.38Å; F641-V787 HydrophobicContact CZ-CG1 3.71Å; F641-V787 HydrophobicContact CZ-CG2 4.32Å; F641-Q788 CarbonylContact C-O 3.46Å; F641-Q788 WeakPolarHBondContact CA-O 3.42Å; F641-V789 HydrophobicContact CB-CG2 4.25Å; F641-V789 HydrophobicContact CD2-CG2 3.63Å; F641-V789 HydrophobicContact CE2-CG2 4.48Å; F641-V789 HydrophobicContact CG-CG2 4.34Å; F641-I801 HydrophobicContact CE2-CD1 4.25Å; F641-I801 HydrophobicContact CE2-CG2 4.05Å; F641-I801 HydrophobicContact CZ-CD1 3.85Å; F641-I801 HydrophobicContact CZ-CG2 4.38Å; F641-I803 HydrophobicContact CB-CD1 4.12Å; F641-I803 HydrophobicContact CD1-CD1 4.13Å; F641-I803 HydrophobicContact CD2-CD1 4.03Å; F641-I803 HydrophobicContact CG-CD1 3.85Å
642	G	92.5	Very high	90	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	143.1	175.2	0	0	0	0	0	112	I711 V787 Q788	G642-I711 WeakPolarHBondContact CA-O 3.32Å; G642-V787 CarbonylContact O-C 3.53Å; G642-V787 WeakPolarHBondContact O-CA 3.23Å; G642-Q788 PolarHBondContact N-O 3.22Å; G642-Q788 PolarHBondContact O-N 3Å
643	I	92	Very high	89.7	Confident	1 Å²	1	19.8 Å²	19.8	1%	0.005	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	140.9	174.6	-175	168.6	0	0	0	110	F641 V694 G710 I711 I777 V779 V785 P786 V787	F641-I643 HydrophobicContact CE1-CB 3.95Å; F641-I643 HydrophobicContact CE1-CG2 4.03Å; F641-I643 HydrophobicContact CZ-CB 4.29Å; I643-V694 HydrophobicContact CD1-CG2 4.07Å; I643-G710 CarbonylContact O-C 3.6Å; I643-G710 WeakPolarHBondContact O-CA 3.35Å; I643-I711 HydrophobicContact CG2-CB 3.76Å; I643-I711 HydrophobicContact CG2-CD1 4.44Å; I643-I711 HydrophobicContact CG2-CG1 4.24Å; I643-I711 PolarHBondContact N-O 2.93Å; I643-I711 PolarHBondContact O-N 3.14Å; I643-I777 HydrophobicContact CD1-CG2 4.24Å; I643-V779 HydrophobicContact CD1-CG2 4.3Å; I643-V785 HydrophobicContact CD1-CB 4.46Å; I643-V785 HydrophobicContact CD1-CG1 3.88Å; I643-V785 HydrophobicContact CG1-CG1 3.56Å; I643-P786 WeakPolarHBondContact CA-O 3.49Å; I643-V787 HydrophobicContact CB-CG2 4.25Å; I643-V787 HydrophobicContact CD1-CG2 3.96Å; I643-V787 HydrophobicContact CG1-CG2 3.88Å
644	G	90.1	Very high	89.4	Confident	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	89.2	-134.5	-177	0	0	0	0	0	113.7	D646 A647 K648 P786	G644-D646 PolarHBondContact O-N 2.92Å; G644-A647 PolarHBondContact O-N 2.76Å; G644-A647 VanDerWaalsContact O-N 3.17Å; G644-K648 PolarHBondContact O-N 3.14Å; G644-P786 PolarHBondContact N-O 3.43Å
645	L	85	Confident	89.2	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-51.1	-45.8	-167.6	179.4	64.5	0	0	0	115.3	K648 I649 E681 Q709 M756	L645-K648 WeakPolarHBondContact O-CB 3.45Å; L645-K648 PolarHBondContact O-N 3.47Å; L645-I649 HydrophobicContact CD1-CD1 4.39Å; L645-I649 HydrophobicContact CG-CD1 4.34Å; L645-I649 WeakPolarHBondContact O-CG1 3.43Å; L645-I649 PolarHBondContact O-N 3.08Å; L645-I649 VanDerWaalsContact O-N 3.11Å; L645-E681 HydrophobicContact CD1-CB 3.91Å; L645-Q709 HydrophobicContact CB-CB 4.2Å; L645-Q709 WeakPolarHBondContact CB-O 3.48Å; L645-Q709 HydrophobicContact CD2-CB 4.23Å; L645-Q709 PolarHBondContact N-O 3.46Å; L645-M756 HydrophobicContact CD2-SD 4.16Å
646	D	85.2	Confident	88.7	Confident	13 Å²	13	16.8 Å²	16.8	7%	0.07	8%	0.083	C	C	.	.	H	α-helix	trans	-67.6	-46.1	-179.5	-174.8	107	0	0	0	111.8	G644 K648 I649 T650 Y719 M756 Q788	G644-D646 PolarHBondContact O-N 2.92Å; D646-K648 PolarHBondContact O-N 3.42Å; D646-I649 PolarHBondContact O-N 2.86Å; D646-I649 VanDerWaalsContact O-N 3.07Å; D646-T650 PolarHBondContact O-N 2.95Å; D646-T650 PolarHBondContact O-OG1 3.34Å; D646-Y719 WeakPolarHBondContact CB-OH 3.45Å; D646-Y719 WeakPolarHBondContact OD1-CE1 3.41Å; D646-Y719 PolarHBondContact OD1-OH 2.78Å; D646-Y719 PolarHBondContact OD2-OH 2.74Å; D646-M756 HydrophobicContact CB-CE 4.06Å; D646-M756 VanDerWaalsContact OD1-CE 3.27Å; D646-M756 WeakPolarHBondContact OD1-CE 3.31Å; D646-Q788 PolarHBondContact OD2-NE2 2.84Å
647	A	89.3	Confident	87.9	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-60.4	-35.4	175.6	0	0	0	0	0	111.9	G644 T650 L651 P786 V787 Q788	G644-A647 PolarHBondContact O-N 2.76Å; G644-A647 VanDerWaalsContact O-N 3.17Å; A647-T650 PolarHBondContact O-N 3.46Å; A647-L651 WeakPolarHBondContact O-CB 3.43Å; A647-L651 PolarHBondContact O-N 2.72Å; A647-P786 VanDerWaalsContact CB-C 3.47Å; A647-P786 HydrophobicContact CB-CB 4.03Å; A647-P786 VanDerWaalsContact CB-O 3.31Å; A647-P786 WeakPolarHBondContact CB-O 3.46Å; A647-V787 VanDerWaalsContact CB-C 3.43Å; A647-Q788 HydrophobicContact CB-CB 3.92Å; A647-Q788 HydrophobicContact CB-CG 4.03Å
648	K	87.9	Confident	87.2	Confident	43 Å²	43	25.7 Å²	25.7	19%	0.187	12%	0.122	C	C	.	.	H	α-helix	trans	-63	-44.5	172.3	178.6	54.1	-178	164.1	0	112.3	G644 L645 D646 L651 D652 Y687 P786	G644-K648 PolarHBondContact O-N 3.14Å; L645-K648 WeakPolarHBondContact O-CB 3.45Å; L645-K648 PolarHBondContact O-N 3.47Å; D646-K648 PolarHBondContact O-N 3.42Å; K648-L651 PolarHBondContact O-N 2.88Å; K648-D652 WeakPolarHBondContact CE-OD2 3.44Å; K648-D652 VanDerWaalsContact NZ-CG 3.3Å; K648-D652 IonicContact NZ-OD1 3.66Å; K648-D652 PolarHBondContact NZ-OD1 3.41Å; K648-D652 IonicContact NZ-OD2 3.03Å; K648-D652 PolarHBondContact NZ-OD2 2.76Å; K648-D652 WeakPolarHBondContact O-CB 3.4Å; K648-D652 PolarHBondContact O-N 2.67Å; K648-Y687 HydrophobicContact CB-CE2 4.44Å; K648-Y687 HydrophobicContact CG-CE2 4.37Å; K648-P786 HydrophobicContact CB-CB 4.32Å; K648-P786 HydrophobicContact CB-CG 4.02Å
649	I	85.9	Confident	86.5	Confident	16 Å²	16	31.7 Å²	31.7	8%	0.082	15%	0.15	C	C	.	.	H	α-helix	trans	-63.3	-43.3	176.6	-67.3	163.8	0	0	0	110.8	L645 D646 F653 Y674 L677 E681	L645-I649 HydrophobicContact CD1-CD1 4.39Å; L645-I649 HydrophobicContact CG-CD1 4.34Å; L645-I649 WeakPolarHBondContact O-CG1 3.43Å; L645-I649 PolarHBondContact O-N 3.08Å; L645-I649 VanDerWaalsContact O-N 3.11Å; D646-I649 PolarHBondContact O-N 2.86Å; D646-I649 VanDerWaalsContact O-N 3.07Å; I649-F653 WeakPolarHBondContact O-CB 3.3Å; I649-F653 PolarHBondContact O-N 2.72Å; I649-Y674 HydrophobicContact CG2-CD1 4.19Å; I649-L677 HydrophobicContact CG2-CB 4.2Å; I649-E681 HydrophobicContact CD1-CB 4.43Å; I649-E681 HydrophobicContact CG1-CB 4.2Å; I649-E681 HydrophobicContact CG1-CG 3.79Å
650	T	87.5	Confident	85.7	Confident	5 Å²	5	35.3 Å²	35.3	3%	0.031	17%	0.167	C	C	.	.	H	α-helix	trans	-69.7	-37.4	179.7	-60.9	0	0	0	0	112.2	D646 A647 F653 N654 Q788 A793	D646-T650 PolarHBondContact O-N 2.95Å; D646-T650 PolarHBondContact O-OG1 3.34Å; A647-T650 PolarHBondContact O-N 3.46Å; T650-F653 PolarHBondContact O-N 2.72Å; T650-N654 WeakPolarHBondContact O-CB 3.41Å; T650-N654 PolarHBondContact O-N 2.78Å; T650-N654 PolarHBondContact O-ND2 3.26Å; T650-Q788 HydrophobicContact CG2-CB 4.37Å; T650-Q788 PolarHBondContact OG1-NE2 2.95Å; T650-A793 HydrophobicContact CG2-CB 3.94Å
651	L	87.1	Confident	84.7	Confident	21 Å²	21	37.8 Å²	37.8	11%	0.11	19%	0.186	C	C	.	.	H	α-helix	trans	-64.3	-47.2	172.8	-178.8	61.8	0	0	0	111.8	A647 K648 F653 N654 N655 A793 I795	A647-L651 WeakPolarHBondContact O-CB 3.43Å; A647-L651 PolarHBondContact O-N 2.72Å; K648-L651 PolarHBondContact O-N 2.88Å; L651-F653 PolarHBondContact O-N 3.22Å; L651-N654 PolarHBondContact O-N 3Å; L651-N655 WeakPolarHBondContact O-CB 3.39Å; L651-N655 VanDerWaalsContact O-CG 3.26Å; L651-N655 PolarHBondContact O-N 2.95Å; L651-N655 PolarHBondContact O-ND2 3Å; L651-A793 HydrophobicContact CB-CB 3.98Å; L651-A793 HydrophobicContact CD1-CB 4.44Å; L651-I795 HydrophobicContact CD2-CD1 3.43Å; L651-I795 VanDerWaalsContact CD2-CD1 3.43Å; L651-I795 HydrophobicContact CD2-CG1 3.87Å
652	D	86.5	Confident	83.5	Confident	27 Å²	27	43.7 Å²	43.7	14%	0.144	21%	0.213	C	C	.	.	H	α-helix	trans	-66.7	-26.2	176.5	-79.3	11.9	0	0	0	112.3	K648 K656 L677	K648-D652 WeakPolarHBondContact CE-OD2 3.44Å; K648-D652 VanDerWaalsContact NZ-CG 3.3Å; K648-D652 IonicContact NZ-OD1 3.66Å; K648-D652 PolarHBondContact NZ-OD1 3.41Å; K648-D652 IonicContact NZ-OD2 3.03Å; K648-D652 PolarHBondContact NZ-OD2 2.76Å; K648-D652 WeakPolarHBondContact O-CB 3.4Å; K648-D652 PolarHBondContact O-N 2.67Å; D652-K656 WeakPolarHBondContact O-CB 3.47Å; D652-K656 WeakPolarHBondContact O-CG 3.41Å; D652-K656 PolarHBondContact O-N 2.82Å; D652-L677 HydrophobicContact CB-CD2 3.91Å
653	F	83.1	Confident	82.2	Confident	10 Å²	10	48.6 Å²	48.6	4%	0.044	23%	0.234	C	C	.	.	H	α-helix	trans	-70.9	-48	169.5	178.6	-91.1	0	0	0	112	I649 T650 L651 K656 R657 N670 W673 Y674 L677	I649-F653 WeakPolarHBondContact O-CB 3.3Å; I649-F653 PolarHBondContact O-N 2.72Å; T650-F653 PolarHBondContact O-N 2.72Å; L651-F653 PolarHBondContact O-N 3.22Å; F653-K656 PolarHBondContact O-N 3.48Å; F653-R657 HydrophobicContact CE1-CB 4.43Å; F653-R657 WeakPolarHBondContact O-CB 3.47Å; F653-R657 PolarHBondContact O-N 3.48Å; F653-N670 HydrophobicContact CE2-CB 4.26Å; F653-N670 HydrophobicContact CZ-CB 4.02Å; F653-W673 HydrophobicContact CD2-CB 4.14Å; F653-W673 HydrophobicContact CE2-CB 3.92Å; F653-Y674 HydrophobicContact CB-CD1 4.47Å; F653-Y674 HydrophobicContact CB-CE1 3.96Å; F653-Y674 HydrophobicContact CB-CE2 4.38Å; F653-Y674 HydrophobicContact CD1-CD2 4.45Å; F653-Y674 HydrophobicContact CD1-CE1 4.38Å; F653-Y674 AromaticContact CD1-CE2 3.52Å; F653-Y674 HydrophobicContact CD1-CE2 3.52Å; F653-Y674 AromaticContact CD1-CZ 3.47Å; F653-Y674 VanDerWaalsContact CD1-CZ 3.47Å; F653-Y674 VanDerWaalsContact CD1-OH 3.25Å; F653-Y674 WeakPolarHBondContact CD1-OH 3.4Å; F653-Y674 HydrophobicContact CD2-CD1 4.46Å; F653-Y674 AromaticContact CD2-CD2 3.61Å; F653-Y674 HydrophobicContact CD2-CD2 3.61Å; F653-Y674 HydrophobicContact CD2-CE1 4.39Å; F653-Y674 AromaticContact CD2-CE2 3.51Å; F653-Y674 HydrophobicContact CD2-CE2 3.51Å; F653-Y674 HydrophobicContact CD2-CG 4.09Å; F653-Y674 AromaticContact CD2-CZ 3.92Å; F653-Y674 HydrophobicContact CE1-CD2 4.47Å; F653-Y674 AromaticContact CE1-CE2 3.56Å; F653-Y674 HydrophobicContact CE1-CE2 3.56Å; F653-Y674 AromaticContact CE1-CZ 3.97Å; F653-Y674 AromaticContact CE2-CD2 3.63Å; F653-Y674 HydrophobicContact CE2-CD2 3.63Å; F653-Y674 AromaticContact CE2-CE2 3.55Å; F653-Y674 HydrophobicContact CE2-CE2 3.55Å; F653-Y674 HydrophobicContact CE2-CG 4.49Å; F653-Y674 HydrophobicContact CG-CD1 4.45Å; F653-Y674 HydrophobicContact CG-CD2 4.05Å; F653-Y674 AromaticContact CG-CE1 3.97Å; F653-Y674 HydrophobicContact CG-CE1 3.97Å; F653-Y674 AromaticContact CG-CE2 3.5Å; F653-Y674 HydrophobicContact CG-CE2 3.5Å; F653-Y674 HydrophobicContact CG-CG 4.49Å; F653-Y674 AromaticContact CG-CZ 3.46Å; F653-Y674 VanDerWaalsContact CG-CZ 3.46Å; F653-Y674 HydrophobicContact CZ-CD2 4.08Å; F653-Y674 AromaticContact CZ-CE2 3.58Å; F653-Y674 HydrophobicContact CZ-CE2 3.58Å; F653-L677 HydrophobicContact CB-CD1 3.66Å; F653-L677 HydrophobicContact CD2-CD1 4.2Å; F653-L677 HydrophobicContact CG-CD1 4.45Å
654	N	83.3	Confident	80.8	Confident	15 Å²	15	49.2 Å²	49.2	8%	0.08	24%	0.239	C	C	.	.	H	α-helix	trans	-62.9	-45.6	180	-76.6	-27.7	0	0	0	111.2	T650 L651 K656 R657 D658 G791	T650-N654 WeakPolarHBondContact O-CB 3.41Å; T650-N654 PolarHBondContact O-N 2.78Å; T650-N654 PolarHBondContact O-ND2 3.26Å; L651-N654 PolarHBondContact O-N 3Å; N654-K656 PolarHBondContact O-N 3.39Å; N654-R657 WeakPolarHBondContact O-CB 3.45Å; N654-R657 PolarHBondContact O-N 2.97Å; N654-R657 VanDerWaalsContact O-N 3.09Å; N654-R657 PolarHBondContact OD1-NH1 3.03Å; N654-D658 PolarHBondContact O-N 3.09Å; N654-G791 PolarHBondContact ND2-O 2.89Å
655	N	85.7	Confident	79.6	Confident	81 Å²	81	55.6 Å²	55.6	43%	0.433	26%	0.263	S	S	.	.	H	α-helix	trans	-54.1	-49	173.3	-70.4	-26.9	0	0	0	111.9	L651 R657 D658 E659	L651-N655 WeakPolarHBondContact O-CB 3.39Å; L651-N655 VanDerWaalsContact O-CG 3.26Å; L651-N655 PolarHBondContact O-N 2.95Å; L651-N655 PolarHBondContact O-ND2 3Å; N655-R657 VanDerWaalsContact C-N 3.35Å; N655-R657 PolarHBondContact O-N 3.16Å; N655-D658 PolarHBondContact O-N 3.47Å; N655-E659 WeakPolarHBondContact O-CG 3.5Å; N655-E659 PolarHBondContact O-N 2.89Å
656	K	81.1	Confident	78.9	Confident	68 Å²	68	56.3 Å²	56.3	30%	0.296	27%	0.268	S	S	.	.	H	α-helix	trans	-65.6	-33.3	176.9	-77.9	179.6	179	179.5	0	113.8	D652 F653 N654 D658 H660 W673 L677	D652-K656 WeakPolarHBondContact O-CB 3.47Å; D652-K656 WeakPolarHBondContact O-CG 3.41Å; D652-K656 PolarHBondContact O-N 2.82Å; F653-K656 PolarHBondContact O-N 3.48Å; N654-K656 PolarHBondContact O-N 3.39Å; K656-D658 VanDerWaalsContact C-N 3.31Å; K656-H660 WeakPolarHBondContact O-CB 3.09Å; K656-H660 PolarHBondContact O-N 2.68Å; K656-W673 HydrophobicContact CD-CZ3 4.47Å; K656-L677 HydrophobicContact CD-CD1 4.43Å; K656-L677 HydrophobicContact CD-CD2 4.18Å; K656-L677 VanDerWaalsContact NZ-CD2 3.31Å
657	R	76.3	Confident	78.3	Confident	103 Å²	103	58.3 Å²	58.3	39%	0.389	28%	0.275	S	S	.	.	H	α-helix	trans	-65.6	-38.8	176	-175.5	-165.5	69.3	-170	-3	110.8	F653 N654 N655 H660 P661 C664	F653-R657 HydrophobicContact CE1-CB 4.43Å; F653-R657 WeakPolarHBondContact O-CB 3.47Å; F653-R657 PolarHBondContact O-N 3.48Å; N654-R657 WeakPolarHBondContact O-CB 3.45Å; N654-R657 PolarHBondContact O-N 2.97Å; N654-R657 VanDerWaalsContact O-N 3.09Å; N654-R657 PolarHBondContact OD1-NH1 3.03Å; N655-R657 VanDerWaalsContact C-N 3.35Å; N655-R657 PolarHBondContact O-N 3.16Å; R657-H660 CarbonylContact O-C 3.57Å; R657-H660 VanDerWaalsContact O-C 3.27Å; R657-H660 PolarHBondContact O-N 3.01Å; R657-P661 WeakPolarHBondContact O-CA 3.4Å; R657-P661 WeakPolarHBondContact O-CD 3.47Å; R657-C664 HydrophobicContact CB-CB 4.46Å; R657-C664 HydrophobicContact CG-CB 3.88Å
658	D	79.1	Confident	77.6	Confident	103 Å²	103	63.4 Å²	63.4	55%	0.551	31%	0.306	S	S	*	.	H	α-helix	trans	-83.1	-30.8	-175.4	-58.4	-11.1	0	0	0	111.1	N654 N655 K656	N654-D658 PolarHBondContact O-N 3.09Å; N655-D658 PolarHBondContact O-N 3.47Å; K656-D658 VanDerWaalsContact C-N 3.31Å
659	E	80.1	Confident	77.1	Confident	134 Å²	134	67.1 Å²	67.1	63%	0.626	32%	0.322	S	S	*	.	H	α-helix	trans	-62.6	-37.5	163.3	-73.2	179	172.5	0	0	113.4	N655	N655-E659 WeakPolarHBondContact O-CG 3.5Å; N655-E659 PolarHBondContact O-N 2.89Å
660	H	75.3	Confident	76.6	Confident	79 Å²	79	67 Å²	67	37%	0.366	32%	0.322	S	S	.	.			trans	-137.9	59.2	-167	-67.8	103.8	0	0	0	113.8	K656 R657 E662 K663	K656-H660 WeakPolarHBondContact O-CB 3.09Å; K656-H660 PolarHBondContact O-N 2.68Å; R657-H660 CarbonylContact O-C 3.57Å; R657-H660 VanDerWaalsContact O-C 3.27Å; R657-H660 PolarHBondContact O-N 3.01Å; H660-E662 PolarHBondContact O-N 3.02Å; H660-E662 VanDerWaalsContact O-N 3.14Å; H660-K663 HydrophobicContact CB-CB 4.17Å; H660-K663 HydrophobicContact CB-CD 3.85Å; H660-K663 HydrophobicContact CB-CG 4.08Å; H660-K663 WeakPolarHBondContact CD2-CE 3.34Å; H660-K663 PolarHBondContact CD2-NZ 2.73Å; H660-K663 PolarHBondContact NE2-NZ 2.92Å; H660-K663 PolarHBondContact O-N 2.7Å
661	P	71.3	Confident	76.1	Confident	75 Å²	75	72.2 Å²	72.2	49%	0.487	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-30.5	-173.8	22.4	-34	0	0	0	113.3	R657 K663 C664	R657-P661 WeakPolarHBondContact O-CA 3.4Å; R657-P661 WeakPolarHBondContact O-CD 3.47Å; P661-K663 VanDerWaalsContact C-N 3.34Å; P661-K663 PolarHBondContact O-N 2.93Å; P661-C664 PolarHBondContact O-N 2.81Å
662	E	68.7	Low	75.6	Confident	123 Å²	123	77.8 Å²	77.8	58%	0.575	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-36.5	173.8	-68.9	-61.3	151.4	0	0	113.4	H660 C664 R665	H660-E662 PolarHBondContact O-N 3.02Å; H660-E662 VanDerWaalsContact O-N 3.14Å; E662-C664 VanDerWaalsContact C-N 3.26Å; E662-C664 PolarHBondContact O-N 3.03Å; E662-R665 IonicContact OE1-CZ 2.7Å; E662-R665 IonicContact OE1-NH1 2.66Å; E662-R665 PolarHBondContact OE1-NH1 3.07Å; E662-R665 IonicContact OE1-NH2 2.69Å; E662-R665 PolarHBondContact OE1-NH2 3.23Å; E662-R665 IonicContact OE2-CZ 2.68Å; E662-R665 IonicContact OE2-NE 3.2Å; E662-R665 IonicContact OE2-NH1 2.82Å; E662-R665 PolarHBondContact OE2-NH1 3.2Å; E662-R665 IonicContact OE2-NH2 3.21Å
663	K	65.6	Low	75.2	Confident	103 Å²	103	80.5 Å²	80.5	45%	0.448	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-23.2	179.4	-62.8	-178.6	-174.8	163.9	0	111.7	H660 P661	H660-K663 HydrophobicContact CB-CB 4.17Å; H660-K663 HydrophobicContact CB-CD 3.85Å; H660-K663 HydrophobicContact CB-CG 4.08Å; H660-K663 WeakPolarHBondContact CD2-CE 3.34Å; H660-K663 PolarHBondContact CD2-NZ 2.73Å; H660-K663 PolarHBondContact NE2-NZ 2.92Å; H660-K663 PolarHBondContact O-N 2.7Å; P661-K663 VanDerWaalsContact C-N 3.34Å; P661-K663 PolarHBondContact O-N 2.93Å
664	C	62.6	Low	74.9	Confident	15 Å²	15	83.5 Å²	83.5	10%	0.101	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	16.3	-170.5	-58.3	0	0	0	0	115	R657 P661 E662 N670	R657-C664 HydrophobicContact CB-CB 4.46Å; R657-C664 HydrophobicContact CG-CB 3.88Å; P661-C664 PolarHBondContact O-N 2.81Å; E662-C664 VanDerWaalsContact C-N 3.26Å; E662-C664 PolarHBondContact O-N 3.03Å; C664-N670 VanDerWaalsContact C-OD1 3.28Å; C664-N670 WeakPolarHBondContact CA-OD1 3.37Å; C664-N670 WeakPolarHBondContact CB-OD1 3.39Å; C664-N670 PolarHBondContact O-ND2 3.44Å; C664-N670 PolarHBondContact O-OD1 3.14Å; C664-N670 VanDerWaalsContact O-OD1 3.06Å
665	R	64.7	Low	74.5	Confident	133 Å²	133	84.5 Å²	84.5	50%	0.502	41%	0.41	S	S	.	.	S	Bend	trans	-76.1	-26.5	178.2	-69.2	-172.1	171.2	155.3	2.4	114.8	E662	E662-R665 IonicContact OE1-CZ 2.7Å; E662-R665 IonicContact OE1-NH1 2.66Å; E662-R665 PolarHBondContact OE1-NH1 3.07Å; E662-R665 IonicContact OE1-NH2 2.69Å; E662-R665 PolarHBondContact OE1-NH2 3.23Å; E662-R665 IonicContact OE2-CZ 2.68Å; E662-R665 IonicContact OE2-NE 3.2Å; E662-R665 IonicContact OE2-NH1 2.82Å; E662-R665 PolarHBondContact OE2-NH1 3.2Å; E662-R665 IonicContact OE2-NH2 3.21Å
666	S	71	Confident	74.3	Confident	15 Å²	15	84.2 Å²	84.2	11%	0.105	41%	0.41	C	S	.	.	S	Bend	trans	-97.8	129.2	-174.6	-177.8	0	0	0	0	111.8	D199 T668 K669 N670	D199-S666 WeakPolarHBondContact OD2-CB 3.37Å; D199-S666 PolarHBondContact OD2-OG 3.03Å; S666-T668 VanDerWaalsContact C-N 3.31Å; S666-T668 PolarHBondContact O-N 3.1Å; S666-K669 PolarHBondContact O-N 3.42Å; S666-K669 VanDerWaalsContact O-N 3.09Å; S666-N670 PolarHBondContact O-N 3.1Å; S666-N670 PolarHBondContact O-OD1 2.81Å
667	R	72.7	Confident	74.2	Confident	56 Å²	56	81 Å²	81	21%	0.211	40%	0.397	C	S	.	.	H	α-helix	trans	-53.2	-45	-177.6	-174.5	-178.6	-176.6	-164.1	-1.9	112.9	G274 T275 N277 S287 D290 N670 L671	G274-R667 PolarHBondContact O-NE 2.98Å; T275-R667 HydrophobicContact CG2-CB 4.34Å; T275-R667 HydrophobicContact CG2-CG 3.89Å; N277-R667 PolarHBondContact ND2-NH2 3.24Å; S287-R667 PolarHBondContact O-NH2 2.87Å; D290-R667 IonicContact OD2-NH1 2.67Å; R667-N670 PolarHBondContact O-N 2.99Å; R667-L671 PolarHBondContact O-N 3.32Å; R667-L671 VanDerWaalsContact O-N 3.11Å
668	T	74.1	Confident	74.1	Confident	106 Å²	106	77.1 Å²	77.1	65%	0.65	39%	0.388	S	S	*	.	H	α-helix	trans	-68.9	-36.5	-179.3	-45.6	0	0	0	0	111.9	S666 L671 M672	S666-T668 VanDerWaalsContact C-N 3.31Å; S666-T668 PolarHBondContact O-N 3.1Å; T668-L671 PolarHBondContact O-N 3.15Å; T668-M672 PolarHBondContact O-N 3.5Å
669	K	76.6	Confident	73.7	Confident	121 Å²	121	76.1 Å²	76.1	53%	0.526	39%	0.386	S	S	.	.	H	α-helix	trans	-66.4	-39	174.8	-63.9	-176.4	-174.6	177.4	0	111.5	S666 M672 W673	S666-K669 PolarHBondContact O-N 3.42Å; S666-K669 VanDerWaalsContact O-N 3.09Å; K669-M672 PolarHBondContact O-N 3.37Å; K669-W673 VanDerWaalsContact O-CD1 3.26Å; K669-W673 PolarHBondContact O-N 3.38Å
670	N	76.9	Confident	73.5	Confident	15 Å²	15	73.7 Å²	73.7	8%	0.08	37%	0.373	C	S	.	.	H	α-helix	trans	-65.2	-43.5	177.3	-66.2	-3.5	0	0	0	111.3	T275 F653 C664 S666 R667 M672 W673 Y674	T275-N670 HydrophobicContact CG2-CB 3.8Å; F653-N670 HydrophobicContact CE2-CB 4.26Å; F653-N670 HydrophobicContact CZ-CB 4.02Å; C664-N670 VanDerWaalsContact C-OD1 3.28Å; C664-N670 WeakPolarHBondContact CA-OD1 3.37Å; C664-N670 WeakPolarHBondContact CB-OD1 3.39Å; C664-N670 PolarHBondContact O-ND2 3.44Å; C664-N670 PolarHBondContact O-OD1 3.14Å; C664-N670 VanDerWaalsContact O-OD1 3.06Å; S666-N670 PolarHBondContact O-N 3.1Å; S666-N670 PolarHBondContact O-OD1 2.81Å; R667-N670 PolarHBondContact O-N 2.99Å; N670-M672 VanDerWaalsContact C-N 3.31Å; N670-M672 PolarHBondContact O-N 3.21Å; N670-W673 PolarHBondContact O-N 2.86Å; N670-Y674 WeakPolarHBondContact O-CD2 3.42Å; N670-Y674 PolarHBondContact O-N 3.09Å
671	L	75.7	Confident	73.4	Confident	113 Å²	113	70 Å²	70	59%	0.592	36%	0.356	S	S	*	.	H	α-helix	trans	-60.4	-40.3	174	-175.9	62.2	0	0	0	112.1	R667 T668 G675	R667-L671 PolarHBondContact O-N 3.32Å; R667-L671 VanDerWaalsContact O-N 3.11Å; T668-L671 PolarHBondContact O-N 3.15Å; L671-G675 PolarHBondContact O-N 2.96Å; L671-G675 VanDerWaalsContact O-N 3.09Å
672	M	77	Confident	73	Confident	138 Å²	138	70 Å²	70	68%	0.68	35%	0.352	S	S	*	.	H	α-helix	trans	-64.5	-42.1	174.2	-172.4	-179.9	-178	0	0	112.3	T668 K669 N670 G675 V676	T668-M672 PolarHBondContact O-N 3.5Å; K669-M672 PolarHBondContact O-N 3.37Å; N670-M672 VanDerWaalsContact C-N 3.31Å; N670-M672 PolarHBondContact O-N 3.21Å; M672-G675 WeakPolarHBondContact O-CA 3.24Å; M672-G675 PolarHBondContact O-N 2.84Å; M672-G675 VanDerWaalsContact O-N 3.14Å; M672-V676 WeakPolarHBondContact O-CG2 3.2Å; M672-V676 PolarHBondContact O-N 2.83Å
673	W	77.6	Confident	72.6	Confident	85 Å²	85	70.9 Å²	70.9	32%	0.322	36%	0.36	S	S	.	.	H	α-helix	trans	-62.1	-43.1	176.2	-85.9	121.9	0	0	0	112.9	F653 K656 K669 N670 G675 V676 L677	F653-W673 HydrophobicContact CD2-CB 4.14Å; F653-W673 HydrophobicContact CE2-CB 3.92Å; K656-W673 HydrophobicContact CD-CZ3 4.47Å; K669-W673 VanDerWaalsContact O-CD1 3.26Å; K669-W673 PolarHBondContact O-N 3.38Å; N670-W673 PolarHBondContact O-N 2.86Å; W673-G675 VanDerWaalsContact C-N 3.28Å; W673-G675 PolarHBondContact O-N 2.95Å; W673-V676 PolarHBondContact O-N 3.31Å; W673-L677 WeakPolarHBondContact O-CB 3.29Å; W673-L677 WeakPolarHBondContact O-CG 3.47Å; W673-L677 PolarHBondContact O-N 3.11Å
674	Y	77.3	Confident	72.3	Confident	72 Å²	72	72.1 Å²	72.1	28%	0.282	37%	0.367	S	S	.	.	H	α-helix	trans	-59.2	-39.6	171.4	-90.2	-76.6	0	0	0	111.9	I649 F653 N670 G678	I649-Y674 HydrophobicContact CG2-CD1 4.19Å; F653-Y674 HydrophobicContact CB-CD1 4.47Å; F653-Y674 HydrophobicContact CB-CE1 3.96Å; F653-Y674 HydrophobicContact CB-CE2 4.38Å; F653-Y674 HydrophobicContact CD1-CD2 4.45Å; F653-Y674 HydrophobicContact CD1-CE1 4.38Å; F653-Y674 AromaticContact CD1-CE2 3.52Å; F653-Y674 HydrophobicContact CD1-CE2 3.52Å; F653-Y674 AromaticContact CD1-CZ 3.47Å; F653-Y674 VanDerWaalsContact CD1-CZ 3.47Å; F653-Y674 VanDerWaalsContact CD1-OH 3.25Å; F653-Y674 WeakPolarHBondContact CD1-OH 3.4Å; F653-Y674 HydrophobicContact CD2-CD1 4.46Å; F653-Y674 AromaticContact CD2-CD2 3.61Å; F653-Y674 HydrophobicContact CD2-CD2 3.61Å; F653-Y674 HydrophobicContact CD2-CE1 4.39Å; F653-Y674 AromaticContact CD2-CE2 3.51Å; F653-Y674 HydrophobicContact CD2-CE2 3.51Å; F653-Y674 HydrophobicContact CD2-CG 4.09Å; F653-Y674 AromaticContact CD2-CZ 3.92Å; F653-Y674 HydrophobicContact CE1-CD2 4.47Å; F653-Y674 AromaticContact CE1-CE2 3.56Å; F653-Y674 HydrophobicContact CE1-CE2 3.56Å; F653-Y674 AromaticContact CE1-CZ 3.97Å; F653-Y674 AromaticContact CE2-CD2 3.63Å; F653-Y674 HydrophobicContact CE2-CD2 3.63Å; F653-Y674 AromaticContact CE2-CE2 3.55Å; F653-Y674 HydrophobicContact CE2-CE2 3.55Å; F653-Y674 HydrophobicContact CE2-CG 4.49Å; F653-Y674 HydrophobicContact CG-CD1 4.45Å; F653-Y674 HydrophobicContact CG-CD2 4.05Å; F653-Y674 AromaticContact CG-CE1 3.97Å; F653-Y674 HydrophobicContact CG-CE1 3.97Å; F653-Y674 AromaticContact CG-CE2 3.5Å; F653-Y674 HydrophobicContact CG-CE2 3.5Å; F653-Y674 HydrophobicContact CG-CG 4.49Å; F653-Y674 AromaticContact CG-CZ 3.46Å; F653-Y674 VanDerWaalsContact CG-CZ 3.46Å; F653-Y674 HydrophobicContact CZ-CD2 4.08Å; F653-Y674 AromaticContact CZ-CE2 3.58Å; F653-Y674 HydrophobicContact CZ-CE2 3.58Å; N670-Y674 WeakPolarHBondContact O-CD2 3.42Å; N670-Y674 PolarHBondContact O-N 3.09Å; Y674-G678 PolarHBondContact O-N 3.25Å
675	G	76.2	Confident	72.3	Confident	37 Å²	37	78.9 Å²	78.9	38%	0.381	39%	0.39	S	S	.	.	H	α-helix	trans	-60.1	-52.8	173.5	0	0	0	0	0	112.7	L671 M672 W673 L677 G678 T679	L671-G675 PolarHBondContact O-N 2.96Å; L671-G675 VanDerWaalsContact O-N 3.09Å; M672-G675 WeakPolarHBondContact O-CA 3.24Å; M672-G675 PolarHBondContact O-N 2.84Å; M672-G675 VanDerWaalsContact O-N 3.14Å; W673-G675 VanDerWaalsContact C-N 3.28Å; W673-G675 PolarHBondContact O-N 2.95Å; G675-L677 VanDerWaalsContact C-N 3.32Å; G675-L677 PolarHBondContact O-N 3.22Å; G675-G678 PolarHBondContact O-N 3.33Å; G675-T679 PolarHBondContact O-N 3.42Å; G675-T679 PolarHBondContact O-OG1 2.83Å
676	V	81.4	Confident	72.1	Confident	74 Å²	74	74.5 Å²	74.5	45%	0.448	38%	0.378	S	S	.	.	H	α-helix	trans	-60.8	-39.6	179.7	173	0	0	0	0	112	M672 W673 T679 K680	M672-V676 WeakPolarHBondContact O-CG2 3.2Å; M672-V676 PolarHBondContact O-N 2.83Å; W673-V676 PolarHBondContact O-N 3.31Å; V676-T679 PolarHBondContact O-N 3.31Å; V676-K680 PolarHBondContact O-N 3.38Å; V676-K680 VanDerWaalsContact O-N 3.08Å
677	L	77.9	Confident	71.7	Confident	2 Å²	2	76.6 Å²	76.6	1%	0.01	38%	0.384	C	S	.	.	H	α-helix	trans	-66.4	-45	174.8	-76.4	168.5	0	0	0	112.2	I649 D652 F653 K656 W673 G675 T679 K680 E681	I649-L677 HydrophobicContact CG2-CB 4.2Å; D652-L677 HydrophobicContact CB-CD2 3.91Å; F653-L677 HydrophobicContact CB-CD1 3.66Å; F653-L677 HydrophobicContact CD2-CD1 4.2Å; F653-L677 HydrophobicContact CG-CD1 4.45Å; K656-L677 HydrophobicContact CD-CD1 4.43Å; K656-L677 HydrophobicContact CD-CD2 4.18Å; K656-L677 VanDerWaalsContact NZ-CD2 3.31Å; W673-L677 WeakPolarHBondContact O-CB 3.29Å; W673-L677 WeakPolarHBondContact O-CG 3.47Å; W673-L677 PolarHBondContact O-N 3.11Å; G675-L677 VanDerWaalsContact C-N 3.32Å; G675-L677 PolarHBondContact O-N 3.22Å; L677-T679 VanDerWaalsContact C-N 3.29Å; L677-T679 PolarHBondContact O-N 3.01Å; L677-K680 WeakPolarHBondContact O-CB 3.44Å; L677-K680 PolarHBondContact O-N 3.12Å; L677-K680 VanDerWaalsContact O-N 3.12Å; L677-E681 PolarHBondContact O-N 3.39Å; L677-E681 VanDerWaalsContact O-N 3.1Å
678	G	74.7	Confident	71.2	Confident	20 Å²	20	80.2 Å²	80.2	21%	0.206	40%	0.401	C	S	.	.	H	α-helix	trans	-59.9	-37.6	175.4	0	0	0	0	0	113.1	Y674 G675 L682	Y674-G678 PolarHBondContact O-N 3.25Å; G675-G678 PolarHBondContact O-N 3.33Å; G678-L682 WeakPolarHBondContact O-CB 2.99Å; G678-L682 PolarHBondContact O-N 3.49Å
679	T	70.5	Confident	71.1	Confident	82 Å²	82	78.5 Å²	78.5	50%	0.503	39%	0.388	S	S	.	.	H	α-helix	trans	-68.5	-35	173.9	-55.3	0	0	0	0	112.6	G675 V676 L677 L682 L683	G675-T679 PolarHBondContact O-N 3.42Å; G675-T679 PolarHBondContact O-OG1 2.83Å; V676-T679 PolarHBondContact O-N 3.31Å; L677-T679 VanDerWaalsContact C-N 3.29Å; L677-T679 PolarHBondContact O-N 3.01Å; T679-L682 WeakPolarHBondContact O-CB 3.46Å; T679-L682 PolarHBondContact O-N 3.11Å; T679-L683 PolarHBondContact O-N 3.09Å
680	K	76.7	Confident	71.3	Confident	84 Å²	84	72.8 Å²	72.8	37%	0.365	36%	0.364	S	S	.	.	H	α-helix	trans	-62.1	-48.2	173.3	177.5	-177.2	164.7	-82.5	0	111.4	V676 L677 L682 L683 H684	V676-K680 PolarHBondContact O-N 3.38Å; V676-K680 VanDerWaalsContact O-N 3.08Å; L677-K680 WeakPolarHBondContact O-CB 3.44Å; L677-K680 PolarHBondContact O-N 3.12Å; L677-K680 VanDerWaalsContact O-N 3.12Å; K680-L682 VanDerWaalsContact C-N 3.3Å; K680-L682 PolarHBondContact O-N 3.35Å; K680-L683 WeakPolarHBondContact O-CB 3.26Å; K680-L683 PolarHBondContact O-N 3.27Å; K680-L683 VanDerWaalsContact O-N 3.12Å; K680-H684 PolarHBondContact O-N 3.22Å; K680-H684 VanDerWaalsContact O-N 3.1Å
681	E	73.1	Confident	71.3	Confident	2 Å²	2	74.3 Å²	74.3	1%	0.009	37%	0.37	C	S	.	.	H	α-helix	trans	-72.2	-24.7	-178.3	-58.8	-52.3	104.8	0	0	112.6	L645 I649 L677 L683 R685 T686	L645-E681 HydrophobicContact CD1-CB 3.91Å; I649-E681 HydrophobicContact CD1-CB 4.43Å; I649-E681 HydrophobicContact CG1-CB 4.2Å; I649-E681 HydrophobicContact CG1-CG 3.79Å; L677-E681 PolarHBondContact O-N 3.39Å; L677-E681 VanDerWaalsContact O-N 3.1Å; E681-L683 VanDerWaalsContact C-N 3.28Å; E681-L683 PolarHBondContact O-N 3.44Å; E681-R685 PolarHBondContact O-N 2.84Å; E681-T686 WeakPolarHBondContact OE2-CB 3.44Å; E681-T686 PolarHBondContact OE2-OG1 3.22Å
682	L	62.2	Low	71.4	Confident	74 Å²	74	75.3 Å²	75.3	39%	0.387	37%	0.372	S	S	.	.	H	α-helix	trans	-60.8	-34.4	167.6	179	64.8	0	0	0	113.1	G678 T679 K680 S753 M754	G678-L682 WeakPolarHBondContact O-CB 2.99Å; G678-L682 PolarHBondContact O-N 3.49Å; T679-L682 WeakPolarHBondContact O-CB 3.46Å; T679-L682 PolarHBondContact O-N 3.11Å; K680-L682 VanDerWaalsContact C-N 3.3Å; K680-L682 PolarHBondContact O-N 3.35Å; L682-S753 VanDerWaalsContact CA-OG 3.23Å; L682-S753 WeakPolarHBondContact CA-OG 3.49Å; L682-S753 WeakPolarHBondContact CB-OG 3.33Å; L682-S753 WeakPolarHBondContact CD1-OG 3.49Å; L682-M754 HydrophobicContact CD1-CB 3.93Å
683	L	59.4	Low	71.7	Confident	141 Å²	141	72.9 Å²	72.9	74%	0.738	36%	0.355	S	S	*	.	H	α-helix	trans	-78.3	-46.5	176.1	-65.8	169.9	0	0	0	111.6	T679 K680 E681	T679-L683 PolarHBondContact O-N 3.09Å; K680-L683 WeakPolarHBondContact O-CB 3.26Å; K680-L683 PolarHBondContact O-N 3.27Å; K680-L683 VanDerWaalsContact O-N 3.12Å; E681-L683 VanDerWaalsContact C-N 3.28Å; E681-L683 PolarHBondContact O-N 3.44Å
684	H	59.8	Low	72.3	Confident	130 Å²	130	69 Å²	69	60%	0.602	34%	0.341	S	S	*	.	H	α-helix	trans	-76	-22.9	-176.3	-81.7	-83.7	0	0	0	115	K680 T686	K680-H684 PolarHBondContact O-N 3.22Å; K680-H684 VanDerWaalsContact O-N 3.1Å; H684-T686 VanDerWaalsContact C-N 3.28Å; H684-T686 PolarHBondContact O-N 3.02Å
685	R	62.3	Low	72.9	Confident	157 Å²	157	69 Å²	69	59%	0.592	35%	0.346	S	S	*	.			trans	48.2	48.2	-176.4	-61	-171.5	-178.5	-174.6	3.8	112.9	E681 K688	E681-R685 PolarHBondContact O-N 2.84Å; R685-K688 WeakPolarHBondContact O-CG 3.43Å
686	T	60	Low	73.8	Confident	41 Å²	41	67.3 Å²	67.3	25%	0.252	33%	0.327	S	S	.	.			trans	-61.3	145.5	179.1	-33.2	0	0	0	0	111	E681 H684	E681-T686 WeakPolarHBondContact OE2-CB 3.44Å; E681-T686 PolarHBondContact OE2-OG1 3.22Å; H684-T686 VanDerWaalsContact C-N 3.28Å; H684-T686 PolarHBondContact O-N 3.02Å
687	Y	63.2	Low	74.3	Confident	59 Å²	59	65.4 Å²	65.4	23%	0.231	31%	0.314	C	S	.	.	S	Bend	trans	54.9	55	-177.3	-59.1	-80.4	0	0	0	114.9	K648 Q709 P786	K648-Y687 HydrophobicContact CB-CE2 4.44Å; K648-Y687 HydrophobicContact CG-CE2 4.37Å; Y687-Q709 WeakPolarHBondContact O-CA 3.07Å; Y687-P786 HydrophobicContact CD2-CG 4.25Å; Y687-P786 HydrophobicContact CE2-CG 3.63Å; Y687-P786 VanDerWaalsContact CZ-CD 3.42Å; Y687-P786 WeakPolarHBondContact OH-CD 3.3Å
688	K	63.4	Low	75	Confident	131 Å²	131	65.7 Å²	65.7	57%	0.57	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	149.4	156.7	-61.2	169.2	-163.3	160.5	0	109.1	R685	R685-K688 WeakPolarHBondContact O-CG 3.43Å
689	N	71	Confident	75.9	Confident	70 Å²	70	68.3 Å²	68.3	37%	0.374	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.5	43	175.6	-45.7	-0	0	0	0	114.7	E691 Q692	N689-E691 VanDerWaalsContact CA-OE1 3.28Å; N689-E691 WeakPolarHBondContact CA-OE1 3.25Å; N689-E691 VanDerWaalsContact CA-OE2 3.27Å; N689-E691 WeakPolarHBondContact CA-OE2 3.12Å; N689-E691 PolarHBondContact O-N 3.43Å; N689-Q692 HydrophobicContact CB-CB 4.44Å; N689-Q692 HydrophobicContact CB-CG 3.99Å; N689-Q692 PolarHBondContact ND2-OE1 3.02Å; N689-Q692 VanDerWaalsContact ND2-OE1 3.16Å; N689-Q692 WeakPolarHBondContact O-CB 3.41Å; N689-Q692 PolarHBondContact O-N 3.28Å
690	L	80.9	Confident	76.6	Confident	2 Å²	2	67.4 Å²	67.4	1%	0.01	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-60.5	-27.3	-180	-175.8	64.5	0	0	0	112.3	Q692 R693 V694 L708 V785	L690-Q692 PolarHBondContact O-N 2.88Å; L690-R693 CarbonylContact O-C 3.59Å; L690-R693 PolarHBondContact O-N 3.46Å; L690-V694 HydrophobicContact CD1-CG2 3.68Å; L690-V694 HydrophobicContact CG-CB 4.46Å; L690-V694 HydrophobicContact CG-CG2 3.9Å; L690-V694 PolarHBondContact O-N 2.93Å; L690-L708 HydrophobicContact CB-CD1 3.83Å; L690-L708 WeakPolarHBondContact CB-O 3.41Å; L690-L708 HydrophobicContact CD2-CD1 3.84Å; L690-L708 HydrophobicContact CG-CD1 4.2Å; L690-L708 PolarHBondContact N-O 2.97Å; L690-L708 VanDerWaalsContact N-O 3.09Å; L690-V785 HydrophobicContact CD1-CG1 3.96Å
691	E	76.1	Confident	77.2	Confident	47 Å²	47	71.1 Å²	71.1	22%	0.22	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-59.9	-18.7	172.7	70.9	-72.4	172.1	0	0	114.7	N689 L705 S707 L708	N689-E691 VanDerWaalsContact CA-OE1 3.28Å; N689-E691 WeakPolarHBondContact CA-OE1 3.25Å; N689-E691 VanDerWaalsContact CA-OE2 3.27Å; N689-E691 WeakPolarHBondContact CA-OE2 3.12Å; N689-E691 PolarHBondContact O-N 3.43Å; E691-L705 HydrophobicContact CB-CB 3.65Å; E691-L705 HydrophobicContact CB-CD1 4.33Å; E691-S707 WeakPolarHBondContact OE2-CA 3.45Å; E691-L708 PolarHBondContact OE2-N 2.65Å
692	Q	78.9	Confident	78	Confident	134 Å²	134	75.3 Å²	75.3	63%	0.626	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-83.4	-17.9	174.2	-62.7	177.5	-15.6	0	0	112.4	N689 L690	N689-Q692 HydrophobicContact CB-CB 4.44Å; N689-Q692 HydrophobicContact CB-CG 3.99Å; N689-Q692 PolarHBondContact ND2-OE1 3.02Å; N689-Q692 VanDerWaalsContact ND2-OE1 3.16Å; N689-Q692 WeakPolarHBondContact O-CB 3.41Å; N689-Q692 PolarHBondContact O-N 3.28Å; L690-Q692 PolarHBondContact O-N 2.88Å
693	R	84.1	Confident	79.3	Confident	87 Å²	87	73.5 Å²	73.5	33%	0.328	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-5.7	-179.4	-64.1	-174.9	175.7	-144.3	1.4	113.5	L690 L780 E783	L690-R693 CarbonylContact O-C 3.59Å; L690-R693 PolarHBondContact O-N 3.46Å; R693-L780 PolarHBondContact O-N 3Å; R693-E783 IonicContact CZ-OE2 2.92Å; R693-E783 IonicContact NH1-OE2 3.26Å; R693-E783 PolarHBondContact NH1-OE2 2.95Å; R693-E783 IonicContact NH2-OE2 2.72Å; R693-E783 PolarHBondContact NH2-OE2 3.34Å
694	V	89.5	Confident	80.5	Confident	3 Å²	3	72.5 Å²	72.5	2%	0.018	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	120.6	-172.7	179.2	0	0	0	0	110.8	I643 L690 L705 I711 I777 T778	I643-V694 HydrophobicContact CD1-CG2 4.07Å; L690-V694 HydrophobicContact CD1-CG2 3.68Å; L690-V694 HydrophobicContact CG-CB 4.46Å; L690-V694 HydrophobicContact CG-CG2 3.9Å; L690-V694 PolarHBondContact O-N 2.93Å; V694-L705 WeakPolarHBondContact O-CD1 3.49Å; V694-I711 HydrophobicContact CG1-CD1 4.16Å; V694-I777 HydrophobicContact CG1-CG2 3.4Å; V694-I777 VanDerWaalsContact CG1-CG2 3.4Å; V694-T778 WeakPolarHBondContact CA-O 3.37Å
695	L	90.6	Very high	81.6	Confident	73 Å²	73	67.7 Å²	67.7	38%	0.382	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	127.9	166	-179.3	65	0	0	0	109.8	P702 I777 T778	L695-P702 HydrophobicContact CD1-CB 4.5Å; L695-I777 WeakPolarHBondContact O-CA 3.23Å; L695-T778 PolarHBondContact N-O 3.08Å; L695-T778 PolarHBondContact O-N 2.85Å
696	L	93.2	Very high	82.5	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	130.4	175.8	178.4	66.7	0	0	0	110.8	P702 I703 L705 V747 I769 V775 I777	L696-P702 CarbonylContact O-C 3.53Å; L696-P702 WeakPolarHBondContact O-CA 3.2Å; L696-I703 HydrophobicContact CD2-CB 4.27Å; L696-I703 HydrophobicContact CD2-CD1 4.5Å; L696-I703 PolarHBondContact O-N 3.25Å; L696-L705 HydrophobicContact CB-CD1 4.2Å; L696-L705 HydrophobicContact CB-CD2 3.95Å; L696-L705 HydrophobicContact CB-CG 4.21Å; L696-L705 HydrophobicContact CD2-CD2 3.75Å; L696-V747 HydrophobicContact CD2-CG1 4Å; L696-I769 HydrophobicContact CD2-CG2 4.11Å; L696-V775 HydrophobicContact CD1-CG1 3.58Å; L696-I777 HydrophobicContact CD1-CG1 4.16Å
697	E	93.7	Very high	83.4	Confident	35 Å²	35	65.2 Å²	65.2	16%	0.164	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	132.2	168.1	-71.7	165.7	-139.4	0	0	110	R701 P702 V775 K776	E697-R701 CarbonylContact C-O 3.47Å; E697-R701 VanDerWaalsContact CA-O 3.32Å; E697-R701 WeakPolarHBondContact CA-O 3.45Å; E697-P702 HydrophobicContact CG-CB 4.16Å; E697-V775 WeakPolarHBondContact O-CA 3.41Å; E697-K776 HydrophobicContact CB-CB 4.06Å; E697-K776 HydrophobicContact CB-CG 4.46Å; E697-K776 PolarHBondContact N-O 2.91Å; E697-K776 PolarHBondContact O-N 3.47Å; E697-K776 IonicContact OE1-NZ 2.71Å; E697-K776 PolarHBondContact OE1-NZ 3.37Å; E697-K776 WeakPolarHBondContact OE2-CD 3.47Å; E697-K776 IonicContact OE2-NZ 2.75Å; E697-K776 PolarHBondContact OE2-NZ 3.41Å
698	C	92.4	Very high	84.4	Confident	8 Å²	8	62.5 Å²	62.5	5%	0.054	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	124.6	176.4	-68.7	0	0	0	0	109.2	G700 R701 I703 C772 T774	C698-G700 PolarHBondContact O-N 2.75Å; C698-R701 PolarHBondContact N-O 2.77Å; C698-R701 WeakPolarHBondContact O-CB 3.22Å; C698-R701 PolarHBondContact O-N 2.72Å; C698-I703 HydrophobicContact CB-CD1 3.76Å; C698-I703 HydrophobicContact CB-CG1 4.42Å; C698-C772 HydrophobicContact CB-CB 3.8Å; C698-T774 WeakPolarHBondContact CA-O 3.4Å
699	D	91.9	Very high	85.4	Confident	74 Å²	74	57.8 Å²	57.8	40%	0.396	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.4	45.9	-176.1	-65.7	-28.2	0	0	0	113.6	R701 C772 R773 T774	D699-R701 VanDerWaalsContact C-N 3.28Å; D699-R701 PolarHBondContact O-N 3.06Å; D699-C772 VanDerWaalsContact OD2-CA 3.22Å; D699-C772 WeakPolarHBondContact OD2-CA 3.3Å; D699-C772 VanDerWaalsContact OD2-CB 3.32Å; D699-C772 WeakPolarHBondContact OD2-CB 3.06Å; D699-R773 VanDerWaalsContact CG-N 3.32Å; D699-R773 WeakPolarHBondContact OD1-CA 3.41Å; D699-R773 PolarHBondContact OD1-N 3.33Å; D699-R773 PolarHBondContact OD2-N 3.45Å; D699-T774 WeakPolarHBondContact CA-OG1 3.29Å; D699-T774 PolarHBondContact N-O 3.41Å; D699-T774 PolarHBondContact OD1-N 3.44Å; D699-T774 PolarHBondContact OD1-OG1 3.26Å
700	G	86.5	Confident	86.3	Confident	63 Å²	63	54.5 Å²	54.5	65%	0.649	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	75	7.6	179.4	0	0	0	0	0	115.3	C698	C698-G700 PolarHBondContact O-N 2.75Å
701	R	89.4	Confident	86.7	Confident	163 Å²	163	54.6 Å²	54.6	62%	0.615	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.5	122.1	179.4	-60.1	-179.4	-179.6	178.4	1.1	110.7	E697 C698 D699	E697-R701 CarbonylContact C-O 3.47Å; E697-R701 VanDerWaalsContact CA-O 3.32Å; E697-R701 WeakPolarHBondContact CA-O 3.45Å; C698-R701 PolarHBondContact N-O 2.77Å; C698-R701 WeakPolarHBondContact O-CB 3.22Å; C698-R701 PolarHBondContact O-N 2.72Å; D699-R701 VanDerWaalsContact C-N 3.28Å; D699-R701 PolarHBondContact O-N 3.06Å
702	P	90.1	Very high	87.5	Confident	89 Å²	89	52.3 Å²	52.3	58%	0.578	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.4	135.3	172.4	28.1	-33.5	0	0	0	110.2	L695 L696 E697	L695-P702 HydrophobicContact CD1-CB 4.5Å; L696-P702 CarbonylContact O-C 3.53Å; L696-P702 WeakPolarHBondContact O-CA 3.2Å; E697-P702 HydrophobicContact CG-CB 4.16Å
703	I	89.3	Confident	88.2	Confident	37 Å²	37	46 Å²	46	19%	0.19	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	123.4	177.6	-60	-172	0	0	0	109.1	L696 C698 L705 I769 A770	L696-I703 HydrophobicContact CD2-CB 4.27Å; L696-I703 HydrophobicContact CD2-CD1 4.5Å; L696-I703 PolarHBondContact O-N 3.25Å; C698-I703 HydrophobicContact CB-CD1 3.76Å; C698-I703 HydrophobicContact CB-CG1 4.42Å; I703-L705 PolarHBondContact O-N 3.5Å; I703-I769 HydrophobicContact CD1-CG2 4.02Å; I703-I769 HydrophobicContact CG2-CG2 3.73Å; I703-A770 HydrophobicContact CD1-CB 3.72Å
704	P	83.6	Confident	88.6	Confident	119 Å²	119	41.9 Å²	41.9	77%	0.773	25%	0.246	S	C	*	.	P	Polyproline II helix	trans	-68.2	123	173.2	28.7	-33.3	0	0	0	110
705	L	84.3	Confident	88.8	Confident	30 Å²	30	41.7 Å²	41.7	16%	0.157	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-87	138.5	-179.4	-64.6	177.1	0	0	0	111.2	E691 V694 L696 I703 L708 I711 I769	E691-L705 HydrophobicContact CB-CB 3.65Å; E691-L705 HydrophobicContact CB-CD1 4.33Å; V694-L705 WeakPolarHBondContact O-CD1 3.49Å; L696-L705 HydrophobicContact CB-CD1 4.2Å; L696-L705 HydrophobicContact CB-CD2 3.95Å; L696-L705 HydrophobicContact CB-CG 4.21Å; L696-L705 HydrophobicContact CD2-CD2 3.75Å; I703-L705 PolarHBondContact O-N 3.5Å; L705-L708 HydrophobicContact CB-CD2 4.03Å; L705-L708 HydrophobicContact CD1-CD2 4.48Å; L705-L708 HydrophobicContact CD2-CD2 4.14Å; L705-L708 HydrophobicContact CG-CD2 4.45Å; L705-I711 HydrophobicContact CD1-CD1 3.72Å; L705-I711 HydrophobicContact CD2-CD1 4.16Å; L705-I769 HydrophobicContact CD2-CD1 4.28Å
706	P	79.4	Confident	88.8	Confident	58 Å²	58	38.2 Å²	38.2	38%	0.377	23%	0.227	S	C	.	.	P	Polyproline II helix	trans	-74.5	169.6	167	34.6	-36.8	0	0	0	110.9	L708 F751	P706-L708 HydrophobicContact CG-CD2 4.3Å; P706-L708 WeakPolarHBondContact O-CD2 3.43Å; P706-L708 VanDerWaalsContact O-CG 3.27Å; P706-L708 WeakPolarHBondContact O-CG 3.43Å; P706-L708 PolarHBondContact O-N 2.67Å; P706-F751 HydrophobicContact CB-CE1 4.05Å; P706-F751 HydrophobicContact CG-CE1 3.79Å; P706-F751 HydrophobicContact CG-CZ 3.91Å
707	S	79.9	Confident	88.3	Confident	87 Å²	87	39.7 Å²	39.7	61%	0.608	24%	0.236	S	C	*	.	S	Bend	trans	-63.1	105.4	179	50	0	0	0	0	112.7	E691 F751	E691-S707 WeakPolarHBondContact OE2-CA 3.45Å; S707-F751 VanDerWaalsContact O-CD1 3.26Å; S707-F751 WeakPolarHBondContact O-CD1 3.23Å
708	L	84.1	Confident	87.8	Confident	3 Å²	3	38.4 Å²	38.4	2%	0.016	23%	0.231	C	C	.	.			trans	-136	163	-166.9	63.7	85.2	0	0	0	113.4	L690 E691 L705 P706 G710 I711 A749 F751	L690-L708 HydrophobicContact CB-CD1 3.83Å; L690-L708 WeakPolarHBondContact CB-O 3.41Å; L690-L708 HydrophobicContact CD2-CD1 3.84Å; L690-L708 HydrophobicContact CG-CD1 4.2Å; L690-L708 PolarHBondContact N-O 2.97Å; L690-L708 VanDerWaalsContact N-O 3.09Å; E691-L708 PolarHBondContact OE2-N 2.65Å; L705-L708 HydrophobicContact CB-CD2 4.03Å; L705-L708 HydrophobicContact CD1-CD2 4.48Å; L705-L708 HydrophobicContact CD2-CD2 4.14Å; L705-L708 HydrophobicContact CG-CD2 4.45Å; P706-L708 HydrophobicContact CG-CD2 4.3Å; P706-L708 WeakPolarHBondContact O-CD2 3.43Å; P706-L708 VanDerWaalsContact O-CG 3.27Å; P706-L708 WeakPolarHBondContact O-CG 3.43Å; P706-L708 PolarHBondContact O-N 2.67Å; L708-G710 WeakPolarHBondContact CD1-O 3.48Å; L708-I711 HydrophobicContact CD1-CG1 3.8Å; L708-I711 HydrophobicContact CD2-CG1 4.3Å; L708-A749 HydrophobicContact CD2-CB 4.2Å; L708-F751 HydrophobicContact CB-CD1 4.47Å
709	Q	85.2	Confident	87.2	Confident	31 Å²	31	38 Å²	38	15%	0.145	23%	0.229	C	C	.	.	S	Bend	trans	-111.1	-11.1	-179.3	-63.7	178.4	15	0	0	112.8	L645 Y687 V750 F751	L645-Q709 HydrophobicContact CB-CB 4.2Å; L645-Q709 WeakPolarHBondContact CB-O 3.48Å; L645-Q709 HydrophobicContact CD2-CB 4.23Å; L645-Q709 PolarHBondContact N-O 3.46Å; Y687-Q709 WeakPolarHBondContact O-CA 3.07Å; Q709-V750 CarbonylContact C-O 3.54Å; Q709-V750 PolarHBondContact N-O 3.22Å; Q709-F751 WeakPolarHBondContact CG-O 3.48Å; Q709-F751 PolarHBondContact NE2-O 3.4Å; Q709-F751 VanDerWaalsContact NE2-O 3.13Å
710	G	88.4	Confident	86.2	Confident	2 Å²	2	35.8 Å²	35.8	2%	0.021	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.7	158.4	174.5	0	0	0	0	0	113.3	I643 L708 V750	I643-G710 CarbonylContact O-C 3.6Å; I643-G710 WeakPolarHBondContact O-CA 3.35Å; L708-G710 WeakPolarHBondContact CD1-O 3.48Å; G710-V750 PolarHBondContact N-O 2.95Å; G710-V750 WeakPolarHBondContact O-CA 3.13Å; G710-V750 WeakPolarHBondContact O-CB 3.09Å; G710-V750 PolarHBondContact O-N 3.23Å
711	I	91.1	Very high	85.6	Confident	3 Å²	3	34.5 Å²	34.5	2%	0.015	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	134.6	171.6	-49.6	173.3	0	0	0	107.5	G642 I643 V694 L705 L708 V747 I769	G642-I711 WeakPolarHBondContact CA-O 3.32Å; I643-I711 HydrophobicContact CG2-CB 3.76Å; I643-I711 HydrophobicContact CG2-CD1 4.44Å; I643-I711 HydrophobicContact CG2-CG1 4.24Å; I643-I711 PolarHBondContact N-O 2.93Å; I643-I711 PolarHBondContact O-N 3.14Å; V694-I711 HydrophobicContact CG1-CD1 4.16Å; L705-I711 HydrophobicContact CD1-CD1 3.72Å; L705-I711 HydrophobicContact CD2-CD1 4.16Å; L708-I711 HydrophobicContact CD1-CG1 3.8Å; L708-I711 HydrophobicContact CD2-CG1 4.3Å; I711-V747 HydrophobicContact CG2-CG1 3.81Å; I711-I769 HydrophobicContact CG2-CD1 4.41Å
712	A	91.6	Very high	84.8	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	133.7	170.9	0	0	0	0	0	109.6	L714 Y719 V748	A712-L714 HydrophobicContact CB-CD2 4.05Å; A712-Y719 HydrophobicContact CB-CD2 4.49Å; A712-Y719 HydrophobicContact CB-CE2 3.78Å; A712-V748 PolarHBondContact N-O 2.92Å; A712-V748 PolarHBondContact O-N 3.18Å
713	V	93.9	Very high	84	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	117.3	173.1	-179.7	0	0	0	0	107	Y640 F641 L745 E746 V747 V775 I803	Y640-V713 CarbonylContact C-O 3.56Å; Y640-V713 VanDerWaalsContact CA-O 3.29Å; Y640-V713 WeakPolarHBondContact CA-O 3.22Å; Y640-V713 WeakPolarHBondContact CB-O 3.38Å; F641-V713 HydrophobicContact CB-CB 4.29Å; F641-V713 HydrophobicContact CD1-CB 4.33Å; F641-V713 HydrophobicContact CD1-CG2 4.17Å; F641-V713 PolarHBondContact N-O 3.08Å; F641-V713 PolarHBondContact O-N 2.75Å; V713-L745 HydrophobicContact CG1-CB 3.96Å; V713-L745 HydrophobicContact CG1-CD1 3.88Å; V713-L745 HydrophobicContact CG1-CD2 4.31Å; V713-L745 HydrophobicContact CG1-CG 4.28Å; V713-E746 CarbonylContact C-O 3.54Å; V713-E746 WeakPolarHBondContact CA-O 3.24Å; V713-V747 HydrophobicContact CG2-CG1 4.29Å; V713-V747 HydrophobicContact CG2-CG2 4.4Å; V713-V775 HydrophobicContact CG1-CG2 4.08Å; V713-V775 HydrophobicContact CG2-CG1 4.48Å; V713-I803 HydrophobicContact CB-CD1 4.37Å; V713-I803 HydrophobicContact CG1-CD1 4.18Å; V713-I803 HydrophobicContact CG2-CD1 4.39Å
714	L	92.8	Very high	83.4	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	140.9	-170.8	-41	177	0	0	0	110.6	A712 Y719 F725 L745 E746 V748	A712-L714 HydrophobicContact CB-CD2 4.05Å; L714-Y719 HydrophobicContact CD2-CD2 3.48Å; L714-Y719 VanDerWaalsContact CD2-CD2 3.48Å; L714-Y719 HydrophobicContact CD2-CE2 4.07Å; L714-Y719 HydrophobicContact CD2-CG 4.42Å; L714-F725 HydrophobicContact CD1-CB 4.17Å; L714-L745 WeakPolarHBondContact O-CA 3.46Å; L714-L745 VanDerWaalsContact O-CD2 3.32Å; L714-L745 WeakPolarHBondContact O-CD2 3.43Å; L714-E746 HydrophobicContact CB-CB 4.15Å; L714-E746 HydrophobicContact CD1-CB 4.43Å; L714-E746 HydrophobicContact CG-CB 4.46Å; L714-E746 PolarHBondContact N-O 2.98Å; L714-E746 PolarHBondContact O-N 3.01Å; L714-E746 VanDerWaalsContact O-N 3.07Å; L714-V748 HydrophobicContact CD1-CG2 4.28Å
715	N	93.3	Very high	82.8	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	14%	0.138	C	C	.	.	S	Bend	trans	-108.5	-13.5	163.1	-179.9	63.8	0	0	0	111.6	D311 W313 N638 N639 F740 L745	D311-N715 PolarHBondContact O-ND2 3.4Å; W313-N715 VanDerWaalsContact NE1-CG 3.33Å; W313-N715 PolarHBondContact NE1-OD1 3.17Å; N638-N715 PolarHBondContact O-ND2 3.3Å; N639-N715 PolarHBondContact O-N 3.13Å; N715-F740 VanDerWaalsContact O-CB 3.24Å; N715-F740 WeakPolarHBondContact O-CB 3.4Å; N715-L745 HydrophobicContact CB-CD2 3.94Å
716	I	90.5	Very high	82.3	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	13%	0.131	C	C	.	.	S	Bend	trans	-132.8	146.1	176.3	72.9	170	0	0	0	110.8	D278 V282 L310 N639 S718 F740	D278-I716 HydrophobicContact CB-CD1 4.23Å; V282-I716 HydrophobicContact CG1-CB 4.4Å; V282-I716 HydrophobicContact CG2-CB 4.16Å; V282-I716 HydrophobicContact CG2-CD1 4.08Å; V282-I716 HydrophobicContact CG2-CG1 4.4Å; L310-I716 HydrophobicContact CD1-CG2 4.33Å; N639-I716 HydrophobicContact CB-CD1 3.68Å; N639-I716 HydrophobicContact CB-CG1 3.97Å; N639-I716 PolarHBondContact O-N 2.87Å; I716-S718 PolarHBondContact O-N 3.2Å; I716-F740 HydrophobicContact CG2-CB 4.08Å
717	P	83.6	Confident	81.7	Confident	31 Å²	31	15.7 Å²	15.7	20%	0.201	12%	0.115	C	C	.	.	S	Bend	trans	-76	21.2	-178.9	31.4	-37.3	0	0	0	114.5	V282 P738	V282-P717 HydrophobicContact CG1-CG 4.47Å; V282-P717 HydrophobicContact CG2-CG 4.28Å; P717-P738 HydrophobicContact CB-CG 4.17Å
718	S	82.4	Confident	80.8	Confident	7 Å²	7	13.4 Å²	13.4	5%	0.049	11%	0.105	C	C	.	.			trans	-127.6	118.4	179.1	-173.7	0	0	0	0	110.7	D278 V282 I716 G722	D278-S718 PolarHBondContact OD1-OG 3.34Å; V282-S718 VanDerWaalsContact CG2-CB 3.41Å; I716-S718 PolarHBondContact O-N 3.2Å; S718-G722 WeakPolarHBondContact OG-CA 3.3Å
719	Y	80.6	Confident	79.5	Confident	1 Å²	1	19 Å²	19	0%	0.004	14%	0.139	C	C	.	.	B	Isolated β-bridge	trans	-127.9	143.5	-172.2	-175.1	-84.6	0	0	0	111.3	Y640 D646 A712 L714 G721 G722 T723 F725 M756	Y640-Y719 HydrophobicContact CD1-CD2 4.19Å; Y640-Y719 AromaticContact CD2-CD2 3.61Å; Y640-Y719 HydrophobicContact CD2-CD2 3.61Å; Y640-Y719 AromaticContact CD2-CE2 3.31Å; Y640-Y719 HydrophobicContact CD2-CE2 3.31Å; Y640-Y719 HydrophobicContact CE1-CD2 4.43Å; Y640-Y719 AromaticContact CE2-CD2 3.83Å; Y640-Y719 HydrophobicContact CE2-CD2 3.83Å; Y640-Y719 AromaticContact CE2-CE2 3.44Å; Y640-Y719 HydrophobicContact CE2-CE2 3.44Å; Y640-Y719 VanDerWaalsContact CE2-CE2 3.44Å; Y640-Y719 AromaticContact CE2-CZ 3.97Å; Y640-Y719 AromaticContact CG-CD2 3.81Å; Y640-Y719 HydrophobicContact CG-CD2 3.81Å; Y640-Y719 AromaticContact CG-CE2 3.99Å; Y640-Y719 HydrophobicContact CG-CE2 3.99Å; D646-Y719 WeakPolarHBondContact CB-OH 3.45Å; D646-Y719 WeakPolarHBondContact OD1-CE1 3.41Å; D646-Y719 PolarHBondContact OD1-OH 2.78Å; D646-Y719 PolarHBondContact OD2-OH 2.74Å; A712-Y719 HydrophobicContact CB-CD2 4.49Å; A712-Y719 HydrophobicContact CB-CE2 3.78Å; L714-Y719 HydrophobicContact CD2-CD2 3.48Å; L714-Y719 VanDerWaalsContact CD2-CD2 3.48Å; L714-Y719 HydrophobicContact CD2-CE2 4.07Å; L714-Y719 HydrophobicContact CD2-CG 4.42Å; Y719-G721 VanDerWaalsContact C-N 3.28Å; Y719-G721 PolarHBondContact O-N 3.45Å; Y719-G721 VanDerWaalsContact O-N 3.09Å; Y719-G722 PolarHBondContact O-N 3.27Å; Y719-T723 WeakPolarHBondContact CB-O 3.45Å; Y719-T723 PolarHBondContact N-O 3.43Å; Y719-T723 WeakPolarHBondContact O-CA 3.02Å; Y719-T723 VanDerWaalsContact O-CB 3.23Å; Y719-T723 WeakPolarHBondContact O-CB 3.27Å; Y719-T723 PolarHBondContact O-N 3.24Å; Y719-T723 PolarHBondContact O-OG1 2.89Å; Y719-T723 VanDerWaalsContact O-OG1 3.08Å; Y719-F725 AromaticContact CD1-CD2 3.66Å; Y719-F725 HydrophobicContact CD1-CD2 3.66Å; Y719-F725 HydrophobicContact CD1-CE1 4.35Å; Y719-F725 AromaticContact CD1-CE2 3.24Å; Y719-F725 HydrophobicContact CD1-CE2 3.24Å; Y719-F725 HydrophobicContact CD1-CG 4.38Å; Y719-F725 AromaticContact CD1-CZ 3.63Å; Y719-F725 HydrophobicContact CD1-CZ 3.63Å; Y719-F725 HydrophobicContact CD2-CD2 4.18Å; Y719-F725 HydrophobicContact CD2-CE2 4.37Å; Y719-F725 AromaticContact CE1-CD2 4Å; Y719-F725 HydrophobicContact CE1-CD2 4Å; Y719-F725 AromaticContact CE1-CE2 3.23Å; Y719-F725 HydrophobicContact CE1-CE2 3.23Å; Y719-F725 AromaticContact CE1-CZ 3.75Å; Y719-F725 HydrophobicContact CE1-CZ 3.75Å; Y719-F725 HydrophobicContact CE2-CD2 4.4Å; Y719-F725 HydrophobicContact CE2-CE2 4.29Å; Y719-F725 AromaticContact CG-CD2 3.77Å; Y719-F725 HydrophobicContact CG-CD2 3.77Å; Y719-F725 AromaticContact CG-CE2 3.86Å; Y719-F725 HydrophobicContact CG-CE2 3.86Å; Y719-F725 HydrophobicContact CG-CG 4.4Å; Y719-F725 AromaticContact CZ-CE2 3.76Å; Y719-M756 HydrophobicContact CE1-CE 4.1Å
720	A	71.4	Confident	78.1	Confident	26 Å²	26	25.3 Å²	25.3	22%	0.215	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	40	49.5	176.3	0	0	0	0	0	114.6	R760	A720-R760 PolarHBondContact O-NH2 2.94Å
721	G	72	Confident	76.8	Confident	36 Å²	36	32.3 Å²	32.3	37%	0.371	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.4	24.2	173.4	0	0	0	0	0	116	D278 R281 Y719	D278-G721 WeakPolarHBondContact OD1-CA 3.4Å; D278-G721 PolarHBondContact OD1-N 3.26Å; D278-G721 VanDerWaalsContact OD1-N 3.08Å; D278-G721 VanDerWaalsContact OD2-CA 3.26Å; D278-G721 WeakPolarHBondContact OD2-CA 3.15Å; D278-G721 PolarHBondContact OD2-N 3.07Å; R281-G721 VanDerWaalsContact CZ-O 3.22Å; R281-G721 PolarHBondContact NE-O 3.43Å; R281-G721 VanDerWaalsContact NH2-CA 3.29Å; R281-G721 PolarHBondContact NH2-O 3.43Å; Y719-G721 VanDerWaalsContact C-N 3.28Å; Y719-G721 PolarHBondContact O-N 3.45Å; Y719-G721 VanDerWaalsContact O-N 3.09Å
722	G	72.5	Confident	75.6	Confident	42 Å²	42	35.5 Å²	35.5	43%	0.433	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	108.5	14.1	176.7	0	0	0	0	0	115.7	D278 S718 Y719	D278-G722 PolarHBondContact OD1-N 3.2Å; S718-G722 WeakPolarHBondContact OG-CA 3.3Å; Y719-G722 PolarHBondContact O-N 3.27Å
723	T	73.7	Confident	74.1	Confident	9 Å²	9	44.2 Å²	44.2	6%	0.055	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-82.4	134.1	174.7	-33.5	0	0	0	0	108.8	Y719 F725 S759 R760	Y719-T723 WeakPolarHBondContact CB-O 3.45Å; Y719-T723 PolarHBondContact N-O 3.43Å; Y719-T723 WeakPolarHBondContact O-CA 3.02Å; Y719-T723 VanDerWaalsContact O-CB 3.23Å; Y719-T723 WeakPolarHBondContact O-CB 3.27Å; Y719-T723 PolarHBondContact O-N 3.24Å; Y719-T723 PolarHBondContact O-OG1 2.89Å; Y719-T723 VanDerWaalsContact O-OG1 3.08Å; T723-F725 HydrophobicContact CG2-CD1 3.93Å; T723-F725 HydrophobicContact CG2-CE1 3.69Å; T723-S759 VanDerWaalsContact CG2-OG 3.24Å; T723-S759 WeakPolarHBondContact CG2-OG 3.47Å; T723-R760 HydrophobicContact CG2-CG 4.05Å
724	N	76.3	Confident	73.2	Confident	37 Å²	37	49.7 Å²	49.7	20%	0.198	30%	0.296	C	S	.	.			trans	-101.4	111.7	174.6	179	-10.4	0	0	0	109.2	W726 G727 H766	N724-W726 PolarHBondContact OD1-N 3.24Å; N724-G727 PolarHBondContact ND2-O 3.07Å; N724-G727 PolarHBondContact OD1-N 3.28Å; N724-H766 PolarHBondContact O-CE1 2.95Å
725	F	72.1	Confident	72.6	Confident	5 Å²	5	51.7 Å²	51.7	2%	0.022	31%	0.305	C	S	.	.	S	Bend	trans	-90.8	-11.4	-179.7	-80.9	-2.4	0	0	0	114.2	L714 Y719 T723 V748 V750 M756 H766	L714-F725 HydrophobicContact CD1-CB 4.17Å; Y719-F725 AromaticContact CD1-CD2 3.66Å; Y719-F725 HydrophobicContact CD1-CD2 3.66Å; Y719-F725 HydrophobicContact CD1-CE1 4.35Å; Y719-F725 AromaticContact CD1-CE2 3.24Å; Y719-F725 HydrophobicContact CD1-CE2 3.24Å; Y719-F725 HydrophobicContact CD1-CG 4.38Å; Y719-F725 AromaticContact CD1-CZ 3.63Å; Y719-F725 HydrophobicContact CD1-CZ 3.63Å; Y719-F725 HydrophobicContact CD2-CD2 4.18Å; Y719-F725 HydrophobicContact CD2-CE2 4.37Å; Y719-F725 AromaticContact CE1-CD2 4Å; Y719-F725 HydrophobicContact CE1-CD2 4Å; Y719-F725 AromaticContact CE1-CE2 3.23Å; Y719-F725 HydrophobicContact CE1-CE2 3.23Å; Y719-F725 AromaticContact CE1-CZ 3.75Å; Y719-F725 HydrophobicContact CE1-CZ 3.75Å; Y719-F725 HydrophobicContact CE2-CD2 4.4Å; Y719-F725 HydrophobicContact CE2-CE2 4.29Å; Y719-F725 AromaticContact CG-CD2 3.77Å; Y719-F725 HydrophobicContact CG-CD2 3.77Å; Y719-F725 AromaticContact CG-CE2 3.86Å; Y719-F725 HydrophobicContact CG-CE2 3.86Å; Y719-F725 HydrophobicContact CG-CG 4.4Å; Y719-F725 AromaticContact CZ-CE2 3.76Å; T723-F725 HydrophobicContact CG2-CD1 3.93Å; T723-F725 HydrophobicContact CG2-CE1 3.69Å; F725-V748 HydrophobicContact CB-CG1 4.4Å; F725-V750 HydrophobicContact CE2-CG2 4.3Å; F725-M756 HydrophobicContact CZ-CB 4.46Å; F725-M756 HydrophobicContact CZ-CE 4.34Å; F725-M756 HydrophobicContact CZ-CG 4.16Å; F725-H766 AromaticContact CD1-CD2 3.74Å; F725-H766 AromaticContact CD1-NE2 3.28Å; F725-H766 VanDerWaalsContact CD1-NE2 3.28Å; F725-H766 WeakPolarHBondContact CD1-NE2 3.06Å; F725-H766 AromaticContact CE1-NE2 3.36Å; F725-H766 WeakPolarHBondContact CE1-NE2 3.45Å; F725-H766 WeakPolarHBondContact O-CB 3.11Å; F725-H766 PolarHBondContact O-ND1 2.95Å
726	W	73.6	Confident	72	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.015	32%	0.322	C	S	.	.	S	Bend	trans	-88.2	-31.5	174.3	-163	-108.2	0	0	0	112.5	N724 F735 T736 P738 E746 V748 R768 Q771	N724-W726 PolarHBondContact OD1-N 3.24Å; W726-F735 AromaticContact CH2-CD1 3.78Å; W726-F735 HydrophobicContact CH2-CD1 3.78Å; W726-F735 AromaticContact CH2-CE1 3.95Å; W726-F735 HydrophobicContact CH2-CE1 3.95Å; W726-F735 HydrophobicContact CH2-CG 4.36Å; W726-F735 HydrophobicContact CZ2-CB 3.94Å; W726-F735 AromaticContact CZ2-CD1 3.57Å; W726-F735 HydrophobicContact CZ2-CD1 3.57Å; W726-F735 HydrophobicContact CZ2-CE1 4.21Å; W726-F735 AromaticContact CZ2-CG 3.84Å; W726-F735 HydrophobicContact CZ2-CG 3.84Å; W726-T736 PolarHBondContact NE1-O 2.91Å; W726-P738 HydrophobicContact CB-CB 4.47Å; W726-P738 HydrophobicContact CB-CG 4.25Å; W726-P738 HydrophobicContact CG-CB 4.16Å; W726-P738 HydrophobicContact CG-CG 4.12Å; W726-E746 HydrophobicContact CB-CG 4.48Å; W726-E746 HydrophobicContact CD2-CB 4.02Å; W726-E746 HydrophobicContact CD2-CG 3.29Å; W726-E746 HydrophobicContact CE3-CB 3.48Å; W726-E746 VanDerWaalsContact CE3-CB 3.48Å; W726-E746 HydrophobicContact CE3-CG 3.3Å; W726-E746 HydrophobicContact CG-CG 3.86Å; W726-E746 HydrophobicContact CH2-CB 4.3Å; W726-E746 HydrophobicContact CH2-CG 3.92Å; W726-E746 HydrophobicContact CZ2-CG 3.91Å; W726-E746 HydrophobicContact CZ3-CB 3.64Å; W726-E746 HydrophobicContact CZ3-CG 3.63Å; W726-V748 HydrophobicContact CE3-CG2 3.7Å; W726-V748 HydrophobicContact CZ3-CG2 3.98Å; W726-R768 HydrophobicContact CD2-CG 3.84Å; W726-R768 VanDerWaalsContact CE2-CD 3.44Å; W726-R768 HydrophobicContact CE3-CB 4.11Å; W726-R768 HydrophobicContact CE3-CG 3.52Å; W726-R768 HydrophobicContact CH2-CB 3.72Å; W726-R768 HydrophobicContact CH2-CG 3.9Å; W726-R768 HydrophobicContact CZ2-CB 4.34Å; W726-R768 HydrophobicContact CZ2-CG 4.18Å; W726-R768 HydrophobicContact CZ3-CB 3.6Å; W726-R768 HydrophobicContact CZ3-CG 3.57Å; W726-Q771 HydrophobicContact CH2-CG 3.71Å; W726-Q771 HydrophobicContact CZ2-CG 3.59Å
727	G	67.7	Low	71.6	Confident	4 Å²	4	56.1 Å²	56.1	4%	0.041	34%	0.335	C	S	.	.			trans	100.1	-124.7	176.9	0	0	0	0	0	113.4	N724	N724-G727 PolarHBondContact ND2-O 3.07Å; N724-G727 PolarHBondContact OD1-N 3.28Å
728	G	59.5	Low	71.7	Confident	39 Å²	39	55.5 Å²	55.5	40%	0.402	33%	0.331	S	S	.	.			trans	-64.3	140.3	-168.5	0	0	0	0	0	114.1	K730	G728-K730 PolarHBondContact O-N 3.4Å
729	T	57.7	Low	71.9	Confident	120 Å²	120	56.4 Å²	56.4	74%	0.736	34%	0.338	S	S	*	.	S	Bend	trans	-79.4	40	170.8	56.7	0	0	0	0	112.1
730	K	56.2	Low	72.3	Confident	165 Å²	165	57.2 Å²	57.2	72%	0.717	34%	0.341	S	S	*	.	S	Bend	trans	-143.3	147.2	-179.6	-66.8	-172	179.1	-176.5	0	108.8	G728	G728-K730 PolarHBondContact O-N 3.4Å
731	E	60.4	Low	73.2	Confident	149 Å²	149	58.2 Å²	58.2	70%	0.696	34%	0.343	S	S	*	.			trans	-63.8	133.8	171	-61	166.1	165.7	0	0	109.4	A737	E731-A737 HydrophobicContact CG-CB 4.15Å
732	D	65.3	Low	74.1	Confident	69 Å²	69	58.9 Å²	58.9	37%	0.369	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-103.2	163.4	165.8	-70.7	-44.1	0	0	0	108.1	T734 F735 R768	D732-T734 PolarHBondContact O-N 2.98Å; D732-F735 PolarHBondContact N-O 3.5Å; D732-F735 PolarHBondContact O-N 3.48Å; D732-F735 VanDerWaalsContact O-N 3.17Å; D732-F735 VanDerWaalsContact O-O 3.12Å; D732-R768 IonicContact OD2-CZ 3.18Å; D732-R768 IonicContact OD2-NH1 2.72Å; D732-R768 PolarHBondContact OD2-NH1 3.27Å; D732-R768 IonicContact OD2-NH2 2.75Å; D732-R768 PolarHBondContact OD2-NH2 3.36Å
733	D	59.8	Low	75.1	Confident	184 Å²	184	60.5 Å²	60.5	98%	0.984	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-5.5	-179.1	-64.2	-42.5	0	0	0	115.5
734	T	75.4	Confident	76	Confident	115 Å²	115	61.6 Å²	61.6	71%	0.706	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.6	-21.4	-177.7	-45.1	0	0	0	0	114.1	D732	D732-T734 PolarHBondContact O-N 2.98Å
735	F	80.1	Confident	76.8	Confident	43 Å²	43	59.9 Å²	59.9	19%	0.189	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-145.5	140.1	-167.4	-71.2	-70.3	0	0	0	111.6	W726 D732 R768	W726-F735 AromaticContact CH2-CD1 3.78Å; W726-F735 HydrophobicContact CH2-CD1 3.78Å; W726-F735 AromaticContact CH2-CE1 3.95Å; W726-F735 HydrophobicContact CH2-CE1 3.95Å; W726-F735 HydrophobicContact CH2-CG 4.36Å; W726-F735 HydrophobicContact CZ2-CB 3.94Å; W726-F735 AromaticContact CZ2-CD1 3.57Å; W726-F735 HydrophobicContact CZ2-CD1 3.57Å; W726-F735 HydrophobicContact CZ2-CE1 4.21Å; W726-F735 AromaticContact CZ2-CG 3.84Å; W726-F735 HydrophobicContact CZ2-CG 3.84Å; D732-F735 PolarHBondContact N-O 3.5Å; D732-F735 PolarHBondContact O-N 3.48Å; D732-F735 VanDerWaalsContact O-N 3.17Å; D732-F735 VanDerWaalsContact O-O 3.12Å; F735-R768 HydrophobicContact CD2-CB 4.37Å; F735-R768 HydrophobicContact CE1-CB 4.43Å; F735-R768 HydrophobicContact CE2-CB 3.87Å; F735-R768 HydrophobicContact CZ-CB 3.9Å
736	T	81.8	Confident	77.8	Confident	60 Å²	60	59.6 Å²	59.6	37%	0.368	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-74.9	160	177	54.7	0	0	0	0	111.4	W726 Q771	W726-T736 PolarHBondContact NE1-O 2.91Å; T736-Q771 VanDerWaalsContact N-OE1 3.11Å; T736-Q771 PolarHBondContact O-NE2 2.76Å; T736-Q771 PolarHBondContact OG1-NE2 2.88Å; T736-Q771 VanDerWaalsContact OG1-NE2 3.08Å; T736-Q771 PolarHBondContact OG1-OE1 3.38Å
737	A	81.6	Confident	78.7	Confident	32 Å²	32	59.4 Å²	59.4	26%	0.264	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-62.3	136.8	167.1	0	0	0	0	0	109.4	E731	E731-A737 HydrophobicContact CG-CB 4.15Å
738	P	85.3	Confident	79.7	Confident	19 Å²	19	59.2 Å²	59.2	12%	0.123	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-75.6	134.5	-173.8	31.7	-34.2	0	0	0	110.1	P717 W726 E746	P717-P738 HydrophobicContact CB-CG 4.17Å; W726-P738 HydrophobicContact CB-CB 4.47Å; W726-P738 HydrophobicContact CB-CG 4.25Å; W726-P738 HydrophobicContact CG-CB 4.16Å; W726-P738 HydrophobicContact CG-CG 4.12Å; P738-E746 HydrophobicContact CB-CG 4.15Å; P738-E746 WeakPolarHBondContact CB-OE2 3.37Å
739	S	86.6	Confident	81	Confident	26 Å²	26	57.6 Å²	57.6	18%	0.182	31%	0.308	C	S	.	.			trans	-136.1	164.3	175.4	-153.8	0	0	0	0	111.4	D741	S739-D741 WeakPolarHBondContact CB-OD1 3.47Å; S739-D741 PolarHBondContact OG-OD1 3.42Å
740	F	89.4	Confident	82.2	Confident	18 Å²	18	52.3 Å²	52.3	8%	0.079	28%	0.275	C	S	.	.	S	Bend	trans	-110.9	13.6	-179.2	59.6	-96.1	0	0	0	112.4	V282 L283 K308 M309 L310 D311 N715 I716 T813	V282-F740 HydrophobicContact CG1-CD1 3.57Å; V282-F740 HydrophobicContact CG1-CE1 3.51Å; V282-F740 HydrophobicContact CG1-CZ 4.4Å; L283-F740 HydrophobicContact CD2-CE2 4.13Å; L283-F740 HydrophobicContact CD2-CZ 4.16Å; K308-F740 HydrophobicContact CB-CE2 4.02Å; K308-F740 HydrophobicContact CB-CZ 4.41Å; K308-F740 HydrophobicContact CD-CE2 4.1Å; K308-F740 HydrophobicContact CD-CZ 3.72Å; M309-F740 VanDerWaalsContact O-CD2 3.28Å; M309-F740 WeakPolarHBondContact O-CD2 3.46Å; M309-F740 WeakPolarHBondContact O-CE2 3.37Å; L310-F740 WeakPolarHBondContact CA-O 3.14Å; L310-F740 HydrophobicContact CD1-CB 4.02Å; L310-F740 HydrophobicContact CD1-CD2 3.95Å; L310-F740 HydrophobicContact CD1-CG 4.33Å; D311-F740 PolarHBondContact N-O 3.29Å; N715-F740 VanDerWaalsContact O-CB 3.24Å; N715-F740 WeakPolarHBondContact O-CB 3.4Å; I716-F740 HydrophobicContact CG2-CB 4.08Å; F740-T813 HydrophobicContact CZ-CG2 4.22Å
741	D	90	Very high	83.2	Confident	47 Å²	47	46.3 Å²	46.3	25%	0.251	25%	0.249	S	C	.	.	S	Bend	trans	-134.2	7.9	-175	59.1	6.1	0	0	0	115	K308 M309 D311 S739	K308-D741 IonicContact NZ-OD1 3.4Å; K308-D741 IonicContact NZ-OD2 2.71Å; K308-D741 PolarHBondContact NZ-OD2 3.15Å; M309-D741 HydrophobicContact CB-CB 4.19Å; D311-D741 WeakPolarHBondContact OD2-CA 3.45Å; D311-D741 PolarHBondContact OD2-N 3.35Å; S739-D741 WeakPolarHBondContact CB-OD1 3.47Å; S739-D741 PolarHBondContact OG-OD1 3.42Å
742	D	91.3	Very high	83.9	Confident	50 Å²	50	39.6 Å²	39.6	27%	0.267	22%	0.22	S	C	.	.	S	Bend	trans	-105.6	-4.6	-176.3	69.8	0	0	0	0	115.1	D311 I744	D311-D742 PolarHBondContact OD2-N 2.92Å; D311-D742 VanDerWaalsContact OD2-N 3.1Å; D742-I744 WeakPolarHBondContact OD1-CB 3.5Å; D742-I744 PolarHBondContact OD1-N 2.84Å
743	K	92.9	Very high	84	Confident	75 Å²	75	37 Å²	37	33%	0.326	21%	0.207	S	C	.	.	S	Bend	trans	63.2	36.1	-173.4	-48.7	-176.1	173.3	-157.5	0	115.4	D311 H805	D311-K743 WeakPolarHBondContact OD1-CG 3.16Å; D311-K743 WeakPolarHBondContact OD2-CA 3.38Å; D311-K743 PolarHBondContact OD2-N 3.45Å; K743-H805 WeakPolarHBondContact CE-NE2 3.33Å; K743-H805 PolarHBondContact NZ-NE2 3.45Å; K743-H805 VanDerWaalsContact NZ-NE2 3.2Å
744	I	92.9	Very high	84.1	Confident	33 Å²	33	34.6 Å²	34.6	17%	0.169	19%	0.192	C	C	.	.			trans	-114.1	152.7	173.8	-60.2	-179.8	0	0	0	109.3	D742 Q771	D742-I744 WeakPolarHBondContact OD1-CB 3.5Å; D742-I744 PolarHBondContact OD1-N 2.84Å; I744-Q771 HydrophobicContact CG2-CB 3.63Å; I744-Q771 HydrophobicContact CG2-CG 3.74Å
745	L	93.8	Very high	83.5	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	128.9	170.5	-69.4	173.4	0	0	0	109.9	W313 M637 V713 L714 N715 Q771 C772 V775 I803	W313-L745 HydrophobicContact CD2-CD1 3.88Å; W313-L745 HydrophobicContact CD2-CD2 3.86Å; W313-L745 HydrophobicContact CD2-CG 4Å; W313-L745 HydrophobicContact CE3-CD1 3.6Å; W313-L745 HydrophobicContact CE3-CD2 4.41Å; W313-L745 HydrophobicContact CE3-CG 4.06Å; W313-L745 HydrophobicContact CG-CD2 4.19Å; W313-L745 HydrophobicContact CH2-CD1 4.12Å; W313-L745 HydrophobicContact CH2-CD2 4.45Å; W313-L745 HydrophobicContact CH2-CG 3.8Å; W313-L745 HydrophobicContact CZ2-CD1 4.34Å; W313-L745 HydrophobicContact CZ2-CD2 3.88Å; W313-L745 HydrophobicContact CZ2-CG 3.71Å; W313-L745 HydrophobicContact CZ3-CD1 3.74Å; W313-L745 HydrophobicContact CZ3-CG 3.97Å; M637-L745 HydrophobicContact CE-CD1 4.2Å; M637-L745 HydrophobicContact CE-CD2 3.62Å; V713-L745 HydrophobicContact CG1-CB 3.96Å; V713-L745 HydrophobicContact CG1-CD1 3.88Å; V713-L745 HydrophobicContact CG1-CD2 4.31Å; V713-L745 HydrophobicContact CG1-CG 4.28Å; L714-L745 WeakPolarHBondContact O-CA 3.46Å; L714-L745 VanDerWaalsContact O-CD2 3.32Å; L714-L745 WeakPolarHBondContact O-CD2 3.43Å; N715-L745 HydrophobicContact CB-CD2 3.94Å; L745-Q771 WeakPolarHBondContact O-CA 3.46Å; L745-C772 PolarHBondContact N-O 2.81Å; L745-C772 PolarHBondContact O-N 3.02Å; L745-C772 VanDerWaalsContact O-N 3.13Å; L745-V775 HydrophobicContact CD1-CG2 4.11Å; L745-I803 HydrophobicContact CD1-CB 4.47Å; L745-I803 HydrophobicContact CD1-CG2 3.64Å
746	E	92.6	Very high	82.8	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	125.8	170.6	-79.8	79.4	-134.7	0	0	111	V713 L714 W726 P738 Q771	V713-E746 CarbonylContact C-O 3.54Å; V713-E746 WeakPolarHBondContact CA-O 3.24Å; L714-E746 HydrophobicContact CB-CB 4.15Å; L714-E746 HydrophobicContact CD1-CB 4.43Å; L714-E746 HydrophobicContact CG-CB 4.46Å; L714-E746 PolarHBondContact N-O 2.98Å; L714-E746 PolarHBondContact O-N 3.01Å; L714-E746 VanDerWaalsContact O-N 3.07Å; W726-E746 HydrophobicContact CB-CG 4.48Å; W726-E746 HydrophobicContact CD2-CB 4.02Å; W726-E746 HydrophobicContact CD2-CG 3.29Å; W726-E746 HydrophobicContact CE3-CB 3.48Å; W726-E746 VanDerWaalsContact CE3-CB 3.48Å; W726-E746 HydrophobicContact CE3-CG 3.3Å; W726-E746 HydrophobicContact CG-CG 3.86Å; W726-E746 HydrophobicContact CH2-CB 4.3Å; W726-E746 HydrophobicContact CH2-CG 3.92Å; W726-E746 HydrophobicContact CZ2-CG 3.91Å; W726-E746 HydrophobicContact CZ3-CB 3.64Å; W726-E746 HydrophobicContact CZ3-CG 3.63Å; P738-E746 HydrophobicContact CB-CG 4.15Å; P738-E746 WeakPolarHBondContact CB-OE2 3.37Å; E746-Q771 HydrophobicContact CG-CG 4.1Å; E746-Q771 PolarHBondContact OE1-NE2 3.17Å
747	V	91.8	Very high	81.7	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	125.9	176.5	-168.3	0	0	0	0	109.8	L696 I711 V713 I769 A770 V775	L696-V747 HydrophobicContact CD2-CG1 4Å; I711-V747 HydrophobicContact CG2-CG1 3.81Å; V713-V747 HydrophobicContact CG2-CG1 4.29Å; V713-V747 HydrophobicContact CG2-CG2 4.4Å; V747-I769 HydrophobicContact CB-CB 4.32Å; V747-I769 HydrophobicContact CG1-CB 4.27Å; V747-I769 HydrophobicContact CG1-CD1 4.06Å; V747-I769 WeakPolarHBondContact O-CB 3.5Å; V747-I769 PolarHBondContact O-N 3.38Å; V747-A770 HydrophobicContact CB-CB 4.5Å; V747-A770 PolarHBondContact N-O 2.82Å; V747-A770 PolarHBondContact O-N 3.42Å; V747-V775 HydrophobicContact CG2-CG2 4.28Å
748	V	88.9	Confident	80.6	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	137.4	-172.2	-173.6	0	0	0	0	111.6	A712 L714 F725 W726 H766	A712-V748 PolarHBondContact N-O 2.92Å; A712-V748 PolarHBondContact O-N 3.18Å; L714-V748 HydrophobicContact CD1-CG2 4.28Å; F725-V748 HydrophobicContact CB-CG1 4.4Å; W726-V748 HydrophobicContact CE3-CG2 3.7Å; W726-V748 HydrophobicContact CZ3-CG2 3.98Å; V748-H766 HydrophobicContact CG1-CB 3.78Å
749	A	87.1	Confident	79.4	Confident	4 Å²	4	33.1 Å²	33.1	3%	0.033	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	137.9	175.5	0	0	0	0	0	112.5	L708 F751 H767 I769	L708-A749 HydrophobicContact CD2-CB 4.2Å; A749-F751 HydrophobicContact CB-CD2 4.42Å; A749-F751 HydrophobicContact CB-CE2 3.64Å; A749-F751 HydrophobicContact CB-CZ 3.73Å; A749-H767 HydrophobicContact CB-CB 4.24Å; A749-H767 PolarHBondContact N-O 2.95Å; A749-I769 HydrophobicContact CB-CD1 3.88Å; A749-I769 HydrophobicContact CB-CG1 4.11Å
750	V	83.1	Confident	78	Confident	9 Å²	9	39 Å²	39	6%	0.055	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	107.1	173.6	-176.2	0	0	0	0	109.3	Q709 G710 F725 M756	Q709-V750 CarbonylContact C-O 3.54Å; Q709-V750 PolarHBondContact N-O 3.22Å; G710-V750 PolarHBondContact N-O 2.95Å; G710-V750 WeakPolarHBondContact O-CA 3.13Å; G710-V750 WeakPolarHBondContact O-CB 3.09Å; G710-V750 PolarHBondContact O-N 3.23Å; F725-V750 HydrophobicContact CE2-CG2 4.3Å; V750-M756 HydrophobicContact CG1-CG 3.76Å; V750-M756 HydrophobicContact CG1-SD 3.67Å
751	F	77.4	Confident	76.2	Confident	40 Å²	40	44.1 Å²	44.1	18%	0.175	23%	0.232	C	C	.	.			trans	-86.2	-12.2	-177.8	-55.1	-97.3	0	0	0	113.5	P706 S707 L708 Q709 A749 H767	P706-F751 HydrophobicContact CB-CE1 4.05Å; P706-F751 HydrophobicContact CG-CE1 3.79Å; P706-F751 HydrophobicContact CG-CZ 3.91Å; S707-F751 VanDerWaalsContact O-CD1 3.26Å; S707-F751 WeakPolarHBondContact O-CD1 3.23Å; L708-F751 HydrophobicContact CB-CD1 4.47Å; Q709-F751 WeakPolarHBondContact CG-O 3.48Å; Q709-F751 PolarHBondContact NE2-O 3.4Å; Q709-F751 VanDerWaalsContact NE2-O 3.13Å; A749-F751 HydrophobicContact CB-CD2 4.42Å; A749-F751 HydrophobicContact CB-CE2 3.64Å; A749-F751 HydrophobicContact CB-CZ 3.73Å; F751-H767 HydrophobicContact CE2-CB 3.67Å; F751-H767 AromaticContact CE2-CD2 3.93Å; F751-H767 AromaticContact CE2-CE1 3.97Å; F751-H767 AromaticContact CE2-CG 3.42Å; F751-H767 VanDerWaalsContact CE2-CG 3.42Å; F751-H767 AromaticContact CE2-ND1 3.47Å; F751-H767 WeakPolarHBondContact CE2-ND1 3.42Å; F751-H767 HydrophobicContact CZ-CB 3.87Å; F751-H767 AromaticContact CZ-CD2 3.57Å; F751-H767 AromaticContact CZ-CG 3.53Å; F751-H767 AromaticContact CZ-ND1 3.93Å
752	G	73.8	Confident	74.4	Confident	8 Å²	8	46.4 Å²	46.4	8%	0.082	24%	0.243	C	C	.	.			trans	159	166.6	170.3	0	0	0	0	0	115.2	M754 Q755 M756	G752-M754 VanDerWaalsContact C-N 3.26Å; G752-M754 PolarHBondContact O-N 3.13Å; G752-Q755 PolarHBondContact O-N 2.93Å; G752-M756 PolarHBondContact O-N 3.47Å
753	S	68.3	Low	72.5	Confident	14 Å²	14	49.5 Å²	49.5	10%	0.098	26%	0.259	C	S	.	.	H	α-helix	trans	-61.4	-27.4	-173.1	45.6	0	0	0	0	114.2	L682 Q755 M756 A757	L682-S753 VanDerWaalsContact CA-OG 3.23Å; L682-S753 WeakPolarHBondContact CA-OG 3.49Å; L682-S753 WeakPolarHBondContact CB-OG 3.33Å; L682-S753 WeakPolarHBondContact CD1-OG 3.49Å; S753-Q755 VanDerWaalsContact C-N 3.33Å; S753-Q755 PolarHBondContact O-N 3.32Å; S753-M756 PolarHBondContact O-N 3.05Å; S753-A757 WeakPolarHBondContact O-CB 3.46Å; S753-A757 PolarHBondContact O-N 3.19Å
754	M	62.9	Low	70.6	Confident	133 Å²	133	50.5 Å²	50.5	66%	0.655	27%	0.268	S	S	*	.	H	α-helix	trans	-62.3	-39.9	173.6	-169.6	177.7	-176.9	0	0	111.9	L682 G752 A757 V758	L682-M754 HydrophobicContact CD1-CB 3.93Å; G752-M754 VanDerWaalsContact C-N 3.26Å; G752-M754 PolarHBondContact O-N 3.13Å; M754-A757 PolarHBondContact O-N 3.45Å; M754-V758 VanDerWaalsContact O-CG2 3.32Å; M754-V758 WeakPolarHBondContact O-CG2 3.36Å; M754-V758 PolarHBondContact O-N 2.94Å
755	Q	61.9	Low	68.8	Low	93 Å²	93	55.8 Å²	55.8	44%	0.435	29%	0.292	S	S	.	.	H	α-helix	trans	-68.6	-42.1	175.8	-66	-176.9	-6.4	0	0	111.1	G752 S753 A757 V758 S759	G752-Q755 PolarHBondContact O-N 2.93Å; S753-Q755 VanDerWaalsContact C-N 3.33Å; S753-Q755 PolarHBondContact O-N 3.32Å; Q755-A757 VanDerWaalsContact C-N 3.28Å; Q755-A757 PolarHBondContact O-N 3.17Å; Q755-V758 PolarHBondContact O-N 2.95Å; Q755-S759 WeakPolarHBondContact O-CB 3.27Å; Q755-S759 PolarHBondContact O-N 2.99Å
756	M	64.9	Low	67.4	Low	26 Å²	26	57.1 Å²	57.1	13%	0.128	30%	0.298	C	S	.	.	H	α-helix	trans	-59.4	-38.6	175.7	-56.4	175.4	77.8	0	0	112.1	L645 D646 Y719 F725 V750 G752 S753	L645-M756 HydrophobicContact CD2-SD 4.16Å; D646-M756 HydrophobicContact CB-CE 4.06Å; D646-M756 VanDerWaalsContact OD1-CE 3.27Å; D646-M756 WeakPolarHBondContact OD1-CE 3.31Å; Y719-M756 HydrophobicContact CE1-CE 4.1Å; F725-M756 HydrophobicContact CZ-CB 4.46Å; F725-M756 HydrophobicContact CZ-CE 4.34Å; F725-M756 HydrophobicContact CZ-CG 4.16Å; V750-M756 HydrophobicContact CG1-CG 3.76Å; V750-M756 HydrophobicContact CG1-SD 3.67Å; G752-M756 PolarHBondContact O-N 3.47Å; S753-M756 PolarHBondContact O-N 3.05Å
757	A	59.6	Low	66.4	Low	60 Å²	60	62.5 Å²	62.5	50%	0.496	32%	0.323	S	S	.	.	H	α-helix	trans	-70.5	-49.2	177.3	0	0	0	0	0	112.4	S753 M754 Q755 S759 R760	S753-A757 WeakPolarHBondContact O-CB 3.46Å; S753-A757 PolarHBondContact O-N 3.19Å; M754-A757 PolarHBondContact O-N 3.45Å; Q755-A757 VanDerWaalsContact C-N 3.28Å; Q755-A757 PolarHBondContact O-N 3.17Å; A757-S759 VanDerWaalsContact C-N 3.29Å; A757-S759 PolarHBondContact O-N 3Å; A757-R760 PolarHBondContact O-N 3.32Å
758	V	58.4	Low	66	Low	49 Å²	49	64.9 Å²	64.9	30%	0.297	33%	0.332	S	S	.	.	H	α-helix	trans	-66.5	-32.1	-179.9	175.7	0	0	0	0	111.6	M754 Q755 R760 V761 I762 L764	M754-V758 VanDerWaalsContact O-CG2 3.32Å; M754-V758 WeakPolarHBondContact O-CG2 3.36Å; M754-V758 PolarHBondContact O-N 2.94Å; Q755-V758 PolarHBondContact O-N 2.95Å; V758-R760 PolarHBondContact O-N 2.97Å; V758-R760 VanDerWaalsContact O-N 3.1Å; V758-V761 PolarHBondContact O-N 3.37Å; V758-I762 HydrophobicContact CG1-CB 4.31Å; V758-I762 HydrophobicContact CG1-CD1 4.04Å; V758-I762 HydrophobicContact CG1-CG1 4.22Å; V758-I762 PolarHBondContact O-N 3.3Å; V758-L764 HydrophobicContact CG1-CD1 3.85Å
759	S	59.2	Low	65.9	Low	10 Å²	10	66.6 Å²	66.6	7%	0.07	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-24.1	176	-178.5	0	0	0	0	114.5	T723 Q755 A757 V761 H766	T723-S759 VanDerWaalsContact CG2-OG 3.24Å; T723-S759 WeakPolarHBondContact CG2-OG 3.47Å; Q755-S759 WeakPolarHBondContact O-CB 3.27Å; Q755-S759 PolarHBondContact O-N 2.99Å; A757-S759 VanDerWaalsContact C-N 3.29Å; A757-S759 PolarHBondContact O-N 3Å; S759-V761 VanDerWaalsContact C-N 3.3Å; S759-H766 WeakPolarHBondContact CB-NE2 3.44Å; S759-H766 PolarHBondContact OG-CE1 3.29Å; S759-H766 PolarHBondContact OG-NE2 3.3Å
760	R	57.5	Low	66	Low	151 Å²	151	67 Å²	67	57%	0.57	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-12.1	175.2	-70.4	179.5	170.9	168.1	-1.4	113.6	A720 T723 A757 V758	A720-R760 PolarHBondContact O-NH2 2.94Å; T723-R760 HydrophobicContact CG2-CG 4.05Å; A757-R760 PolarHBondContact O-N 3.32Å; V758-R760 PolarHBondContact O-N 2.97Å; V758-R760 VanDerWaalsContact O-N 3.1Å
761	V	51.3	Low	66.5	Low	125 Å²	125	68.7 Å²	68.7	76%	0.758	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.2	-34.5	-174.6	-174.5	0	0	0	0	111.4	V758 S759	V758-V761 PolarHBondContact O-N 3.37Å; S759-V761 VanDerWaalsContact C-N 3.3Å
762	I	52.8	Low	67.2	Low	95 Å²	95	67 Å²	67	49%	0.487	35%	0.345	S	S	.	.	S	Bend	trans	-127.6	125.2	179.1	-48.9	179.8	0	0	0	108.1	V758 L764	V758-I762 HydrophobicContact CG1-CB 4.31Å; V758-I762 HydrophobicContact CG1-CD1 4.04Å; V758-I762 HydrophobicContact CG1-CG1 4.22Å; V758-I762 PolarHBondContact O-N 3.3Å; I762-L764 HydrophobicContact CB-CD1 4.38Å; I762-L764 HydrophobicContact CB-CG 4.32Å; I762-L764 HydrophobicContact CG2-CD1 4.44Å; I762-L764 HydrophobicContact CG2-CG 3.95Å; I762-L764 PolarHBondContact O-N 3.41Å
763	N	51.4	Low	68.2	Low	115 Å²	115	74.3 Å²	74.3	62%	0.615	37%	0.37	S	S	*	.			trans	-76.5	58.8	180	-164.9	97	0	0	0	111.5
764	L	53.3	Low	69.4	Low	95 Å²	95	76 Å²	76	50%	0.497	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-64.6	145.4	173.8	-75.6	159.7	0	0	0	110.2	V758 I762 H766	V758-L764 HydrophobicContact CG1-CD1 3.85Å; I762-L764 HydrophobicContact CB-CD1 4.38Å; I762-L764 HydrophobicContact CB-CG 4.32Å; I762-L764 HydrophobicContact CG2-CD1 4.44Å; I762-L764 HydrophobicContact CG2-CG 3.95Å; I762-L764 PolarHBondContact O-N 3.41Å; L764-H766 PolarHBondContact O-CE1 2.92Å; L764-H766 PolarHBondContact O-N 2.75Å; L764-H766 PolarHBondContact O-ND1 2.86Å
765	Q	54.4	Low	71	Confident	144 Å²	144	69.8 Å²	69.8	67%	0.673	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-77.5	120.4	171.9	-70.3	174.2	-40.1	0	0	109.4
766	H	64.1	Low	72.5	Confident	29 Å²	29	67.9 Å²	67.9	13%	0.134	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-77.5	164.5	174.2	-47.1	73.8	0	0	0	110.4	N724 F725 V748 S759 L764 R768	N724-H766 PolarHBondContact O-CE1 2.95Å; F725-H766 AromaticContact CD1-CD2 3.74Å; F725-H766 AromaticContact CD1-NE2 3.28Å; F725-H766 VanDerWaalsContact CD1-NE2 3.28Å; F725-H766 WeakPolarHBondContact CD1-NE2 3.06Å; F725-H766 AromaticContact CE1-NE2 3.36Å; F725-H766 WeakPolarHBondContact CE1-NE2 3.45Å; F725-H766 WeakPolarHBondContact O-CB 3.11Å; F725-H766 PolarHBondContact O-ND1 2.95Å; V748-H766 HydrophobicContact CG1-CB 3.78Å; S759-H766 WeakPolarHBondContact CB-NE2 3.44Å; S759-H766 PolarHBondContact OG-CE1 3.29Å; S759-H766 PolarHBondContact OG-NE2 3.3Å; L764-H766 PolarHBondContact O-CE1 2.92Å; L764-H766 PolarHBondContact O-N 2.75Å; L764-H766 PolarHBondContact O-ND1 2.86Å; H766-R768 VanDerWaalsContact C-N 3.34Å; H766-R768 PolarHBondContact O-N 3.25Å
767	H	71.3	Confident	73.9	Confident	113 Å²	113	66.6 Å²	66.6	52%	0.523	33%	0.333	S	S	.	.			trans	-78.3	91.4	175.2	-63.3	49.6	0	0	0	109.1	A749 F751 I769	A749-H767 HydrophobicContact CB-CB 4.24Å; A749-H767 PolarHBondContact N-O 2.95Å; F751-H767 HydrophobicContact CE2-CB 3.67Å; F751-H767 AromaticContact CE2-CD2 3.93Å; F751-H767 AromaticContact CE2-CE1 3.97Å; F751-H767 AromaticContact CE2-CG 3.42Å; F751-H767 VanDerWaalsContact CE2-CG 3.42Å; F751-H767 AromaticContact CE2-ND1 3.47Å; F751-H767 WeakPolarHBondContact CE2-ND1 3.42Å; F751-H767 HydrophobicContact CZ-CB 3.87Å; F751-H767 AromaticContact CZ-CD2 3.57Å; F751-H767 AromaticContact CZ-CG 3.53Å; F751-H767 AromaticContact CZ-ND1 3.93Å; H767-I769 PolarHBondContact O-N 3.25Å
768	R	85.1	Confident	75.5	Confident	49 Å²	49	64.3 Å²	64.3	19%	0.185	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	119.3	163.7	-62	-176.8	-75.4	-163.6	-2.6	108.3	W726 D732 F735 H766	W726-R768 HydrophobicContact CD2-CG 3.84Å; W726-R768 VanDerWaalsContact CE2-CD 3.44Å; W726-R768 HydrophobicContact CE3-CB 4.11Å; W726-R768 HydrophobicContact CE3-CG 3.52Å; W726-R768 HydrophobicContact CH2-CB 3.72Å; W726-R768 HydrophobicContact CH2-CG 3.9Å; W726-R768 HydrophobicContact CZ2-CB 4.34Å; W726-R768 HydrophobicContact CZ2-CG 4.18Å; W726-R768 HydrophobicContact CZ3-CB 3.6Å; W726-R768 HydrophobicContact CZ3-CG 3.57Å; D732-R768 IonicContact OD2-CZ 3.18Å; D732-R768 IonicContact OD2-NH1 2.72Å; D732-R768 PolarHBondContact OD2-NH1 3.27Å; D732-R768 IonicContact OD2-NH2 2.75Å; D732-R768 PolarHBondContact OD2-NH2 3.36Å; F735-R768 HydrophobicContact CD2-CB 4.37Å; F735-R768 HydrophobicContact CE1-CB 4.43Å; F735-R768 HydrophobicContact CE2-CB 3.87Å; F735-R768 HydrophobicContact CZ-CB 3.9Å; H766-R768 VanDerWaalsContact C-N 3.34Å; H766-R768 PolarHBondContact O-N 3.25Å
769	I	86.3	Confident	77	Confident	36 Å²	36	62.1 Å²	62.1	19%	0.185	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	-57.8	178.9	-61.4	168.9	0	0	0	109.1	L696 I703 L705 I711 V747 A749 H767	L696-I769 HydrophobicContact CD2-CG2 4.11Å; I703-I769 HydrophobicContact CD1-CG2 4.02Å; I703-I769 HydrophobicContact CG2-CG2 3.73Å; L705-I769 HydrophobicContact CD2-CD1 4.28Å; I711-I769 HydrophobicContact CG2-CD1 4.41Å; V747-I769 HydrophobicContact CB-CB 4.32Å; V747-I769 HydrophobicContact CG1-CB 4.27Å; V747-I769 HydrophobicContact CG1-CD1 4.06Å; V747-I769 WeakPolarHBondContact O-CB 3.5Å; V747-I769 PolarHBondContact O-N 3.38Å; A749-I769 HydrophobicContact CB-CD1 3.88Å; A749-I769 HydrophobicContact CB-CG1 4.11Å; H767-I769 PolarHBondContact O-N 3.25Å
770	A	90.1	Very high	78.3	Confident	14 Å²	14	65 Å²	65	12%	0.116	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	162.1	-172.9	0	0	0	0	0	112.1	I703 V747	I703-A770 HydrophobicContact CD1-CB 3.72Å; V747-A770 HydrophobicContact CB-CB 4.5Å; V747-A770 PolarHBondContact N-O 2.82Å; V747-A770 PolarHBondContact O-N 3.42Å
771	Q	91.9	Very high	79.5	Confident	43 Å²	43	60 Å²	60	20%	0.201	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	129.6	158.8	-94.2	167.5	-39.4	0	0	106.9	W726 T736 I744 L745 E746	W726-Q771 HydrophobicContact CH2-CG 3.71Å; W726-Q771 HydrophobicContact CZ2-CG 3.59Å; T736-Q771 VanDerWaalsContact N-OE1 3.11Å; T736-Q771 PolarHBondContact O-NE2 2.76Å; T736-Q771 PolarHBondContact OG1-NE2 2.88Å; T736-Q771 VanDerWaalsContact OG1-NE2 3.08Å; T736-Q771 PolarHBondContact OG1-OE1 3.38Å; I744-Q771 HydrophobicContact CG2-CB 3.63Å; I744-Q771 HydrophobicContact CG2-CG 3.74Å; L745-Q771 WeakPolarHBondContact O-CA 3.46Å; E746-Q771 HydrophobicContact CG-CG 4.1Å; E746-Q771 PolarHBondContact OE1-NE2 3.17Å
772	C	93.3	Very high	80.8	Confident	5 Å²	5	61.6 Å²	61.6	3%	0.034	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	165.7	-171.4	60.4	0	0	0	0	112.6	C698 D699 L745	C698-C772 HydrophobicContact CB-CB 3.8Å; D699-C772 VanDerWaalsContact OD2-CA 3.22Å; D699-C772 WeakPolarHBondContact OD2-CA 3.3Å; D699-C772 VanDerWaalsContact OD2-CB 3.32Å; D699-C772 WeakPolarHBondContact OD2-CB 3.06Å; L745-C772 PolarHBondContact N-O 2.81Å; L745-C772 PolarHBondContact O-N 3.02Å; L745-C772 VanDerWaalsContact O-N 3.13Å
773	R	93.4	Very high	82.2	Confident	161 Å²	161	62.7 Å²	62.7	61%	0.608	32%	0.317	S	S	*	.	S	Bend	trans	-103	-12.9	179.8	-61.9	-170.2	169.4	157.1	0.5	114.2	W313 D699	W313-R773 VanDerWaalsContact CZ3-O 3.31Å; W313-R773 WeakPolarHBondContact CZ3-O 3.43Å; D699-R773 VanDerWaalsContact CG-N 3.32Å; D699-R773 WeakPolarHBondContact OD1-CA 3.41Å; D699-R773 PolarHBondContact OD1-N 3.33Å; D699-R773 PolarHBondContact OD2-N 3.45Å
774	T	94.1	Very high	83.8	Confident	51 Å²	51	58.2 Å²	58.2	31%	0.313	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	132.9	177.5	53.5	0	0	0	0	109	C698 D699 I804	C698-T774 WeakPolarHBondContact CA-O 3.4Å; D699-T774 WeakPolarHBondContact CA-OG1 3.29Å; D699-T774 PolarHBondContact N-O 3.41Å; D699-T774 PolarHBondContact OD1-N 3.44Å; D699-T774 PolarHBondContact OD1-OG1 3.26Å; T774-I804 HydrophobicContact CG2-CG2 4.31Å
775	V	96	Very high	85.6	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.006	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	130.4	174.5	-170.2	0	0	0	0	108	L696 E697 V713 L745 V747 I777 K802 I803	L696-V775 HydrophobicContact CD1-CG1 3.58Å; E697-V775 WeakPolarHBondContact O-CA 3.41Å; V713-V775 HydrophobicContact CG1-CG2 4.08Å; V713-V775 HydrophobicContact CG2-CG1 4.48Å; L745-V775 HydrophobicContact CD1-CG2 4.11Å; V747-V775 HydrophobicContact CG2-CG2 4.28Å; V775-I777 HydrophobicContact CG1-CD1 4.14Å; V775-I777 HydrophobicContact CG1-CG1 3.78Å; V775-K802 CarbonylContact O-C 3.51Å; V775-K802 WeakPolarHBondContact O-CA 3.19Å; V775-I803 HydrophobicContact CB-CB 4.12Å; V775-I803 HydrophobicContact CB-CD1 4.33Å; V775-I803 HydrophobicContact CB-CG1 4.33Å; V775-I803 PolarHBondContact N-O 3.48Å; V775-I803 PolarHBondContact O-N 3.44Å
776	K	94.9	Very high	87.4	Confident	53 Å²	53	46.9 Å²	46.9	23%	0.23	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	130.7	166.6	165.2	169.6	162.4	-117.7	0	108.3	E697 I801	E697-K776 HydrophobicContact CB-CB 4.06Å; E697-K776 HydrophobicContact CB-CG 4.46Å; E697-K776 PolarHBondContact N-O 2.91Å; E697-K776 PolarHBondContact O-N 3.47Å; E697-K776 IonicContact OE1-NZ 2.71Å; E697-K776 PolarHBondContact OE1-NZ 3.37Å; E697-K776 WeakPolarHBondContact OE2-CD 3.47Å; E697-K776 IonicContact OE2-NZ 2.75Å; E697-K776 PolarHBondContact OE2-NZ 3.41Å; K776-I801 CarbonylContact C-O 3.5Å; K776-I801 WeakPolarHBondContact CA-O 3.48Å
777	I	93.8	Very high	88.8	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	115.5	-177.9	-53.3	-178.1	0	0	0	106.4	F641 I643 V694 L695 L696 V775 I801	F641-I777 HydrophobicContact CD1-CD1 4.38Å; F641-I777 HydrophobicContact CE1-CD1 3.53Å; F641-I777 HydrophobicContact CZ-CD1 3.9Å; I643-I777 HydrophobicContact CD1-CG2 4.24Å; V694-I777 HydrophobicContact CG1-CG2 3.4Å; V694-I777 VanDerWaalsContact CG1-CG2 3.4Å; L695-I777 WeakPolarHBondContact O-CA 3.23Å; L696-I777 HydrophobicContact CD1-CG1 4.16Å; V775-I777 HydrophobicContact CG1-CD1 4.14Å; V775-I777 HydrophobicContact CG1-CG1 3.78Å; I777-I801 HydrophobicContact CB-CB 4.25Å; I777-I801 PolarHBondContact N-O 2.88Å; I777-I801 PolarHBondContact O-N 2.76Å
778	T	92.4	Very high	89.9	Confident	12 Å²	12	40.1 Å²	40.1	7%	0.074	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	118.8	176.3	-48.9	0	0	0	0	108.6	V694 L695 L780 Y800	V694-T778 WeakPolarHBondContact CA-O 3.37Å; L695-T778 PolarHBondContact N-O 3.08Å; L695-T778 PolarHBondContact O-N 2.85Å; T778-L780 HydrophobicContact CG2-CD2 3.79Å; T778-L780 HydrophobicContact CG2-CG 4.45Å; T778-Y800 HydrophobicContact CG2-CD1 3.69Å; T778-Y800 HydrophobicContact CG2-CE1 3.44Å; T778-Y800 VanDerWaalsContact CG2-CE1 3.44Å; T778-Y800 WeakPolarHBondContact OG1-CD1 3.49Å; T778-Y800 WeakPolarHBondContact OG1-CE1 3.38Å
779	V	91.3	Very high	90.2	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.012	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	121.9	176.5	-178.4	0	0	0	0	108.6	I643 V785 G799 I801	I643-V779 HydrophobicContact CD1-CG2 4.3Å; V779-V785 HydrophobicContact CG1-CB 4.2Å; V779-V785 HydrophobicContact CG1-CG2 3.68Å; V779-G799 PolarHBondContact N-O 3.33Å; V779-G799 PolarHBondContact O-N 3.28Å; V779-I801 HydrophobicContact CG2-CD1 4.27Å
780	L	86.8	Confident	90.4	Very high	72 Å²	72	37.7 Å²	37.7	38%	0.377	20%	0.202	S	C	.	.			trans	-114.5	154.1	-170.6	-58.3	173.5	0	0	0	111.8	R693 T778	R693-L780 PolarHBondContact O-N 3Å; T778-L780 HydrophobicContact CG2-CD2 3.79Å; T778-L780 HydrophobicContact CG2-CG 4.45Å
781	G	82.6	Confident	90.1	Very high	45 Å²	45	38.2 Å²	38.2	46%	0.464	21%	0.209	S	C	.	.	S	Bend	trans	89.2	-177.6	-173.8	0	0	0	0	0	112.4	P798	G781-P798 WeakPolarHBondContact O-CB 3.26Å; G781-P798 WeakPolarHBondContact O-CG 3.22Å
782	D	77.3	Confident	89.9	Confident	158 Å²	158	42.6 Å²	42.6	85%	0.845	23%	0.229	S	C	*	.	S	Bend	trans	-91.9	-20.5	-176	-54.7	-76.7	0	0	0	113.6
783	E	83.2	Confident	89.8	Confident	119 Å²	119	43.3 Å²	43.3	56%	0.556	24%	0.235	S	C	*	.	S	Bend	trans	-88.5	135.3	179.4	-67.1	-172.1	125.5	0	0	112.6	R693	R693-E783 IonicContact CZ-OE2 2.92Å; R693-E783 IonicContact NH1-OE2 3.26Å; R693-E783 PolarHBondContact NH1-OE2 2.95Å; R693-E783 IonicContact NH2-OE2 2.72Å; R693-E783 PolarHBondContact NH2-OE2 3.34Å
784	G	85.1	Confident	89.7	Confident	21 Å²	21	37.9 Å²	37.9	22%	0.216	22%	0.215	C	C	.	.			trans	-69.4	150.4	173.2	0	0	0	0	0	114	Q796	G784-Q796 CarbonylContact C-O 3.52Å; G784-Q796 WeakPolarHBondContact CA-O 3.37Å
785	V	90.5	Very high	89.6	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	137.7	-177.1	-179.9	0	0	0	0	110.3	I643 L690 V779 V787 Q796	I643-V785 HydrophobicContact CD1-CB 4.46Å; I643-V785 HydrophobicContact CD1-CG1 3.88Å; I643-V785 HydrophobicContact CG1-CG1 3.56Å; L690-V785 HydrophobicContact CD1-CG1 3.96Å; V779-V785 HydrophobicContact CG1-CB 4.2Å; V779-V785 HydrophobicContact CG1-CG2 3.68Å; V785-V787 PolarHBondContact O-N 3.4Å; V785-Q796 PolarHBondContact N-O 3.22Å; V785-Q796 PolarHBondContact O-N 2.84Å
786	P	92.3	Very high	89.4	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	130.7	176.3	25.2	-33.9	0	0	0	111.7	I643 G644 A647 K648 Y687 W794 I795	I643-P786 WeakPolarHBondContact CA-O 3.49Å; G644-P786 PolarHBondContact N-O 3.43Å; A647-P786 VanDerWaalsContact CB-C 3.47Å; A647-P786 HydrophobicContact CB-CB 4.03Å; A647-P786 VanDerWaalsContact CB-O 3.31Å; A647-P786 WeakPolarHBondContact CB-O 3.46Å; K648-P786 HydrophobicContact CB-CB 4.32Å; K648-P786 HydrophobicContact CB-CG 4.02Å; Y687-P786 HydrophobicContact CD2-CG 4.25Å; Y687-P786 HydrophobicContact CE2-CG 3.63Å; Y687-P786 VanDerWaalsContact CZ-CD 3.42Å; Y687-P786 WeakPolarHBondContact OH-CD 3.3Å; P786-W794 WeakPolarHBondContact CA-O 3.47Å; P786-I795 HydrophobicContact CB-CD1 3.92Å
787	V	93.9	Very high	89.2	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	145.2	178.2	171.4	0	0	0	0	109.3	F641 G642 I643 A647 V785 A793 W794 Q796 I801	F641-V787 HydrophobicContact CD2-CG1 4.13Å; F641-V787 HydrophobicContact CE2-CG1 3.38Å; F641-V787 HydrophobicContact CZ-CG1 3.71Å; F641-V787 HydrophobicContact CZ-CG2 4.32Å; G642-V787 CarbonylContact O-C 3.53Å; G642-V787 WeakPolarHBondContact O-CA 3.23Å; I643-V787 HydrophobicContact CB-CG2 4.25Å; I643-V787 HydrophobicContact CD1-CG2 3.96Å; I643-V787 HydrophobicContact CG1-CG2 3.88Å; A647-V787 VanDerWaalsContact CB-C 3.43Å; V785-V787 PolarHBondContact O-N 3.4Å; V787-A793 CarbonylContact O-C 3.5Å; V787-A793 VanDerWaalsContact O-CA 3.28Å; V787-A793 WeakPolarHBondContact O-CA 3.28Å; V787-W794 HydrophobicContact CB-CD2 4.47Å; V787-W794 HydrophobicContact CB-CZ2 4.26Å; V787-W794 HydrophobicContact CG1-CD2 4.48Å; V787-W794 HydrophobicContact CG1-CH2 3.77Å; V787-W794 HydrophobicContact CG1-CZ2 3.57Å; V787-W794 HydrophobicContact CG1-CZ3 4.28Å; V787-W794 PolarHBondContact N-O 3.49Å; V787-W794 PolarHBondContact O-N 3.28Å; V787-W794 VanDerWaalsContact O-O 3.13Å; V787-Q796 HydrophobicContact CB-CB 4.21Å; V787-Q796 HydrophobicContact CG2-CB 3.62Å; V787-Q796 HydrophobicContact CG2-CG 4.35Å; V787-I801 HydrophobicContact CG2-CD1 4.07Å
788	Q	93	Very high	89.1	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	150.9	171.4	82.7	116.2	-33.6	0	0	112.8	Y640 F641 G642 D646 A647 T650 G791 E792 A793	Y640-Q788 PolarHBondContact OH-NE2 3.4Å; F641-Q788 CarbonylContact C-O 3.46Å; F641-Q788 WeakPolarHBondContact CA-O 3.42Å; G642-Q788 PolarHBondContact N-O 3.22Å; G642-Q788 PolarHBondContact O-N 3Å; D646-Q788 PolarHBondContact OD2-NE2 2.84Å; A647-Q788 HydrophobicContact CB-CB 3.92Å; A647-Q788 HydrophobicContact CB-CG 4.03Å; T650-Q788 HydrophobicContact CG2-CB 4.37Å; T650-Q788 PolarHBondContact OG1-NE2 2.95Å; Q788-G791 VanDerWaalsContact OE1-CA 3.27Å; Q788-E792 CarbonylContact C-O 3.58Å; Q788-E792 WeakPolarHBondContact CA-O 2.91Å; Q788-E792 WeakPolarHBondContact CB-O 3.44Å; Q788-A793 HydrophobicContact CB-CB 3.64Å
789	V	92.8	Very high	89	Confident	7 Å²	7	39.3 Å²	39.3	4%	0.042	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	124	177.1	174.9	0	0	0	0	108.8	I315 M637 F641 G791 E792 W794	I315-V789 HydrophobicContact CG1-CG2 4.15Å; M637-V789 HydrophobicContact CB-CG1 3.7Å; M637-V789 HydrophobicContact CG-CG1 4.18Å; F641-V789 HydrophobicContact CB-CG2 4.25Å; F641-V789 HydrophobicContact CD2-CG2 3.63Å; F641-V789 HydrophobicContact CE2-CG2 4.48Å; F641-V789 HydrophobicContact CG-CG2 4.34Å; V789-G791 PolarHBondContact O-N 2.92Å; V789-E792 PolarHBondContact N-O 3.17Å; V789-E792 PolarHBondContact O-N 3.02Å; V789-W794 HydrophobicContact CB-CH2 4.38Å; V789-W794 HydrophobicContact CB-CZ3 4.27Å; V789-W794 HydrophobicContact CG2-CH2 3.73Å; V789-W794 HydrophobicContact CG2-CZ3 4.06Å
790	D	89.3	Confident	89	Confident	28 Å²	28	42.7 Å²	42.7	15%	0.15	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	50	19	177.2	-65	-7.3	0	0	0	116.1	N638 N639 Y640	N638-D790 WeakPolarHBondContact CA-OD2 3.46Å; N638-D790 WeakPolarHBondContact CB-OD2 3.36Å; N638-D790 PolarHBondContact N-OD2 3.05Å; N638-D790 PolarHBondContact ND2-OD2 2.86Å; N639-D790 WeakPolarHBondContact CA-OD1 3.47Å; N639-D790 VanDerWaalsContact CB-OD1 3.28Å; N639-D790 WeakPolarHBondContact CB-OD1 3.37Å; N639-D790 PolarHBondContact N-OD1 3.34Å; N639-D790 PolarHBondContact N-OD2 2.92Å; Y640-D790 PolarHBondContact N-OD1 3.4Å; Y640-D790 PolarHBondContact O-N 3.1Å; Y640-D790 VanDerWaalsContact O-N 3.12Å
791	G	84.4	Confident	89.4	Confident	25 Å²	25	39.3 Å²	39.3	26%	0.258	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	106.7	-7.4	-177.8	0	0	0	0	0	115.7	N654 Q788 V789	N654-G791 PolarHBondContact ND2-O 2.89Å; Q788-G791 VanDerWaalsContact OE1-CA 3.27Å; V789-G791 PolarHBondContact O-N 2.92Å
792	E	88.1	Confident	90	Very high	134 Å²	134	39 Å²	39	63%	0.626	21%	0.207	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93	130	172.6	-61	-171.2	167.6	0	0	109.5	Q788 V789	Q788-E792 CarbonylContact C-O 3.58Å; Q788-E792 WeakPolarHBondContact CA-O 2.91Å; Q788-E792 WeakPolarHBondContact CB-O 3.44Å; V789-E792 PolarHBondContact N-O 3.17Å; V789-E792 PolarHBondContact O-N 3.02Å
793	A	91.3	Very high	90.9	Very high	20 Å²	20	31.5 Å²	31.5	17%	0.165	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	142.6	-170.1	0	0	0	0	0	112.5	T650 L651 V787 Q788	T650-A793 HydrophobicContact CG2-CB 3.94Å; L651-A793 HydrophobicContact CB-CB 3.98Å; L651-A793 HydrophobicContact CD1-CB 4.44Å; V787-A793 CarbonylContact O-C 3.5Å; V787-A793 VanDerWaalsContact O-CA 3.28Å; V787-A793 WeakPolarHBondContact O-CA 3.28Å; Q788-A793 HydrophobicContact CB-CB 3.64Å
794	W	91.6	Very high	91.4	Very high	47 Å²	47	28 Å²	28	18%	0.178	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	170.1	179.5	66.8	103	0	0	0	111.5	K634 P786 V787 V789	K634-W794 HydrophobicContact CG-CZ2 4.15Å; P786-W794 WeakPolarHBondContact CA-O 3.47Å; V787-W794 HydrophobicContact CB-CD2 4.47Å; V787-W794 HydrophobicContact CB-CZ2 4.26Å; V787-W794 HydrophobicContact CG1-CD2 4.48Å; V787-W794 HydrophobicContact CG1-CH2 3.77Å; V787-W794 HydrophobicContact CG1-CZ2 3.57Å; V787-W794 HydrophobicContact CG1-CZ3 4.28Å; V787-W794 PolarHBondContact N-O 3.49Å; V787-W794 PolarHBondContact O-N 3.28Å; V787-W794 VanDerWaalsContact O-O 3.13Å; V789-W794 HydrophobicContact CB-CH2 4.38Å; V789-W794 HydrophobicContact CB-CZ3 4.27Å; V789-W794 HydrophobicContact CG2-CH2 3.73Å; V789-W794 HydrophobicContact CG2-CZ3 4.06Å
795	I	91.5	Very high	91.9	Very high	82 Å²	82	29.8 Å²	29.8	42%	0.421	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	120.1	163.6	-60.4	-59.5	0	0	0	107.6	L651 P786	L651-I795 HydrophobicContact CD2-CD1 3.43Å; L651-I795 VanDerWaalsContact CD2-CD1 3.43Å; L651-I795 HydrophobicContact CD2-CG1 3.87Å; P786-I795 HydrophobicContact CB-CD1 3.92Å
796	Q	91.1	Very high	91.9	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	118	176.4	178.6	52	51.5	0	0	109.5	G784 V785 V787 I801	G784-Q796 CarbonylContact C-O 3.52Å; G784-Q796 WeakPolarHBondContact CA-O 3.37Å; V785-Q796 PolarHBondContact N-O 3.22Å; V785-Q796 PolarHBondContact O-N 2.84Å; V787-Q796 HydrophobicContact CB-CB 4.21Å; V787-Q796 HydrophobicContact CG2-CB 3.62Å; V787-Q796 HydrophobicContact CG2-CG 4.35Å; Q796-I801 HydrophobicContact CG-CD1 3.98Å; Q796-I801 HydrophobicContact CG-CG1 4.21Å
797	P	91	Very high	91.9	Very high	46 Å²	46	34.9 Å²	34.9	30%	0.299	18%	0.178	S	C	.	.	P	Polyproline II helix	trans	-64.9	162.1	172.3	27.4	-36.1	0	0	0	112.3	E319	E319-P797 HydrophobicContact CG-CG 4.06Å
798	P	90.8	Very high	91.8	Very high	19 Å²	19	39.3 Å²	39.3	12%	0.123	19%	0.194	C	C	.	.	S	Bend	trans	-51.5	142.9	177.5	-27.4	35.7	0	0	0	113.8	T320 F322 G781	T320-P798 PolarHBondContact N-O 3.34Å; T320-P798 PolarHBondContact OG1-O 2.94Å; F322-P798 HydrophobicContact CE2-CB 4.49Å; G781-P798 WeakPolarHBondContact O-CB 3.26Å; G781-P798 WeakPolarHBondContact O-CG 3.22Å
799	G	90.9	Very high	91.7	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	141.5	-155.2	-173.9	0	0	0	0	0	113.2	Y318 T320 V779	Y318-G799 WeakPolarHBondContact O-CA 3.43Å; T320-G799 WeakPolarHBondContact OG1-CA 3.44Å; T320-G799 PolarHBondContact OG1-N 2.78Å; V779-G799 PolarHBondContact N-O 3.33Å; V779-G799 PolarHBondContact O-N 3.28Å
800	Y	92.1	Very high	91.7	Very high	73 Å²	73	41.3 Å²	41.3	29%	0.286	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	129.6	-171.2	-55.5	-87.1	0	0	0	111.9	V317 Y318 T320 T778	V317-Y800 WeakPolarHBondContact CA-O 3.47Å; Y318-Y800 AromaticContact CD1-CD2 3.66Å; Y318-Y800 HydrophobicContact CD1-CD2 3.66Å; Y318-Y800 HydrophobicContact CD1-CE2 4.23Å; Y318-Y800 HydrophobicContact CE1-CD2 4.23Å; Y318-Y800 HydrophobicContact CE1-CE2 4.35Å; Y318-Y800 PolarHBondContact N-O 2.94Å; Y318-Y800 PolarHBondContact O-N 2.59Å; T320-Y800 HydrophobicContact CG2-CD2 3.8Å; T320-Y800 HydrophobicContact CG2-CE2 3.43Å; T320-Y800 VanDerWaalsContact CG2-CE2 3.43Å; T778-Y800 HydrophobicContact CG2-CD1 3.69Å; T778-Y800 HydrophobicContact CG2-CE1 3.44Å; T778-Y800 VanDerWaalsContact CG2-CE1 3.44Å; T778-Y800 WeakPolarHBondContact OG1-CD1 3.49Å; T778-Y800 WeakPolarHBondContact OG1-CE1 3.38Å
801	I	94.9	Very high	91.8	Very high	1 Å²	1	40 Å²	40	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	129.2	167.4	-42.9	172.6	0	0	0	107.3	I315 M316 V317 F641 K776 I777 V779 V787 Q796	I315-I801 HydrophobicContact CG2-CG2 3.94Å; M316-I801 CarbonylContact O-C 3.27Å; M316-I801 WeakPolarHBondContact O-CA 3.41Å; V317-I801 HydrophobicContact CG2-CG2 4.4Å; F641-I801 HydrophobicContact CE2-CD1 4.25Å; F641-I801 HydrophobicContact CE2-CG2 4.05Å; F641-I801 HydrophobicContact CZ-CD1 3.85Å; F641-I801 HydrophobicContact CZ-CG2 4.38Å; K776-I801 CarbonylContact C-O 3.5Å; K776-I801 WeakPolarHBondContact CA-O 3.48Å; I777-I801 HydrophobicContact CB-CB 4.25Å; I777-I801 PolarHBondContact N-O 2.88Å; I777-I801 PolarHBondContact O-N 2.76Å; V779-I801 HydrophobicContact CG2-CD1 4.27Å; V787-I801 HydrophobicContact CG2-CD1 4.07Å; Q796-I801 HydrophobicContact CG-CD1 3.98Å; Q796-I801 HydrophobicContact CG-CG1 4.21Å
802	K	94.7	Very high	92.2	Very high	39 Å²	39	38.9 Å²	38.9	17%	0.17	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	116.2	178.1	-164.1	-177.1	-176.6	176.6	0	109.2	M316 M628 Y631 V775 I804	M316-K802 HydrophobicContact CB-CB 4.29Å; M316-K802 WeakPolarHBondContact CB-O 3.48Å; M316-K802 PolarHBondContact N-O 3.11Å; M316-K802 PolarHBondContact O-N 2.93Å; M628-K802 HydrophobicContact CE-CD 4.15Å; Y631-K802 HydrophobicContact CD1-CB 4.38Å; Y631-K802 HydrophobicContact CE1-CB 3.96Å; Y631-K802 HydrophobicContact CE1-CD 4.46Å; V775-K802 CarbonylContact O-C 3.51Å; V775-K802 WeakPolarHBondContact O-CA 3.19Å; K802-I804 HydrophobicContact CD-CG2 4.36Å; K802-I804 HydrophobicContact CG-CG2 4.03Å
803	I	95.8	Very high	92.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	119.6	178.6	-50.7	-176.3	0	0	0	108.2	W313 S314 I315 M637 F641 V713 L745 V775	W313-I803 HydrophobicContact CB-CG2 4.09Å; W313-I803 HydrophobicContact CE3-CG2 4.27Å; S314-I803 WeakPolarHBondContact O-CA 3.34Å; I315-I803 HydrophobicContact CD1-CB 4.3Å; I315-I803 HydrophobicContact CD1-CD1 3.98Å; I315-I803 HydrophobicContact CD1-CG1 3.74Å; I315-I803 HydrophobicContact CD1-CG2 3.91Å; M637-I803 HydrophobicContact CE-CG2 3.9Å; F641-I803 HydrophobicContact CB-CD1 4.12Å; F641-I803 HydrophobicContact CD1-CD1 4.13Å; F641-I803 HydrophobicContact CD2-CD1 4.03Å; F641-I803 HydrophobicContact CG-CD1 3.85Å; V713-I803 HydrophobicContact CB-CD1 4.37Å; V713-I803 HydrophobicContact CG1-CD1 4.18Å; V713-I803 HydrophobicContact CG2-CD1 4.39Å; L745-I803 HydrophobicContact CD1-CB 4.47Å; L745-I803 HydrophobicContact CD1-CG2 3.64Å; V775-I803 HydrophobicContact CB-CB 4.12Å; V775-I803 HydrophobicContact CB-CD1 4.33Å; V775-I803 HydrophobicContact CB-CG1 4.33Å; V775-I803 PolarHBondContact N-O 3.48Å; V775-I803 PolarHBondContact O-N 3.44Å
804	I	94.7	Very high	92	Very high	44 Å²	44	34 Å²	34	23%	0.226	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	146.6	-176.3	62	178.1	0	0	0	111.4	W313 S314 M316 T774 K802 K806	W313-I804 CarbonylContact C-O 3.58Å; W313-I804 WeakPolarHBondContact CA-O 3.47Å; W313-I804 VanDerWaalsContact CE3-C 3.4Å; S314-I804 PolarHBondContact N-O 2.79Å; S314-I804 PolarHBondContact O-N 3.29Å; S314-I804 VanDerWaalsContact O-N 3.13Å; M316-I804 HydrophobicContact CG-CD1 3.9Å; M316-I804 HydrophobicContact CG-CG1 4.22Å; T774-I804 HydrophobicContact CG2-CG2 4.31Å; K802-I804 HydrophobicContact CD-CG2 4.36Å; K802-I804 HydrophobicContact CG-CG2 4.03Å; I804-K806 PolarHBondContact O-N 3.14Å
805	H	94.5	Very high	91.5	Very high	59 Å²	59	35.8 Å²	35.8	27%	0.273	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	119.8	177	163.6	-63.1	0	0	0	109.7	D311 W313 K743 R808	D311-H805 IonicContact OD1-NE2 3.66Å; W313-H805 VanDerWaalsContact CE3-CA 3.45Å; W313-H805 HydrophobicContact CE3-CB 3.94Å; W313-H805 HydrophobicContact CH2-CB 3.99Å; W313-H805 HydrophobicContact CZ3-CB 3.64Å; K743-H805 WeakPolarHBondContact CE-NE2 3.33Å; K743-H805 PolarHBondContact NZ-NE2 3.45Å; K743-H805 VanDerWaalsContact NZ-NE2 3.2Å; H805-R808 WeakPolarHBondContact NE2-CG 3.08Å
806	K	91.7	Very high	90.6	Very high	75 Å²	75	38.2 Å²	38.2	33%	0.326	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	-71.5	177.2	-174.1	173.7	-172.1	163.5	0	111	R312 E633 V636 I804	R312-K806 WeakPolarHBondContact O-CA 3.43Å; R312-K806 WeakPolarHBondContact O-CB 3.49Å; R312-K806 PolarHBondContact O-N 3.32Å; E633-K806 WeakPolarHBondContact OE1-CD 3.03Å; E633-K806 WeakPolarHBondContact OE1-CE 3.08Å; E633-K806 IonicContact OE1-NZ 2.64Å; E633-K806 PolarHBondContact OE1-NZ 2.72Å; E633-K806 IonicContact OE2-NZ 2.87Å; E633-K806 PolarHBondContact OE2-NZ 3.44Å; V636-K806 HydrophobicContact CG1-CD 4.2Å; V636-K806 HydrophobicContact CG2-CD 3.71Å; V636-K806 VanDerWaalsContact CG2-NZ 3.31Å; I804-K806 PolarHBondContact O-N 3.14Å
807	N	91.9	Very high	89.6	Confident	32 Å²	32	41.3 Å²	41.3	17%	0.171	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	-172.5	-177.1	71.6	26.9	0	0	0	111.2	D258 R312	D258-N807 PolarHBondContact OD1-ND2 2.94Å; R312-N807 PolarHBondContact N-O 2.91Å; R312-N807 PolarHBondContact NH1-OD1 3.37Å; R312-N807 PolarHBondContact O-N 2.85Å
808	R	91.3	Very high	88.7	Confident	93 Å²	93	45.3 Å²	45.3	35%	0.351	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	140.8	178.2	-49.7	-162	-69.6	-179.7	0.5	110.5	M309 L310 D311 H805	M309-R808 HydrophobicContact CE-CB 3.47Å; M309-R808 VanDerWaalsContact CE-CB 3.47Å; L310-R808 VanDerWaalsContact O-CA 3.27Å; L310-R808 WeakPolarHBondContact O-CA 3.22Å; D311-R808 WeakPolarHBondContact OD1-CD 3.15Å; D311-R808 VanDerWaalsContact OD1-CG 3.24Å; D311-R808 WeakPolarHBondContact OD1-CG 3.46Å; H805-R808 WeakPolarHBondContact NE2-CG 3.08Å
809	T	91.4	Very high	87.8	Confident	0 Å²	0	47 Å²	47	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	144.7	179	-54.2	0	0	0	0	110.5	L254 M309 L310 R312	L254-T809 HydrophobicContact CD2-CG2 3.78Å; M309-T809 CarbonylContact C-O 3.53Å; M309-T809 WeakPolarHBondContact CA-O 3.44Å; L310-T809 PolarHBondContact N-O 3.47Å; L310-T809 PolarHBondContact O-N 3.24Å; R312-T809 WeakPolarHBondContact CD-OG1 3.47Å
810	Q	92.4	Very high	87.1	Confident	50 Å²	50	50.8 Å²	50.8	23%	0.234	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	127.3	172.1	-64.2	-178.4	19.9	0	0	110.2	Q267 M268 M309	Q267-Q810 HydrophobicContact CG-CB 4.1Å; Q267-Q810 VanDerWaalsContact CG-OE1 3.22Å; M268-Q810 PolarHBondContact N-O 2.83Å; M309-Q810 HydrophobicContact CE-CG 4.23Å; M309-Q810 HydrophobicContact SD-CG 3.87Å
811	T	92.6	Very high	86.5	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	146.3	177.6	61.4	0	0	0	0	111.7	M268 L283 T307 K308 L310	M268-T811 HydrophobicContact CE-CG2 3.98Å; M268-T811 CarbonylContact O-C 3.56Å; M268-T811 WeakPolarHBondContact O-CA 3.43Å; L283-T811 WeakPolarHBondContact CD2-OG1 3.47Å; T307-T811 CarbonylContact C-O 3.46Å; T307-T811 WeakPolarHBondContact CA-O 3.23Å; K308-T811 PolarHBondContact N-O 3.04Å; K308-T811 PolarHBondContact O-N 2.87Å; K308-T811 PolarHBondContact O-OG1 3.41Å; L310-T811 HydrophobicContact CB-CG2 3.61Å; L310-T811 HydrophobicContact CD2-CG2 4.06Å; L310-T811 HydrophobicContact CG-CG2 4.49Å
812	L	91.9	Very high	85.7	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.01	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	120	178.4	-66.4	170.4	0	0	0	109.4	R240 Q267 M268 W285 L302 A305 T307	R240-L812 HydrophobicContact CB-CD1 4.24Å; R240-L812 HydrophobicContact CG-CD1 4.03Å; Q267-L812 HydrophobicContact CB-CD1 4.4Å; Q267-L812 HydrophobicContact CB-CD2 4.15Å; Q267-L812 HydrophobicContact CB-CG 4.16Å; M268-L812 PolarHBondContact O-N 2.83Å; W285-L812 HydrophobicContact CZ2-CB 4.37Å; W285-L812 PolarHBondContact NE1-O 3.31Å; L302-L812 HydrophobicContact CD1-CB 4.21Å; L302-L812 HydrophobicContact CD1-CD1 3.57Å; L302-L812 HydrophobicContact CG-CD1 4.04Å; A305-L812 HydrophobicContact CB-CB 4.1Å; A305-L812 HydrophobicContact CB-CD2 4.31Å; T307-L812 HydrophobicContact CG2-CD2 3.85Å
813	T	89.8	Confident	84.9	Confident	12 Å²	12	58.9 Å²	58.9	7%	0.074	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	144.6	-177.8	57.5	0	0	0	0	111.2	L283 A305 S306 K308 F740	L283-T813 HydrophobicContact CB-CG2 4.48Å; L283-T813 HydrophobicContact CD2-CG2 3.61Å; L283-T813 WeakPolarHBondContact O-CA 3.05Å; A305-T813 WeakPolarHBondContact CB-O 3.35Å; S306-T813 PolarHBondContact N-O 2.7Å; S306-T813 VanDerWaalsContact N-O 3.07Å; S306-T813 PolarHBondContact O-N 2.99Å; S306-T813 PolarHBondContact O-OG1 3.48Å; S306-T813 PolarHBondContact OG-O 2.88Å; S306-T813 PolarHBondContact OG-OG1 3.24Å; K308-T813 HydrophobicContact CB-CG2 3.92Å; K308-T813 HydrophobicContact CD-CG2 4.06Å; K308-T813 HydrophobicContact CG-CG2 4.17Å; F740-T813 HydrophobicContact CZ-CG2 4.22Å
814	R	86.4	Confident	84.1	Confident	38 Å²	38	61.5 Å²	61.5	14%	0.143	31%	0.311	C	S	.	.			trans	-119	94.4	175.4	-172.6	-173.4	65.7	-173.3	-3.9	110.4	L283 G284 W285 R816 E819	L283-R814 PolarHBondContact O-N 3Å; G284-R814 PolarHBondContact O-NE 3.22Å; G284-R814 PolarHBondContact O-NH2 2.84Å; W285-R814 HydrophobicContact CD2-CB 4.46Å; W285-R814 HydrophobicContact CH2-CB 4.26Å; W285-R814 HydrophobicContact CZ2-CB 4.21Å; W285-R814 HydrophobicContact CZ3-CB 4.43Å; W285-R814 PolarHBondContact O-NH2 3.4Å; R814-R816 PolarHBondContact O-N 3.4Å; R814-R816 VanDerWaalsContact O-N 3.08Å; R814-E819 WeakPolarHBondContact CD-OE1 3.3Å; R814-E819 HydrophobicContact CG-CG 4.36Å
815	D	79.5	Confident	83.3	Confident	85 Å²	85	66.3 Å²	66.3	46%	0.455	33%	0.326	S	S	.	.			trans	-66	106.7	170.4	-176.4	-7.7	0	0	0	110.4	A817 F818 E819	D815-A817 WeakPolarHBondContact OD1-CA 3.1Å; D815-A817 WeakPolarHBondContact OD1-CB 3.41Å; D815-A817 PolarHBondContact OD1-N 3.38Å; D815-F818 HydrophobicContact CB-CB 3.9Å; D815-F818 PolarHBondContact OD1-N 3.4Å; D815-F818 WeakPolarHBondContact OD2-CB 3.33Å; D815-E819 WeakPolarHBondContact O-CG 3.48Å; D815-E819 PolarHBondContact O-N 3.06Å
816	R	74	Confident	82.6	Confident	133 Å²	133	67.3 Å²	67.3	50%	0.502	33%	0.331	S	S	.	.	H	α-helix	trans	-72.3	-27.8	177.4	-59.9	-177.3	-175.5	-153.8	-1.8	112.9	G284 W285 R814 S820	G284-R816 PolarHBondContact O-NE 3.39Å; G284-R816 PolarHBondContact O-NH2 3.25Å; W285-R816 PolarHBondContact O-NH2 2.81Å; R814-R816 PolarHBondContact O-N 3.4Å; R814-R816 VanDerWaalsContact O-N 3.08Å; R816-S820 WeakPolarHBondContact O-CB 3.46Å; R816-S820 PolarHBondContact O-N 3.38Å
817	A	68.6	Low	81.9	Confident	65 Å²	65	66.6 Å²	66.6	54%	0.537	33%	0.331	S	S	.	.	H	α-helix	trans	-71.3	-45	176.5	0	0	0	0	0	109.3	D815 S820 T821	D815-A817 WeakPolarHBondContact OD1-CA 3.1Å; D815-A817 WeakPolarHBondContact OD1-CB 3.41Å; D815-A817 PolarHBondContact OD1-N 3.38Å; A817-S820 PolarHBondContact O-N 2.9Å; A817-T821 WeakPolarHBondContact O-CB 3.34Å; A817-T821 PolarHBondContact O-N 3.34Å; A817-T821 PolarHBondContact O-OG1 3.5Å; A817-T821 VanDerWaalsContact O-OG1 3.08Å
818	F	73.4	Confident	81.1	Confident	130 Å²	130	70.8 Å²	70.8	57%	0.57	35%	0.348	S	S	*	.	H	α-helix	trans	-62.5	-48	171.7	-174.4	-99.5	0	0	0	112.4	D815 S820 T821 L822	D815-F818 HydrophobicContact CB-CB 3.9Å; D815-F818 PolarHBondContact OD1-N 3.4Å; D815-F818 WeakPolarHBondContact OD2-CB 3.33Å; F818-S820 VanDerWaalsContact C-N 3.27Å; F818-S820 PolarHBondContact O-N 3.36Å; F818-T821 PolarHBondContact O-N 2.86Å; F818-L822 HydrophobicContact CE1-CD2 4.2Å; F818-L822 VanDerWaalsContact O-CB 3.28Å; F818-L822 WeakPolarHBondContact O-CB 3.42Å; F818-L822 PolarHBondContact O-N 3.3Å
819	E	72.2	Confident	79.5	Confident	55 Å²	55	70 Å²	70	26%	0.257	35%	0.348	S	S	.	.	H	α-helix	trans	-56	-41.4	174.4	-80.1	-165	154.3	0	0	112.2	K301 R814 D815 K823	K301-E819 WeakPolarHBondContact CG-OE1 3.38Å; K301-E819 IonicContact NZ-OE1 2.71Å; K301-E819 PolarHBondContact NZ-OE1 3.06Å; K301-E819 IonicContact NZ-OE2 3.17Å; K301-E819 PolarHBondContact NZ-OE2 3.49Å; R814-E819 WeakPolarHBondContact CD-OE1 3.3Å; R814-E819 HydrophobicContact CG-CG 4.36Å; D815-E819 WeakPolarHBondContact O-CG 3.48Å; D815-E819 PolarHBondContact O-N 3.06Å; E819-K823 VanDerWaalsContact O-CB 3.25Å; E819-K823 WeakPolarHBondContact O-CB 3.41Å; E819-K823 PolarHBondContact O-N 3.08Å
820	S	75.3	Confident	77.9	Confident	81 Å²	81	75.3 Å²	75.3	57%	0.566	37%	0.371	S	S	*	.	H	α-helix	trans	-69.9	-41.7	179.7	-169.8	0	0	0	0	111.9	R816 A817 F818 S824	R816-S820 WeakPolarHBondContact O-CB 3.46Å; R816-S820 PolarHBondContact O-N 3.38Å; A817-S820 PolarHBondContact O-N 2.9Å; F818-S820 VanDerWaalsContact C-N 3.27Å; F818-S820 PolarHBondContact O-N 3.36Å; S820-S824 VanDerWaalsContact O-CB 3.28Å; S820-S824 WeakPolarHBondContact O-CB 3.37Å; S820-S824 PolarHBondContact O-N 2.92Å; S820-S824 PolarHBondContact O-OG 3.22Å
821	T	80.2	Confident	75.9	Confident	91 Å²	91	77.9 Å²	77.9	56%	0.558	39%	0.394	S	S	*	.	H	α-helix	trans	-64.5	-49.4	174.9	-64.8	0	0	0	0	111.1	A817 F818 K823 S824 W825	A817-T821 WeakPolarHBondContact O-CB 3.34Å; A817-T821 PolarHBondContact O-N 3.34Å; A817-T821 PolarHBondContact O-OG1 3.5Å; A817-T821 VanDerWaalsContact O-OG1 3.08Å; F818-T821 PolarHBondContact O-N 2.86Å; T821-K823 PolarHBondContact O-N 3.27Å; T821-S824 CarbonylContact O-C 3.59Å; T821-S824 PolarHBondContact O-N 2.95Å; T821-S824 VanDerWaalsContact O-N 3.14Å; T821-S824 PolarHBondContact O-OG 2.92Å; T821-W825 PolarHBondContact O-N 2.87Å
822	L	77.3	Confident	73.4	Confident	68 Å²	68	83.7 Å²	83.7	36%	0.356	42%	0.42	S	S	.	.	H	α-helix	trans	-57.6	-49.2	177.2	-179.8	64.9	0	0	0	110.8	F818 S824 W825 E826	F818-L822 HydrophobicContact CE1-CD2 4.2Å; F818-L822 VanDerWaalsContact O-CB 3.28Å; F818-L822 WeakPolarHBondContact O-CB 3.42Å; F818-L822 PolarHBondContact O-N 3.3Å; L822-S824 VanDerWaalsContact C-N 3.34Å; L822-S824 PolarHBondContact O-N 2.98Å; L822-W825 HydrophobicContact CD1-CE3 4.43Å; L822-W825 WeakPolarHBondContact O-CB 3.39Å; L822-W825 PolarHBondContact O-N 2.99Å; L822-W825 VanDerWaalsContact O-N 3.1Å; L822-E826 PolarHBondContact O-N 2.94Å
823	K	77.8	Confident	71.2	Confident	123 Å²	123	90.9 Å²	90.9	54%	0.535	45%	0.452	S	S	.	.	H	α-helix	trans	-61.5	-41.1	175.6	-178.3	175.8	173.3	-177.9	0	111.9	E819 T821 W825 E826 D827	E819-K823 VanDerWaalsContact O-CB 3.25Å; E819-K823 WeakPolarHBondContact O-CB 3.41Å; E819-K823 PolarHBondContact O-N 3.08Å; T821-K823 PolarHBondContact O-N 3.27Å; K823-W825 PolarHBondContact O-N 3.25Å; K823-E826 PolarHBondContact O-N 3.27Å; K823-D827 WeakPolarHBondContact CE-OD2 3.26Å; K823-D827 WeakPolarHBondContact CG-OD2 3.26Å; K823-D827 IonicContact NZ-OD2 3.38Å; K823-D827 VanDerWaalsContact O-CB 3.3Å; K823-D827 WeakPolarHBondContact O-CB 3.32Å; K823-D827 VanDerWaalsContact O-CG 3.28Å; K823-D827 PolarHBondContact O-N 3.08Å
824	S	78.4	Confident	68.5	Low	55 Å²	55	94.9 Å²	94.9	39%	0.385	48%	0.478	S	S	.	.	H	α-helix	trans	-65.9	-24.4	176.9	79.6	0	0	0	0	113.2	S820 T821 L822 K828	S820-S824 VanDerWaalsContact O-CB 3.28Å; S820-S824 WeakPolarHBondContact O-CB 3.37Å; S820-S824 PolarHBondContact O-N 2.92Å; S820-S824 PolarHBondContact O-OG 3.22Å; T821-S824 CarbonylContact O-C 3.59Å; T821-S824 PolarHBondContact O-N 2.95Å; T821-S824 VanDerWaalsContact O-N 3.14Å; T821-S824 PolarHBondContact O-OG 2.92Å; L822-S824 VanDerWaalsContact C-N 3.34Å; L822-S824 PolarHBondContact O-N 2.98Å; S824-K828 WeakPolarHBondContact O-CB 3.41Å; S824-K828 WeakPolarHBondContact O-CD 3.25Å; S824-K828 WeakPolarHBondContact O-CG 3.35Å; S824-K828 PolarHBondContact O-N 3.29Å
825	W	79.2	Confident	66	Low	145 Å²	145	102 Å²	102	55%	0.549	51%	0.513	S	S	.	.	H	α-helix	trans	-80.2	-45.4	173.2	176.7	87	0	0	0	111.2	T821 L822 K823 D827 K828 Q829	T821-W825 PolarHBondContact O-N 2.87Å; L822-W825 HydrophobicContact CD1-CE3 4.43Å; L822-W825 WeakPolarHBondContact O-CB 3.39Å; L822-W825 PolarHBondContact O-N 2.99Å; L822-W825 VanDerWaalsContact O-N 3.1Å; K823-W825 PolarHBondContact O-N 3.25Å; W825-D827 VanDerWaalsContact C-N 3.33Å; W825-D827 PolarHBondContact O-N 3.1Å; W825-K828 WeakPolarHBondContact O-CB 3.5Å; W825-K828 PolarHBondContact O-N 2.97Å; W825-Q829 HydrophobicContact CD2-CG 4.29Å; W825-Q829 HydrophobicContact CH2-CG 4.19Å; W825-Q829 HydrophobicContact CZ2-CG 3.91Å; W825-Q829 HydrophobicContact CZ3-CG 4.5Å; W825-Q829 WeakPolarHBondContact O-CG 3.26Å; W825-Q829 PolarHBondContact O-N 3Å
826	E	80.2	Confident	64.1	Low	80 Å²	80	102.6 Å²	102.6	37%	0.374	52%	0.521	S	S	.	.	H	α-helix	trans	-59	-43.2	172.6	-69.3	-177.8	-162.5	0	0	112.2	L822 K823 K828 Q829 K830	L822-E826 PolarHBondContact O-N 2.94Å; K823-E826 PolarHBondContact O-N 3.27Å; E826-K828 VanDerWaalsContact C-N 3.32Å; E826-Q829 PolarHBondContact O-N 2.86Å; E826-K830 WeakPolarHBondContact O-CD 3.46Å; E826-K830 WeakPolarHBondContact O-CE 3.36Å; E826-K830 VanDerWaalsContact O-CG 3.23Å; E826-K830 WeakPolarHBondContact O-CG 3.43Å; E826-K830 PolarHBondContact O-N 3.39Å; E826-K830 IonicContact OE2-NZ 2.76Å; E826-K830 PolarHBondContact OE2-NZ 3.23Å
827	D	76	Confident	62.3	Low	61 Å²	61	102.2 Å²	102.2	33%	0.326	54%	0.539	S	S	.	.	H	α-helix	trans	-72.9	-27.1	-178.3	-68.9	-9.7	0	0	0	111.2	K823 W825 K830 C831	K823-D827 WeakPolarHBondContact CE-OD2 3.26Å; K823-D827 WeakPolarHBondContact CG-OD2 3.26Å; K823-D827 IonicContact NZ-OD2 3.38Å; K823-D827 VanDerWaalsContact O-CB 3.3Å; K823-D827 WeakPolarHBondContact O-CB 3.32Å; K823-D827 VanDerWaalsContact O-CG 3.28Å; K823-D827 PolarHBondContact O-N 3.08Å; W825-D827 VanDerWaalsContact C-N 3.33Å; W825-D827 PolarHBondContact O-N 3.1Å; D827-K830 IonicContact OD1-NZ 2.71Å; D827-K830 PolarHBondContact OD1-NZ 3.36Å; D827-C831 PolarHBondContact O-N 3.13Å; D827-C831 VanDerWaalsContact O-N 3.1Å; D827-C831 PolarHBondContact O-SG 3.03Å
828	K	74.7	Confident	60.9	Low	119 Å²	119	103.9 Å²	103.9	52%	0.517	54%	0.539	S	S	.	.	H	α-helix	trans	-66	-48.7	165.7	-80.5	170.8	-179.4	-175	0	111.8	S824 W825 E826 K830 C831 E832	S824-K828 WeakPolarHBondContact O-CB 3.41Å; S824-K828 WeakPolarHBondContact O-CD 3.25Å; S824-K828 WeakPolarHBondContact O-CG 3.35Å; S824-K828 PolarHBondContact O-N 3.29Å; W825-K828 WeakPolarHBondContact O-CB 3.5Å; W825-K828 PolarHBondContact O-N 2.97Å; E826-K828 VanDerWaalsContact C-N 3.32Å; K828-K830 VanDerWaalsContact C-N 3.25Å; K828-K830 PolarHBondContact O-N 2.77Å; K828-C831 CarbonylContact O-C 3.47Å; K828-C831 WeakPolarHBondContact O-CA 3.41Å; K828-C831 WeakPolarHBondContact O-CB 3.25Å; K828-C831 PolarHBondContact O-N 3.21Å; K828-E832 WeakPolarHBondContact O-CG 3.25Å; K828-E832 PolarHBondContact O-N 2.93Å
829	Q	58.3	Low	59.3	Low	76 Å²	76	102.5 Å²	102.5	36%	0.355	54%	0.543	S	S	.	.	H	α-helix	trans	-60.2	-34.7	177.6	-71.5	-87.3	-88.1	0	0	112.3	W825 E826 E832 F833	W825-Q829 HydrophobicContact CD2-CG 4.29Å; W825-Q829 HydrophobicContact CH2-CG 4.19Å; W825-Q829 HydrophobicContact CZ2-CG 3.91Å; W825-Q829 HydrophobicContact CZ3-CG 4.5Å; W825-Q829 WeakPolarHBondContact O-CG 3.26Å; W825-Q829 PolarHBondContact O-N 3Å; E826-Q829 PolarHBondContact O-N 2.86Å; Q829-E832 PolarHBondContact NE2-OE2 3.17Å; Q829-E832 PolarHBondContact O-N 3.36Å; Q829-F833 PolarHBondContact O-N 3.04Å
830	K	57.3	Low	57.9	Low	113 Å²	113	106.2 Å²	106.2	49%	0.491	57%	0.572	S	S	.	*	H	α-helix	trans	-67.9	-34.9	171.6	-67.2	160.5	-149.7	158.7	0	112.5	E826 D827 K828 F833	E826-K830 WeakPolarHBondContact O-CD 3.46Å; E826-K830 WeakPolarHBondContact O-CE 3.36Å; E826-K830 VanDerWaalsContact O-CG 3.23Å; E826-K830 WeakPolarHBondContact O-CG 3.43Å; E826-K830 PolarHBondContact O-N 3.39Å; E826-K830 IonicContact OE2-NZ 2.76Å; E826-K830 PolarHBondContact OE2-NZ 3.23Å; D827-K830 IonicContact OD1-NZ 2.71Å; D827-K830 PolarHBondContact OD1-NZ 3.36Å; K828-K830 VanDerWaalsContact C-N 3.25Å; K828-K830 PolarHBondContact O-N 2.77Å; K830-F833 CarbonylContact O-C 3.55Å
831	C	50.2	Low	56.7	Low	104 Å²	104	105.8 Å²	105.8	70%	0.703	56%	0.561	S	S	*	*	H	α-helix	trans	-77.1	-20.4	174.3	-71.7	0	0	0	0	114	D827 K828 P834	D827-C831 PolarHBondContact O-N 3.13Å; D827-C831 VanDerWaalsContact O-N 3.1Å; D827-C831 PolarHBondContact O-SG 3.03Å; K828-C831 CarbonylContact O-C 3.47Å; K828-C831 WeakPolarHBondContact O-CA 3.41Å; K828-C831 WeakPolarHBondContact O-CB 3.25Å; K828-C831 PolarHBondContact O-N 3.21Å; C831-P834 WeakPolarHBondContact O-CD 3.36Å
832	E	40	Very low	55.5	Low	121 Å²	121	104.4 Å²	104.4	57%	0.565	55%	0.553	S	S	*	*	H	α-helix	trans	-81.3	-18.3	172.9	-72.5	166.4	156.6	0	0	112.3	K828 Q829 P834	K828-E832 WeakPolarHBondContact O-CG 3.25Å; K828-E832 PolarHBondContact O-N 2.93Å; Q829-E832 PolarHBondContact NE2-OE2 3.17Å; Q829-E832 PolarHBondContact O-N 3.36Å; E832-P834 VanDerWaalsContact C-CD 3.48Å
833	F	45.6	Very low	54.5	Low	154 Å²	154	110.2 Å²	110.2	68%	0.675	58%	0.578	S	S	*	*			trans	-129	58.1	177.5	-68.1	-79	0	0	0	115.7	Q829 K830 Q835	Q829-F833 PolarHBondContact O-N 3.04Å; K830-F833 CarbonylContact O-C 3.55Å; F833-Q835 PolarHBondContact O-N 2.71Å
834	P	34.9	Very low	53.7	Low	96 Å²	96	108.9 Å²	108.9	62%	0.623	58%	0.581	S	S	*	*			trans	-73.6	101.5	154.5	31.3	-28.3	0	0	0	108.3	C831 E832 P836	C831-P834 WeakPolarHBondContact O-CD 3.36Å; E832-P834 VanDerWaalsContact C-CD 3.48Å; P834-P836 WeakPolarHBondContact O-CD 3.44Å
835	Q	33.8	Very low	53.1	Low	187 Å²	187	107.1 Å²	107.1	87%	0.874	57%	0.568	S	S	*	*			trans	-81.3	103.8	163	-84	-171.5	-33.3	0	0	109.5	F833	F833-Q835 PolarHBondContact O-N 2.71Å
836	P	38.6	Very low	52.8	Low	97 Å²	97	103 Å²	103	63%	0.63	56%	0.561	S	S	*	*			trans	-65	143.2	151	31.3	-33.8	0	0	0	108.2	P834 L838	P834-P836 WeakPolarHBondContact O-CD 3.44Å; P836-L838 VanDerWaalsContact C-N 3.29Å; P836-L838 PolarHBondContact O-N 3.25Å
837	S	36.5	Very low	52.4	Low	126 Å²	126	107.3 Å²	107.3	88%	0.881	58%	0.581	S	S	*	*			trans	-72.3	87.1	171.6	55.5	0	0	0	0	109.6
838	L	39.5	Very low	52.2	Low	100 Å²	100	110.1 Å²	110.1	52%	0.524	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-58.9	148.9	171.7	-76.2	164	0	0	0	110.6	P836	P836-L838 VanDerWaalsContact C-N 3.29Å; P836-L838 PolarHBondContact O-N 3.25Å
839	P	39.3	Very low	52.3	Low	100 Å²	100	106.2 Å²	106.2	65%	0.649	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-60.6	158.5	169.4	28.5	-35	0	0	0	110.6	Q841	P839-Q841 PolarHBondContact O-N 2.96Å; P839-Q841 VanDerWaalsContact O-N 3.09Å
840	P	43	Very low	53.2	Low	133 Å²	133	103.6 Å²	103.6	86%	0.864	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-58.5	117.2	-178.5	24.6	-34.4	0	0	0	110.7
841	Q	50.1	Low	54.3	Low	73 Å²	73	103.5 Å²	103.5	34%	0.341	58%	0.575	S	S	.	*	P	Polyproline II helix	trans	-72.8	146.4	174.2	-69.6	-169.8	-19.3	0	0	110.3	P839	P839-Q841 PolarHBondContact O-N 2.96Å; P839-Q841 VanDerWaalsContact O-N 3.09Å
842	P	55.1	Low	55.9	Low	61 Å²	61	100.6 Å²	100.6	40%	0.396	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-65.3	146	166.5	30.1	-34.3	0	0	0	109.9	T844 C905	P842-T844 VanDerWaalsContact C-N 3.26Å; P842-T844 PolarHBondContact O-N 3.24Å; P842-C905 PolarHBondContact O-SG 3.37Å
843	E	55.8	Low	57.9	Low	190 Å²	190	95.1 Å²	95.1	89%	0.888	53%	0.527	S	S	*	.	S	Bend	trans	-76.8	-13.9	179.7	-63.4	-174.4	139.2	0	0	112.9
844	T	61.5	Low	59.7	Low	95 Å²	95	89.5 Å²	89.5	58%	0.583	51%	0.507	S	S	*	.	S	Bend	trans	-136	140.6	-179.1	54.2	0	0	0	0	111.2	P842	P842-T844 VanDerWaalsContact C-N 3.26Å; P842-T844 PolarHBondContact O-N 3.24Å
845	V	65.9	Low	62.1	Low	19 Å²	19	88.9 Å²	88.9	12%	0.115	50%	0.496	C	S	.	.			trans	-77.3	141.4	172.3	-179.1	0	0	0	0	110.1	E849 A850 L903 V908 W961	V845-E849 HydrophobicContact CG1-CB 3.42Å; V845-E849 VanDerWaalsContact CG1-CB 3.42Å; V845-A850 HydrophobicContact CG1-CB 4.23Å; V845-L903 HydrophobicContact CG2-CB 4.37Å; V845-V908 HydrophobicContact CG2-CG2 4.47Å; V845-W961 HydrophobicContact CG2-CH2 4.19Å; V845-W961 HydrophobicContact CG2-CZ2 4.1Å
846	S	73.5	Confident	64.8	Low	59 Å²	59	80 Å²	80	41%	0.413	45%	0.454	S	S	.	.			trans	-68.5	157.6	175.1	-170.9	0	0	0	0	112.3	D848 E849 A850	S846-D848 VanDerWaalsContact C-N 3.32Å; S846-D848 PolarHBondContact O-N 3.19Å; S846-E849 WeakPolarHBondContact CB-OE2 3.47Å; S846-E849 PolarHBondContact N-OE2 3.23Å; S846-E849 PolarHBondContact O-N 3.5Å; S846-A850 WeakPolarHBondContact O-CB 3.47Å; S846-A850 PolarHBondContact O-N 3.25Å
847	E	70	Confident	67.1	Low	169 Å²	169	75.4 Å²	75.4	79%	0.79	43%	0.425	S	S	*	.	H	α-helix	trans	-58.9	-42.8	175.7	-64.8	-171.5	146.4	0	0	111.8	E849 A850 L851	E847-E849 PolarHBondContact O-N 3.16Å; E847-A850 PolarHBondContact O-N 3.43Å; E847-L851 WeakPolarHBondContact O-CG 3.44Å; E847-L851 PolarHBondContact O-N 2.96Å; E847-L851 VanDerWaalsContact O-N 3.09Å
848	D	72.9	Confident	69.5	Low	120 Å²	120	75.3 Å²	75.3	64%	0.642	41%	0.411	S	S	*	.	H	α-helix	trans	-63.3	-39.5	175.5	-62.1	-51.4	0	0	0	112.4	S846 L851 L852	S846-D848 VanDerWaalsContact C-N 3.32Å; S846-D848 PolarHBondContact O-N 3.19Å; D848-L851 PolarHBondContact O-N 3.1Å; D848-L852 PolarHBondContact O-N 2.83Å
849	E	77.2	Confident	71.9	Confident	38 Å²	38	71 Å²	71	18%	0.178	39%	0.39	C	S	.	.	H	α-helix	trans	-70.1	-37.7	177	-68.8	176.4	131.7	0	0	111.2	V845 S846 E847 L851 L852 V853 V959 W961	V845-E849 HydrophobicContact CG1-CB 3.42Å; V845-E849 VanDerWaalsContact CG1-CB 3.42Å; S846-E849 WeakPolarHBondContact CB-OE2 3.47Å; S846-E849 PolarHBondContact N-OE2 3.23Å; S846-E849 PolarHBondContact O-N 3.5Å; E847-E849 PolarHBondContact O-N 3.16Å; E849-L851 VanDerWaalsContact C-N 3.3Å; E849-L851 PolarHBondContact O-N 3.49Å; E849-L852 PolarHBondContact O-N 3.42Å; E849-V853 WeakPolarHBondContact O-CB 3.4Å; E849-V853 VanDerWaalsContact O-CG2 3.28Å; E849-V853 WeakPolarHBondContact O-CG2 3.42Å; E849-V853 PolarHBondContact O-N 2.88Å; E849-V959 WeakPolarHBondContact OE1-CG1 3.43Å; E849-W961 PolarHBondContact OE1-NE1 3.25Å
850	A	77.5	Confident	74.3	Confident	20 Å²	20	66.2 Å²	66.2	17%	0.165	36%	0.359	C	S	.	.	H	α-helix	trans	-65.7	-33.2	177.5	0	0	0	0	0	112	V845 S846 E847 S854 L903	V845-A850 HydrophobicContact CG1-CB 4.23Å; S846-A850 WeakPolarHBondContact O-CB 3.47Å; S846-A850 PolarHBondContact O-N 3.25Å; E847-A850 PolarHBondContact O-N 3.43Å; A850-S854 WeakPolarHBondContact O-CB 3.49Å; A850-S854 PolarHBondContact O-N 3.13Å; A850-L903 HydrophobicContact CB-CD1 4.38Å
851	L	80.6	Confident	76.4	Confident	111 Å²	111	61.2 Å²	61.2	58%	0.581	33%	0.331	S	S	*	.	H	α-helix	trans	-64.2	-48.8	170.3	-70.4	171.5	0	0	0	111.5	E847 D848 E849 V853 S854 E855	E847-L851 WeakPolarHBondContact O-CG 3.44Å; E847-L851 PolarHBondContact O-N 2.96Å; E847-L851 VanDerWaalsContact O-N 3.09Å; D848-L851 PolarHBondContact O-N 3.1Å; E849-L851 VanDerWaalsContact C-N 3.3Å; E849-L851 PolarHBondContact O-N 3.49Å; L851-V853 VanDerWaalsContact C-N 3.34Å; L851-V853 PolarHBondContact O-N 3.13Å; L851-S854 WeakPolarHBondContact O-CB 3.32Å; L851-S854 PolarHBondContact O-N 2.91Å; L851-S854 VanDerWaalsContact O-N 3.1Å; L851-E855 PolarHBondContact O-N 3.34Å
852	L	81.9	Confident	78.3	Confident	43 Å²	43	60.3 Å²	60.3	23%	0.225	34%	0.336	C	S	.	.	H	α-helix	trans	-60.3	-41.4	176.7	-66.3	173.1	0	0	0	112.5	D848 E849 S854 E855 F856 R955 L956 V959	D848-L852 PolarHBondContact O-N 2.83Å; E849-L852 PolarHBondContact O-N 3.42Å; L852-S854 VanDerWaalsContact C-N 3.3Å; L852-S854 PolarHBondContact O-N 3.09Å; L852-E855 PolarHBondContact O-N 3.13Å; L852-F856 WeakPolarHBondContact O-CB 3.32Å; L852-F856 PolarHBondContact O-N 2.79Å; L852-R955 VanDerWaalsContact CD2-NH2 3.3Å; L852-L956 HydrophobicContact CB-CD2 3.91Å; L852-V959 HydrophobicContact CD1-CG2 4.38Å
853	V	83.6	Confident	80	Confident	6 Å²	6	57.4 Å²	57.4	4%	0.036	32%	0.317	C	S	.	.	H	α-helix	trans	-64.6	-35.2	175.4	171.2	0	0	0	0	111.4	E849 L851 G857 V895 V908 M911 L956	E849-V853 WeakPolarHBondContact O-CB 3.4Å; E849-V853 VanDerWaalsContact O-CG2 3.28Å; E849-V853 WeakPolarHBondContact O-CG2 3.42Å; E849-V853 PolarHBondContact O-N 2.88Å; L851-V853 VanDerWaalsContact C-N 3.34Å; L851-V853 PolarHBondContact O-N 3.13Å; V853-G857 PolarHBondContact O-N 3.35Å; V853-V895 HydrophobicContact CG1-CG1 4.46Å; V853-V908 HydrophobicContact CB-CG1 4.46Å; V853-V908 HydrophobicContact CG1-CG1 3.91Å; V853-V908 HydrophobicContact CG1-CG2 4.22Å; V853-V908 HydrophobicContact CG2-CG1 3.6Å; V853-M911 HydrophobicContact CG1-CE 3.73Å; V853-L956 HydrophobicContact CG2-CD2 4.29Å
854	S	82.9	Confident	81.6	Confident	37 Å²	37	48.6 Å²	48.6	26%	0.259	28%	0.276	S	S	.	.	H	α-helix	trans	-71	-40.9	175.3	-171.9	0	0	0	0	112.8	A850 L851 L852 G857 Q858 Y896	A850-S854 WeakPolarHBondContact O-CB 3.49Å; A850-S854 PolarHBondContact O-N 3.13Å; L851-S854 WeakPolarHBondContact O-CB 3.32Å; L851-S854 PolarHBondContact O-N 2.91Å; L851-S854 VanDerWaalsContact O-N 3.1Å; L852-S854 VanDerWaalsContact C-N 3.3Å; L852-S854 PolarHBondContact O-N 3.09Å; S854-G857 PolarHBondContact O-N 2.65Å; S854-Q858 WeakPolarHBondContact O-CB 3.31Å; S854-Q858 VanDerWaalsContact O-CG 3.25Å; S854-Q858 WeakPolarHBondContact O-CG 3.46Å; S854-Q858 PolarHBondContact O-N 2.88Å; S854-Q858 PolarHBondContact O-NE2 3.24Å; S854-Q858 PolarHBondContact OG-NE2 2.85Å; S854-Q858 VanDerWaalsContact OG-NE2 3.16Å; S854-Y896 PolarHBondContact O-OH 2.89Å; S854-Y896 VanDerWaalsContact O-OH 3.08Å
855	E	85.8	Confident	82.9	Confident	82 Å²	82	49.4 Å²	49.4	38%	0.383	27%	0.273	S	S	.	.	H	α-helix	trans	-63.3	-45.2	175	-71.7	-177.5	173.5	0	0	111.2	L851 L852 Q858 A859 R955	L851-E855 PolarHBondContact O-N 3.34Å; L852-E855 PolarHBondContact O-N 3.13Å; E855-Q858 PolarHBondContact O-N 3.08Å; E855-A859 PolarHBondContact O-N 2.94Å; E855-R955 IonicContact OE2-CZ 3.97Å; E855-R955 IonicContact OE2-NH1 2.83Å; E855-R955 PolarHBondContact OE2-NH1 2.71Å; E855-R955 IonicContact OE2-NH2 3.61Å; E855-R955 PolarHBondContact OE2-NH2 3.39Å
856	F	89.1	Confident	83.9	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60.8	-45.5	174.4	174.6	-100.4	0	0	0	112.8	L852 Q858 A859 A860 M911 V912 V915 V949 E952 L953 L956	L852-F856 WeakPolarHBondContact O-CB 3.32Å; L852-F856 PolarHBondContact O-N 2.79Å; F856-Q858 VanDerWaalsContact C-N 3.32Å; F856-Q858 PolarHBondContact O-N 3.2Å; F856-A859 PolarHBondContact O-N 2.93Å; F856-A860 WeakPolarHBondContact O-CB 3.47Å; F856-A860 PolarHBondContact O-N 3.29Å; F856-M911 HydrophobicContact CD1-CE 4.12Å; F856-M911 HydrophobicContact CE1-CE 4.46Å; F856-V912 HydrophobicContact CD1-CG2 4.3Å; F856-V912 HydrophobicContact CE1-CB 4.4Å; F856-V912 HydrophobicContact CE1-CG2 3.85Å; F856-V912 HydrophobicContact CZ-CG2 4.4Å; F856-V915 HydrophobicContact CE1-CB 4.03Å; F856-V915 HydrophobicContact CE1-CG1 4Å; F856-V915 HydrophobicContact CE1-CG2 4.3Å; F856-V915 HydrophobicContact CE2-CG1 4.13Å; F856-V915 HydrophobicContact CZ-CB 3.77Å; F856-V915 HydrophobicContact CZ-CG1 3.45Å; F856-V915 VanDerWaalsContact CZ-CG1 3.45Å; F856-V949 HydrophobicContact CE2-CG1 4.22Å; F856-E952 HydrophobicContact CB-CB 4.2Å; F856-E952 HydrophobicContact CD2-CB 3.94Å; F856-L953 HydrophobicContact CE2-CB 4.04Å; F856-L953 HydrophobicContact CE2-CD1 3.91Å; F856-L953 HydrophobicContact CZ-CD1 4.2Å; F856-L956 HydrophobicContact CB-CD1 3.71Å; F856-L956 HydrophobicContact CB-CG 4.35Å; F856-L956 HydrophobicContact CD1-CD1 3.75Å; F856-L956 HydrophobicContact CD2-CD1 3.7Å; F856-L956 HydrophobicContact CE1-CD1 4.26Å; F856-L956 HydrophobicContact CE2-CD1 4.22Å; F856-L956 HydrophobicContact CG-CD1 3.43Å; F856-L956 VanDerWaalsContact CG-CD1 3.43Å; F856-L956 HydrophobicContact CG-CG 4.46Å; F856-L956 HydrophobicContact CZ-CD1 4.46Å
857	G	86.7	Confident	84.6	Confident	2 Å²	2	46 Å²	46	2%	0.021	25%	0.25	C	S	.	.	H	α-helix	trans	-66.9	-30.8	178	0	0	0	0	0	113.4	V853 S854 A860 G861 Y896	V853-G857 PolarHBondContact O-N 3.35Å; S854-G857 PolarHBondContact O-N 2.65Å; G857-A860 PolarHBondContact O-N 3.13Å; G857-G861 PolarHBondContact O-N 3.16Å; G857-Y896 VanDerWaalsContact C-OH 3.24Å; G857-Y896 VanDerWaalsContact CA-OH 3.23Å; G857-Y896 WeakPolarHBondContact CA-OH 3.14Å
858	Q	87.1	Confident	85.4	Confident	124 Å²	124	43.1 Å²	43.1	58%	0.579	23%	0.232	S	C	*	.	H	α-helix	trans	-67.3	-44	171.2	-74.9	170.6	59.2	0	0	111.8	S854 E855 F856 A860 G861 A862 Y896	S854-Q858 WeakPolarHBondContact O-CB 3.31Å; S854-Q858 VanDerWaalsContact O-CG 3.25Å; S854-Q858 WeakPolarHBondContact O-CG 3.46Å; S854-Q858 PolarHBondContact O-N 2.88Å; S854-Q858 PolarHBondContact O-NE2 3.24Å; S854-Q858 PolarHBondContact OG-NE2 2.85Å; S854-Q858 VanDerWaalsContact OG-NE2 3.16Å; E855-Q858 PolarHBondContact O-N 3.08Å; F856-Q858 VanDerWaalsContact C-N 3.32Å; F856-Q858 PolarHBondContact O-N 3.2Å; Q858-A860 VanDerWaalsContact C-N 3.35Å; Q858-A860 PolarHBondContact O-N 2.97Å; Q858-G861 PolarHBondContact O-N 3.27Å; Q858-A862 PolarHBondContact O-N 3.26Å; Q858-Y896 PolarHBondContact N-OH 2.86Å
859	A	89.6	Confident	86	Confident	9 Å²	9	40.8 Å²	40.8	7%	0.074	22%	0.217	C	C	.	.	H	α-helix	trans	-61.5	-42.8	173.8	0	0	0	0	0	111.7	E855 F856 G861 A862 L863 V949 E952	E855-A859 PolarHBondContact O-N 2.94Å; F856-A859 PolarHBondContact O-N 2.93Å; A859-G861 PolarHBondContact O-N 3.01Å; A859-A862 PolarHBondContact O-N 3.28Å; A859-L863 PolarHBondContact O-N 3.03Å; A859-V949 VanDerWaalsContact C-CG2 3.45Å; A859-V949 HydrophobicContact CB-CG2 3.91Å; A859-V949 WeakPolarHBondContact O-CG2 3.25Å; A859-E952 HydrophobicContact CB-CG 4.22Å
860	A	90	Very high	86.3	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.7	-39.4	175.9	0	0	0	0	0	112.5	F856 G857 Q858 L863 I864 M892 V915	F856-A860 WeakPolarHBondContact O-CB 3.47Å; F856-A860 PolarHBondContact O-N 3.29Å; G857-A860 PolarHBondContact O-N 3.13Å; Q858-A860 VanDerWaalsContact C-N 3.35Å; Q858-A860 PolarHBondContact O-N 2.97Å; A860-L863 PolarHBondContact O-N 3.16Å; A860-I864 WeakPolarHBondContact O-CB 3.4Å; A860-I864 WeakPolarHBondContact O-CG1 3.38Å; A860-I864 PolarHBondContact O-N 3.27Å; A860-M892 HydrophobicContact CB-SD 3.68Å; A860-V915 HydrophobicContact CB-CB 4.43Å; A860-V915 HydrophobicContact CB-CG1 3.69Å; A860-V915 HydrophobicContact CB-CG2 3.78Å
861	G	88.8	Confident	86.6	Confident	27 Å²	27	38.8 Å²	38.8	28%	0.278	21%	0.207	S	C	.	.	H	α-helix	trans	-61.4	-42	172	0	0	0	0	0	113	G857 Q858 A859 I864 H865	G857-G861 PolarHBondContact O-N 3.16Å; Q858-G861 PolarHBondContact O-N 3.27Å; A859-G861 PolarHBondContact O-N 3.01Å; G861-I864 PolarHBondContact O-N 2.97Å; G861-H865 PolarHBondContact O-N 3.08Å
862	A	88.9	Confident	86.7	Confident	55 Å²	55	40.6 Å²	40.6	46%	0.455	21%	0.212	S	C	.	.	H	α-helix	trans	-65	-40.4	175.4	0	0	0	0	0	112.4	Q858 A859 H865 S866	Q858-A862 PolarHBondContact O-N 3.26Å; A859-A862 PolarHBondContact O-N 3.28Å; A862-H865 PolarHBondContact O-N 3.45Å; A862-S866 PolarHBondContact O-N 3.04Å
863	L	90.1	Very high	86.5	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61.9	-46.2	172.7	176.7	60.6	0	0	0	111.7	A859 A860 H865 S866 I867 L942 A945 L946 V949	A859-L863 PolarHBondContact O-N 3.03Å; A860-L863 PolarHBondContact O-N 3.16Å; L863-H865 VanDerWaalsContact C-N 3.3Å; L863-H865 PolarHBondContact O-N 2.98Å; L863-S866 PolarHBondContact O-N 3.28Å; L863-I867 HydrophobicContact CD1-CD1 3.85Å; L863-I867 HydrophobicContact CD1-CG1 4.16Å; L863-I867 HydrophobicContact CG-CD1 3.87Å; L863-I867 WeakPolarHBondContact O-CG1 3.41Å; L863-I867 PolarHBondContact O-N 3.3Å; L863-L942 HydrophobicContact CD1-CD1 3.69Å; L863-A945 HydrophobicContact CB-CB 4.29Å; L863-A945 HydrophobicContact CD1-CB 4.05Å; L863-L946 HydrophobicContact CD1-CD2 3.57Å; L863-L946 HydrophobicContact CD1-CG 3.83Å; L863-L946 HydrophobicContact CD2-CD2 3.82Å; L863-L946 HydrophobicContact CG-CD2 4.36Å; L863-V949 HydrophobicContact CB-CG2 3.93Å; L863-V949 HydrophobicContact CD2-CB 4.39Å; L863-V949 HydrophobicContact CD2-CG2 3.95Å
864	I	90.1	Very high	86.3	Confident	4 Å²	4	47 Å²	47	2%	0.021	24%	0.238	C	C	.	.	H	α-helix	trans	-61.9	-36.9	176.4	-76.4	164.5	0	0	0	111.7	A860 G861 R868 V885 M892 L918	A860-I864 WeakPolarHBondContact O-CB 3.4Å; A860-I864 WeakPolarHBondContact O-CG1 3.38Å; A860-I864 PolarHBondContact O-N 3.27Å; G861-I864 PolarHBondContact O-N 2.97Å; I864-R868 WeakPolarHBondContact O-CB 3.23Å; I864-R868 VanDerWaalsContact O-CG 3.24Å; I864-R868 WeakPolarHBondContact O-CG 3.43Å; I864-R868 PolarHBondContact O-N 2.97Å; I864-V885 HydrophobicContact CG2-CG1 4.14Å; I864-M892 HydrophobicContact CD1-CE 3.53Å; I864-M892 HydrophobicContact CD1-SD 4.39Å; I864-L918 HydrophobicContact CD1-CD2 4.03Å; I864-L918 HydrophobicContact CG1-CD2 3.59Å
865	H	88.4	Confident	86.1	Confident	112 Å²	112	51.5 Å²	51.5	52%	0.519	26%	0.255	S	S	.	.	H	α-helix	trans	-64.2	-51	173.5	-164.3	-81	0	0	0	111.2	G861 A862 L863 I867 R868 E869	G861-H865 PolarHBondContact O-N 3.08Å; A862-H865 PolarHBondContact O-N 3.45Å; L863-H865 VanDerWaalsContact C-N 3.3Å; L863-H865 PolarHBondContact O-N 2.98Å; H865-I867 PolarHBondContact O-N 3.5Å; H865-R868 CarbonylContact O-C 3.5Å; H865-R868 WeakPolarHBondContact O-CA 3.32Å; H865-R868 PolarHBondContact O-N 3.32Å; H865-E869 IonicContact CE1-OE1 3.42Å; H865-E869 PolarHBondContact CE1-OE1 2.98Å; H865-E869 IonicContact CE1-OE2 3.39Å; H865-E869 PolarHBondContact CE1-OE2 3Å; H865-E869 IonicContact ND1-OE1 3.82Å; H865-E869 IonicContact ND1-OE2 3.2Å; H865-E869 PolarHBondContact ND1-OE2 3.25Å; H865-E869 WeakPolarHBondContact O-CG 3.35Å; H865-E869 PolarHBondContact O-N 3.32Å
866	S	87.4	Confident	85.6	Confident	4 Å²	4	49.7 Å²	49.7	3%	0.028	25%	0.252	C	S	.	.	H	α-helix	trans	-59.6	-42.5	179.7	-175.6	0	0	0	0	112.4	A862 L863 R868 E869 V870	A862-S866 PolarHBondContact O-N 3.04Å; L863-S866 PolarHBondContact O-N 3.28Å; S866-R868 PolarHBondContact O-N 3.45Å; S866-E869 PolarHBondContact O-N 3.37Å; S866-V870 WeakPolarHBondContact O-CG2 3.43Å; S866-V870 PolarHBondContact O-N 3.45Å
867	I	87.1	Confident	85.1	Confident	4 Å²	4	49.8 Å²	49.8	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-62.7	-42	174.2	-65.5	166.4	0	0	0	110.9	L863 H865 V870 A871 M877 L881 V885 L918 T922 L942	L863-I867 HydrophobicContact CD1-CD1 3.85Å; L863-I867 HydrophobicContact CD1-CG1 4.16Å; L863-I867 HydrophobicContact CG-CD1 3.87Å; L863-I867 WeakPolarHBondContact O-CG1 3.41Å; L863-I867 PolarHBondContact O-N 3.3Å; H865-I867 PolarHBondContact O-N 3.5Å; I867-V870 PolarHBondContact O-N 3.34Å; I867-A871 WeakPolarHBondContact O-CB 3.49Å; I867-A871 PolarHBondContact O-N 3.46Å; I867-M877 HydrophobicContact CG2-CG 4.42Å; I867-M877 HydrophobicContact CG2-SD 4.28Å; I867-L881 HydrophobicContact CD1-CD1 4.28Å; I867-L881 HydrophobicContact CG1-CD1 4.49Å; I867-L881 HydrophobicContact CG2-CB 4.43Å; I867-L881 HydrophobicContact CG2-CD1 3.91Å; I867-V885 HydrophobicContact CD1-CG2 4.39Å; I867-V885 HydrophobicContact CG2-CG2 3.85Å; I867-L918 HydrophobicContact CD1-CD1 3.95Å; I867-L918 HydrophobicContact CD1-CG 4.38Å; I867-T922 HydrophobicContact CD1-CG2 4.1Å; I867-T922 HydrophobicContact CG1-CG2 4.38Å; I867-L942 HydrophobicContact CG1-CD1 3.75Å
868	R	87.2	Confident	84.8	Confident	108 Å²	108	54 Å²	54	41%	0.408	27%	0.272	S	S	.	.	H	α-helix	trans	-69	-28.4	177.2	-75.1	173.1	177.8	163.5	3.1	113.4	I864 H865 S866 Q872 V885 S889	I864-R868 WeakPolarHBondContact O-CB 3.23Å; I864-R868 VanDerWaalsContact O-CG 3.24Å; I864-R868 WeakPolarHBondContact O-CG 3.43Å; I864-R868 PolarHBondContact O-N 2.97Å; H865-R868 CarbonylContact O-C 3.5Å; H865-R868 WeakPolarHBondContact O-CA 3.32Å; H865-R868 PolarHBondContact O-N 3.32Å; S866-R868 PolarHBondContact O-N 3.45Å; R868-Q872 WeakPolarHBondContact O-CG 3.44Å; R868-Q872 PolarHBondContact O-NE2 2.88Å; R868-V885 HydrophobicContact CG-CG1 4.47Å; R868-S889 PolarHBondContact NH2-OG 2.98Å; R868-S889 VanDerWaalsContact NH2-OG 3.15Å
869	E	86.2	Confident	84.5	Confident	71 Å²	71	55.3 Å²	55.3	33%	0.332	28%	0.278	S	S	.	.	H	α-helix	trans	-72.3	-49.3	172.4	-73.2	176.3	117.9	0	0	111.3	H865 S866 A871 Q872 F873	H865-E869 IonicContact CE1-OE1 3.42Å; H865-E869 PolarHBondContact CE1-OE1 2.98Å; H865-E869 IonicContact CE1-OE2 3.39Å; H865-E869 PolarHBondContact CE1-OE2 3Å; H865-E869 IonicContact ND1-OE1 3.82Å; H865-E869 IonicContact ND1-OE2 3.2Å; H865-E869 PolarHBondContact ND1-OE2 3.25Å; H865-E869 WeakPolarHBondContact O-CG 3.35Å; H865-E869 PolarHBondContact O-N 3.32Å; S866-E869 PolarHBondContact O-N 3.37Å; E869-A871 VanDerWaalsContact C-N 3.32Å; E869-A871 PolarHBondContact O-N 3.1Å; E869-Q872 WeakPolarHBondContact O-CB 3.3Å; E869-Q872 PolarHBondContact O-N 2.97Å; E869-F873 WeakPolarHBondContact O-CD2 3.46Å
870	V	83.2	Confident	84.1	Confident	3 Å²	3	61 Å²	61	2%	0.018	30%	0.303	C	S	.	.	H	α-helix	trans	-65.9	-35.5	179.1	177.1	0	0	0	0	111.6	S866 I867 Q872 F873 H874 M877 L934 Q938	S866-V870 WeakPolarHBondContact O-CG2 3.43Å; S866-V870 PolarHBondContact O-N 3.45Å; I867-V870 PolarHBondContact O-N 3.34Å; V870-Q872 PolarHBondContact O-N 3.01Å; V870-F873 PolarHBondContact O-N 3.5Å; V870-F873 VanDerWaalsContact O-N 3.07Å; V870-H874 PolarHBondContact O-N 2.91Å; V870-M877 HydrophobicContact CB-CE 4.49Å; V870-M877 HydrophobicContact CB-SD 3.89Å; V870-M877 HydrophobicContact CG1-CE 3.64Å; V870-M877 HydrophobicContact CG1-SD 3.58Å; V870-M877 VanDerWaalsContact CG1-SD 3.58Å; V870-L934 HydrophobicContact CG1-CD2 3.42Å; V870-L934 VanDerWaalsContact CG1-CD2 3.42Å; V870-Q938 HydrophobicContact CG2-CB 4.27Å
871	A	84.3	Confident	83.9	Confident	13 Å²	13	61.2 Å²	61.2	11%	0.107	30%	0.304	C	S	.	.	H	α-helix	trans	-58	-30.9	175.8	0	0	0	0	0	114	I867 E869 F873 H874 E878	I867-A871 WeakPolarHBondContact O-CB 3.49Å; I867-A871 PolarHBondContact O-N 3.46Å; E869-A871 VanDerWaalsContact C-N 3.32Å; E869-A871 PolarHBondContact O-N 3.1Å; A871-F873 PolarHBondContact O-N 3.49Å; A871-H874 CarbonylContact O-C 3.54Å; A871-H874 PolarHBondContact O-N 2.93Å; A871-E878 HydrophobicContact CB-CB 4.05Å; A871-E878 HydrophobicContact CB-CG 4.47Å
872	Q	82.5	Confident	83.7	Confident	148 Å²	148	61.6 Å²	61.6	69%	0.692	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-26.6	176.9	-69.6	168.3	51.3	0	0	112.8	R868 E869 V870	R868-Q872 WeakPolarHBondContact O-CG 3.44Å; R868-Q872 PolarHBondContact O-NE2 2.88Å; E869-Q872 WeakPolarHBondContact O-CB 3.3Å; E869-Q872 PolarHBondContact O-N 2.97Å; V870-Q872 PolarHBondContact O-N 3.01Å
873	F	77.9	Confident	83.4	Confident	143 Å²	143	66.4 Å²	66.4	63%	0.627	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-25.8	177.2	-55.7	-79.3	0	0	0	112	E869 V870 A871	E869-F873 WeakPolarHBondContact O-CD2 3.46Å; V870-F873 PolarHBondContact O-N 3.5Å; V870-F873 VanDerWaalsContact O-N 3.07Å; A871-F873 PolarHBondContact O-N 3.49Å
874	H	79.7	Confident	83.2	Confident	40 Å²	40	66.8 Å²	66.8	19%	0.185	32%	0.32	C	S	.	.			trans	-126	81.4	-176.4	-60.3	-83.5	0	0	0	112.3	V870 A871 S876 M877 E878 Q933	V870-H874 PolarHBondContact O-N 2.91Å; A871-H874 CarbonylContact O-C 3.54Å; A871-H874 PolarHBondContact O-N 2.93Å; H874-S876 PolarHBondContact O-N 3.49Å; H874-M877 HydrophobicContact CB-CB 4.33Å; H874-M877 WeakPolarHBondContact O-CB 3.39Å; H874-M877 PolarHBondContact O-N 3.43Å; H874-E878 PolarHBondContact O-N 3.47Å; H874-Q933 PolarHBondContact CE1-O 3.03Å
875	H	77.2	Confident	83.1	Confident	132 Å²	132	67 Å²	67	61%	0.611	32%	0.321	S	S	*	.	H	α-helix	trans	-57	-19.5	178	-169.6	57.3	0	0	0	114.4	E878 Q879	H875-E878 IonicContact CE1-OE2 2.81Å; H875-E878 PolarHBondContact CE1-OE2 2.71Å; H875-E878 IonicContact CG-OE2 3.66Å; H875-E878 IonicContact ND1-OE2 3.38Å; H875-E878 PolarHBondContact ND1-OE2 2.9Å; H875-E878 WeakPolarHBondContact O-CB 3.34Å; H875-E878 PolarHBondContact O-N 3.03Å; H875-Q879 WeakPolarHBondContact O-CB 3.37Å; H875-Q879 PolarHBondContact O-N 2.98Å
876	S	75.4	Confident	83.1	Confident	45 Å²	45	66.1 Å²	66.1	32%	0.315	32%	0.321	S	S	.	.	H	α-helix	trans	-71.1	-27.3	170.9	49.7	0	0	0	0	113.8	H874 E880	H874-S876 PolarHBondContact O-N 3.49Å; S876-E880 WeakPolarHBondContact O-CG 3.35Å
877	M	79.1	Confident	82.9	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-74.2	-40.2	170.8	-177.7	176.3	-69.8	0	0	110.6	I867 V870 H874 L881 L925 L934 L942	I867-M877 HydrophobicContact CG2-CG 4.42Å; I867-M877 HydrophobicContact CG2-SD 4.28Å; V870-M877 HydrophobicContact CB-CE 4.49Å; V870-M877 HydrophobicContact CB-SD 3.89Å; V870-M877 HydrophobicContact CG1-CE 3.64Å; V870-M877 HydrophobicContact CG1-SD 3.58Å; V870-M877 VanDerWaalsContact CG1-SD 3.58Å; H874-M877 HydrophobicContact CB-CB 4.33Å; H874-M877 WeakPolarHBondContact O-CB 3.39Å; H874-M877 PolarHBondContact O-N 3.43Å; M877-L881 HydrophobicContact CG-CD1 3.82Å; M877-L881 HydrophobicContact CG-CG 4.47Å; M877-L881 WeakPolarHBondContact O-CB 3.48Å; M877-L881 PolarHBondContact O-N 3.43Å; M877-L925 HydrophobicContact CB-CD2 4.23Å; M877-L925 HydrophobicContact CE-CD2 4.23Å; M877-L925 HydrophobicContact CG-CD2 3.8Å; M877-L934 HydrophobicContact CE-CD1 4.15Å; M877-L934 HydrophobicContact CE-CD2 4.15Å; M877-L942 HydrophobicContact CE-CD2 3.97Å; M877-L942 HydrophobicContact SD-CD2 4.41Å
878	E	80	Confident	82.9	Confident	92 Å²	92	67.2 Å²	67.2	43%	0.43	33%	0.331	S	S	.	.	H	α-helix	trans	-57.6	-49.5	172.7	-163.8	-175	177.2	0	0	111.1	A871 H874 H875 E880 A882	A871-E878 HydrophobicContact CB-CB 4.05Å; A871-E878 HydrophobicContact CB-CG 4.47Å; H874-E878 PolarHBondContact O-N 3.47Å; H875-E878 IonicContact CE1-OE2 2.81Å; H875-E878 PolarHBondContact CE1-OE2 2.71Å; H875-E878 IonicContact CG-OE2 3.66Å; H875-E878 IonicContact ND1-OE2 3.38Å; H875-E878 PolarHBondContact ND1-OE2 2.9Å; H875-E878 WeakPolarHBondContact O-CB 3.34Å; H875-E878 PolarHBondContact O-N 3.03Å; E878-E880 VanDerWaalsContact C-N 3.33Å; E878-E880 PolarHBondContact O-N 3.35Å; E878-A882 WeakPolarHBondContact O-CB 3.19Å; E878-A882 PolarHBondContact O-N 3.25Å
879	Q	80.7	Confident	83	Confident	151 Å²	151	63 Å²	63	71%	0.706	32%	0.317	S	S	*	.	H	α-helix	trans	-61.8	-35.7	-176.3	-175.8	171.9	10.2	0	0	114	H875	H875-Q879 WeakPolarHBondContact O-CB 3.37Å; H875-Q879 PolarHBondContact O-N 2.98Å
880	E	81.6	Confident	83	Confident	128 Å²	128	66.6 Å²	66.6	60%	0.598	33%	0.332	S	S	*	.	H	α-helix	trans	-85.9	-43.9	-179.5	-59.4	-77.1	160.1	0	0	111.5	S876 E878 L925	S876-E880 WeakPolarHBondContact O-CG 3.35Å; E878-E880 VanDerWaalsContact C-N 3.33Å; E878-E880 PolarHBondContact O-N 3.35Å; E880-L925 HydrophobicContact CB-CD1 4.37Å; E880-L925 HydrophobicContact CG-CD1 4.32Å
881	L	86.1	Confident	83	Confident	4 Å²	4	67.1 Å²	67.1	2%	0.021	34%	0.337	C	S	.	.	H	α-helix	trans	-92.2	-12.2	-171.9	-60.8	-179.3	0	0	0	115.4	I867 M877 H883 A884 V885 E921 T922 L925	I867-L881 HydrophobicContact CD1-CD1 4.28Å; I867-L881 HydrophobicContact CG1-CD1 4.49Å; I867-L881 HydrophobicContact CG2-CB 4.43Å; I867-L881 HydrophobicContact CG2-CD1 3.91Å; M877-L881 HydrophobicContact CG-CD1 3.82Å; M877-L881 HydrophobicContact CG-CG 4.47Å; M877-L881 WeakPolarHBondContact O-CB 3.48Å; M877-L881 PolarHBondContact O-N 3.43Å; L881-H883 PolarHBondContact O-N 3.38Å; L881-A884 PolarHBondContact O-N 2.93Å; L881-V885 HydrophobicContact CB-CG2 4.16Å; L881-V885 WeakPolarHBondContact O-CB 3.38Å; L881-V885 WeakPolarHBondContact O-CG2 3.48Å; L881-V885 PolarHBondContact O-N 3.02Å; L881-E921 HydrophobicContact CD2-CB 3.77Å; L881-T922 HydrophobicContact CD1-CG2 4.08Å; L881-L925 HydrophobicContact CD1-CD2 3.76Å; L881-L925 HydrophobicContact CD2-CD2 4.4Å; L881-L925 HydrophobicContact CG-CD2 3.91Å
882	A	84.5	Confident	83	Confident	36 Å²	36	67.2 Å²	67.2	30%	0.298	34%	0.335	S	S	.	.	H	α-helix	trans	-56.5	-28.3	-174.6	0	0	0	0	0	114.3	E878 N886	E878-A882 WeakPolarHBondContact O-CB 3.19Å; E878-A882 PolarHBondContact O-N 3.25Å; A882-N886 VanDerWaalsContact O-CB 3.27Å; A882-N886 WeakPolarHBondContact O-CB 3.21Å; A882-N886 VanDerWaalsContact O-CG 3.24Å; A882-N886 PolarHBondContact O-N 3.27Å; A882-N886 PolarHBondContact O-ND2 2.94Å
883	H	83.3	Confident	83	Confident	155 Å²	155	64.8 Å²	64.8	72%	0.718	33%	0.327	S	S	*	.	H	α-helix	trans	-69.2	-54.8	176.3	-172.9	-92	0	0	0	111.7	L881 V885 N886 A887	L881-H883 PolarHBondContact O-N 3.38Å; H883-V885 PolarHBondContact O-N 3Å; H883-N886 PolarHBondContact O-N 3.47Å; H883-A887 WeakPolarHBondContact O-CB 3.34Å; H883-A887 PolarHBondContact O-N 3.38Å
884	A	84.8	Confident	83.2	Confident	8 Å²	8	61.4 Å²	61.4	7%	0.066	32%	0.318	C	S	.	.	H	α-helix	trans	-65.8	-36.5	179.9	0	0	0	0	0	112.8	L881 S888 L918 E921	L881-A884 PolarHBondContact O-N 2.93Å; A884-S888 VanDerWaalsContact O-CB 3.26Å; A884-S888 WeakPolarHBondContact O-CB 2.96Å; A884-S888 PolarHBondContact O-N 3.46Å; A884-S888 PolarHBondContact O-OG 3.18Å; A884-L918 HydrophobicContact CB-CB 4.13Å; A884-L918 HydrophobicContact CB-CD1 3.89Å; A884-E921 VanDerWaalsContact CB-OE2 3.25Å; A884-E921 WeakPolarHBondContact CB-OE2 3.16Å
885	V	88.1	Confident	83.3	Confident	8 Å²	8	59.8 Å²	59.8	5%	0.048	31%	0.31	C	S	.	.	H	α-helix	trans	-61.7	-45.6	174.5	169.1	0	0	0	0	111.2	I864 I867 R868 L881 H883 S889 L918	I864-V885 HydrophobicContact CG2-CG1 4.14Å; I867-V885 HydrophobicContact CD1-CG2 4.39Å; I867-V885 HydrophobicContact CG2-CG2 3.85Å; R868-V885 HydrophobicContact CG-CG1 4.47Å; L881-V885 HydrophobicContact CB-CG2 4.16Å; L881-V885 WeakPolarHBondContact O-CB 3.38Å; L881-V885 WeakPolarHBondContact O-CG2 3.48Å; L881-V885 PolarHBondContact O-N 3.02Å; H883-V885 PolarHBondContact O-N 3Å; V885-S889 VanDerWaalsContact O-CB 3.23Å; V885-S889 WeakPolarHBondContact O-CB 3.32Å; V885-S889 PolarHBondContact O-N 3.45Å; V885-L918 HydrophobicContact CG2-CD1 3.63Å; V885-L918 HydrophobicContact CG2-CD2 4.46Å
886	N	88.2	Confident	83.3	Confident	95 Å²	95	58.6 Å²	58.6	51%	0.508	30%	0.302	S	S	.	.	H	α-helix	trans	-76	-33	-178.5	-71.6	-38.7	0	0	0	112.9	A882 H883 K890	A882-N886 VanDerWaalsContact O-CB 3.27Å; A882-N886 WeakPolarHBondContact O-CB 3.21Å; A882-N886 VanDerWaalsContact O-CG 3.24Å; A882-N886 PolarHBondContact O-N 3.27Å; A882-N886 PolarHBondContact O-ND2 2.94Å; H883-N886 PolarHBondContact O-N 3.47Å; N886-K890 VanDerWaalsContact O-CB 3.31Å; N886-K890 WeakPolarHBondContact O-CB 3.46Å; N886-K890 PolarHBondContact O-N 3Å; N886-K890 VanDerWaalsContact O-N 3.13Å
887	A	83.9	Confident	83.3	Confident	31 Å²	31	60.7 Å²	60.7	26%	0.256	32%	0.321	S	S	.	.	H	α-helix	trans	-61.7	-53.7	170.3	0	0	0	0	0	111	H883 S889 K890 A891	H883-A887 WeakPolarHBondContact O-CB 3.34Å; H883-A887 PolarHBondContact O-N 3.38Å; A887-S889 PolarHBondContact O-N 3.32Å; A887-K890 PolarHBondContact O-N 3.05Å; A887-A891 PolarHBondContact O-N 2.92Å
888	S	88.1	Confident	82.8	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-59.7	-46.5	179.5	-56.9	0	0	0	0	112.2	A884 K890 A891 M892 D914	A884-S888 VanDerWaalsContact O-CB 3.26Å; A884-S888 WeakPolarHBondContact O-CB 2.96Å; A884-S888 PolarHBondContact O-N 3.46Å; A884-S888 PolarHBondContact O-OG 3.18Å; S888-K890 VanDerWaalsContact C-N 3.34Å; S888-K890 PolarHBondContact O-N 3.42Å; S888-A891 PolarHBondContact O-N 2.81Å; S888-M892 WeakPolarHBondContact O-CG 3.42Å; S888-M892 PolarHBondContact O-N 3.12Å; S888-D914 PolarHBondContact OG-O 3.48Å
889	S	88.3	Confident	81.8	Confident	18 Å²	18	62.7 Å²	62.7	13%	0.126	34%	0.336	C	S	.	.	H	α-helix	trans	-54	-51.2	175.6	-166.2	0	0	0	0	110.8	R868 V885 A887 A891 M892 D893	R868-S889 PolarHBondContact NH2-OG 2.98Å; R868-S889 VanDerWaalsContact NH2-OG 3.15Å; V885-S889 VanDerWaalsContact O-CB 3.23Å; V885-S889 WeakPolarHBondContact O-CB 3.32Å; V885-S889 PolarHBondContact O-N 3.45Å; A887-S889 PolarHBondContact O-N 3.32Å; S889-A891 PolarHBondContact O-N 2.97Å; S889-M892 PolarHBondContact O-N 2.9Å; S889-D893 PolarHBondContact O-N 2.83Å; S889-D893 VanDerWaalsContact O-OD2 3.08Å
890	K	85.6	Confident	80.7	Confident	148 Å²	148	60.1 Å²	60.1	64%	0.643	33%	0.333	S	S	*	.	H	α-helix	trans	-65.8	-34.6	-179.1	-174.8	-177.6	176.6	-171.7	0	113.2	N886 A887 S888 D893 V894	N886-K890 VanDerWaalsContact O-CB 3.31Å; N886-K890 WeakPolarHBondContact O-CB 3.46Å; N886-K890 PolarHBondContact O-N 3Å; N886-K890 VanDerWaalsContact O-N 3.13Å; A887-K890 PolarHBondContact O-N 3.05Å; S888-K890 VanDerWaalsContact C-N 3.34Å; S888-K890 PolarHBondContact O-N 3.42Å; K890-D893 PolarHBondContact O-N 3.21Å; K890-V894 WeakPolarHBondContact O-CG2 3.25Å; K890-V894 PolarHBondContact O-N 3.35Å
891	A	84.1	Confident	79.3	Confident	13 Å²	13	62.6 Å²	62.6	11%	0.107	34%	0.344	C	S	.	.	H	α-helix	trans	-69.2	-40.8	176.4	0	0	0	0	0	111.7	A887 S888 S889 V894 V895 M911 D914	A887-A891 PolarHBondContact O-N 2.92Å; S888-A891 PolarHBondContact O-N 2.81Å; S889-A891 PolarHBondContact O-N 2.97Å; A891-V894 PolarHBondContact O-N 2.9Å; A891-V895 PolarHBondContact O-N 3.14Å; A891-M911 HydrophobicContact CB-CB 4.24Å; A891-M911 HydrophobicContact CB-CG 4.46Å; A891-D914 HydrophobicContact CB-CB 4.42Å; A891-D914 VanDerWaalsContact CB-OD2 3.26Å; A891-D914 WeakPolarHBondContact CB-OD2 3.33Å
892	M	83.3	Confident	78	Confident	16 Å²	16	64.9 Å²	64.9	8%	0.079	36%	0.364	C	S	.	.	H	α-helix	trans	-62.6	-44.6	171	-65.8	-170.2	-46.2	0	0	111.7	A860 I864 S888 S889 V894 V895 Y896 M911	A860-M892 HydrophobicContact CB-SD 3.68Å; I864-M892 HydrophobicContact CD1-CE 3.53Å; I864-M892 HydrophobicContact CD1-SD 4.39Å; S888-M892 WeakPolarHBondContact O-CG 3.42Å; S888-M892 PolarHBondContact O-N 3.12Å; S889-M892 PolarHBondContact O-N 2.9Å; M892-V894 PolarHBondContact O-N 3.16Å; M892-V895 PolarHBondContact O-N 2.89Å; M892-Y896 HydrophobicContact CB-CD2 4.16Å; M892-Y896 HydrophobicContact CB-CE2 4.28Å; M892-Y896 WeakPolarHBondContact O-CD2 3.4Å; M892-Y896 PolarHBondContact O-N 3.21Å; M892-M911 HydrophobicContact CB-SD 4.22Å; M892-M911 HydrophobicContact CG-CG 3.83Å; M892-M911 HydrophobicContact CG-SD 3.76Å
893	D	83.9	Confident	77.2	Confident	97 Å²	97	64.2 Å²	64.2	52%	0.519	36%	0.355	S	S	.	.	H	α-helix	trans	-56.2	-38.9	177.8	-64.3	-36.1	0	0	0	111.6	S889 K890 V895 A897	S889-D893 PolarHBondContact O-N 2.83Å; S889-D893 VanDerWaalsContact O-OD2 3.08Å; K890-D893 PolarHBondContact O-N 3.21Å; D893-V895 VanDerWaalsContact C-N 3.33Å; D893-V895 PolarHBondContact O-N 2.86Å; D893-A897 WeakPolarHBondContact O-CB 3.38Å; D893-A897 PolarHBondContact O-N 2.91Å
894	V	82.2	Confident	76.7	Confident	72 Å²	72	58.6 Å²	58.6	44%	0.436	33%	0.334	S	S	.	.	H	α-helix	trans	-71.5	-23.9	177.5	168.9	0	0	0	0	113.4	K890 A891 M892 K898	K890-V894 WeakPolarHBondContact O-CG2 3.25Å; K890-V894 PolarHBondContact O-N 3.35Å; A891-V894 PolarHBondContact O-N 2.9Å; M892-V894 PolarHBondContact O-N 3.16Å; V894-K898 WeakPolarHBondContact O-CE 3.5Å
895	V	80.9	Confident	76.3	Confident	5 Å²	5	58.5 Å²	58.5	3%	0.03	33%	0.332	C	S	.	.	H	α-helix	trans	-81.8	-52.2	173.5	169.6	0	0	0	0	110.2	V853 A891 M892 D893 A897 K898 L903 M911	V853-V895 HydrophobicContact CG1-CG1 4.46Å; A891-V895 PolarHBondContact O-N 3.14Å; M892-V895 PolarHBondContact O-N 2.89Å; D893-V895 VanDerWaalsContact C-N 3.33Å; D893-V895 PolarHBondContact O-N 2.86Å; V895-A897 VanDerWaalsContact C-N 3.32Å; V895-A897 PolarHBondContact O-N 3.02Å; V895-K898 PolarHBondContact O-N 3.09Å; V895-L903 HydrophobicContact CG1-CD2 3.95Å; V895-L903 WeakPolarHBondContact O-CD2 3.45Å; V895-M911 HydrophobicContact CB-SD 3.86Å; V895-M911 HydrophobicContact CG1-CE 4.39Å; V895-M911 HydrophobicContact CG1-SD 4.05Å; V895-M911 HydrophobicContact CG2-CB 4.1Å; V895-M911 HydrophobicContact CG2-CG 4.48Å; V895-M911 HydrophobicContact CG2-SD 3.76Å
896	Y	78.5	Confident	75.7	Confident	108 Å²	108	61.8 Å²	61.8	42%	0.424	36%	0.356	S	S	.	.	H	α-helix	trans	-73	-16.4	-177.4	-70.9	-67.4	0	0	0	114.7	S854 G857 Q858 M892 K898	S854-Y896 PolarHBondContact O-OH 2.89Å; S854-Y896 VanDerWaalsContact O-OH 3.08Å; G857-Y896 VanDerWaalsContact C-OH 3.24Å; G857-Y896 VanDerWaalsContact CA-OH 3.23Å; G857-Y896 WeakPolarHBondContact CA-OH 3.14Å; Q858-Y896 PolarHBondContact N-OH 2.86Å; M892-Y896 HydrophobicContact CB-CD2 4.16Å; M892-Y896 HydrophobicContact CB-CE2 4.28Å; M892-Y896 WeakPolarHBondContact O-CD2 3.4Å; M892-Y896 PolarHBondContact O-N 3.21Å; Y896-K898 PolarHBondContact O-N 2.8Å
897	A	74.1	Confident	75.2	Confident	88 Å²	88	58.3 Å²	58.3	73%	0.727	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-1.8	172.1	0	0	0	0	0	114.4	D893 V895	D893-A897 WeakPolarHBondContact O-CB 3.38Å; D893-A897 PolarHBondContact O-N 2.91Å; V895-A897 VanDerWaalsContact C-N 3.32Å; V895-A897 PolarHBondContact O-N 3.02Å
898	K	67.9	Low	75.1	Confident	72 Å²	72	56.9 Å²	56.9	31%	0.313	33%	0.327	S	S	.	.	S	Bend	trans	-107.1	148.6	178.2	-63.7	174.5	179.5	179.4	0	110.6	V894 V895 Y896 A902 L903 S904 S907	V894-K898 WeakPolarHBondContact O-CE 3.5Å; V895-K898 PolarHBondContact O-N 3.09Å; Y896-K898 PolarHBondContact O-N 2.8Å; K898-A902 HydrophobicContact CB-CB 4.5Å; K898-L903 HydrophobicContact CB-CD2 4.15Å; K898-S904 PolarHBondContact NZ-OG 3.25Å; K898-S907 PolarHBondContact NZ-OG 3.5Å
899	S	58.9	Low	74.9	Confident	63 Å²	63	58.6 Å²	58.6	44%	0.441	34%	0.337	S	S	.	.			trans	-67.7	155.6	167.1	52.7	0	0	0	0	110.7	E901 A902	S899-E901 PolarHBondContact O-N 2.71Å; S899-A902 PolarHBondContact O-N 2.67Å
900	P	58.2	Low	74.5	Confident	97 Å²	97	63.2 Å²	63.2	63%	0.63	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-53.6	-41.3	179.7	-27.6	35.7	0	0	0	113.2	A902 L903	P900-A902 PolarHBondContact O-N 3.2Å; P900-A902 VanDerWaalsContact O-N 3.1Å; P900-L903 PolarHBondContact O-N 3.1Å
901	E	52.4	Low	74.6	Confident	180 Å²	180	56.2 Å²	56.2	84%	0.841	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-63.9	-11.7	177.7	-57.2	172.4	145.4	0	0	114.2	S899	S899-E901 PolarHBondContact O-N 2.71Å
902	A	58.1	Low	74.7	Confident	53 Å²	53	55.6 Å²	55.6	44%	0.438	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-116.7	11.1	-177.6	0	0	0	0	0	113.5	K898 S899 P900 S904	K898-A902 HydrophobicContact CB-CB 4.5Å; S899-A902 PolarHBondContact O-N 2.67Å; P900-A902 PolarHBondContact O-N 3.2Å; P900-A902 VanDerWaalsContact O-N 3.1Å; A902-S904 PolarHBondContact O-N 2.87Å; A902-S904 VanDerWaalsContact O-N 3.08Å
903	L	69.1	Low	74.8	Confident	21 Å²	21	57.6 Å²	57.6	11%	0.11	34%	0.337	C	S	.	.			trans	-74.3	96.4	179.6	-72.8	175.4	0	0	0	112.1	V845 A850 V895 K898 P900 C905	V845-L903 HydrophobicContact CG2-CB 4.37Å; A850-L903 HydrophobicContact CB-CD1 4.38Å; V895-L903 HydrophobicContact CG1-CD2 3.95Å; V895-L903 WeakPolarHBondContact O-CD2 3.45Å; K898-L903 HydrophobicContact CB-CD2 4.15Å; P900-L903 PolarHBondContact O-N 3.1Å; L903-C905 PolarHBondContact O-N 2.89Å
904	S	73.1	Confident	74.9	Confident	38 Å²	38	54.6 Å²	54.6	27%	0.266	32%	0.321	S	S	.	.			trans	-71.4	121.4	172.2	53	0	0	0	0	112	K898 A902 S906 S907	K898-S904 PolarHBondContact NZ-OG 3.25Å; A902-S904 PolarHBondContact O-N 2.87Å; A902-S904 VanDerWaalsContact O-N 3.08Å; S904-S906 PolarHBondContact O-N 3.19Å; S904-S907 WeakPolarHBondContact O-CB 3.17Å; S904-S907 PolarHBondContact O-N 3.4Å; S904-S907 PolarHBondContact OG-OG 2.86Å
905	C	75.3	Confident	75.1	Confident	5 Å²	5	51.2 Å²	51.2	3%	0.034	30%	0.3	C	S	.	.	H	α-helix	trans	-49.2	-34.9	-177.9	-56	0	0	0	0	114.1	P842 L903 S907 V908 V909 W961	P842-C905 PolarHBondContact O-SG 3.37Å; L903-C905 PolarHBondContact O-N 2.89Å; C905-S907 VanDerWaalsContact C-N 3.32Å; C905-S907 PolarHBondContact O-N 3.34Å; C905-V908 WeakPolarHBondContact O-CB 3.26Å; C905-V908 PolarHBondContact O-N 2.85Å; C905-V908 VanDerWaalsContact O-N 3.13Å; C905-V909 PolarHBondContact O-N 3.45Å; C905-W961 HydrophobicContact CB-CE3 4.13Å; C905-W961 HydrophobicContact CB-CH2 3.98Å; C905-W961 HydrophobicContact CB-CZ3 3.74Å
906	S	74.9	Confident	75.4	Confident	78 Å²	78	53.8 Å²	53.8	55%	0.545	31%	0.311	S	S	.	.	H	α-helix	trans	-62.3	-30.9	175.7	56.3	0	0	0	0	114.5	S904 H910	S904-S906 PolarHBondContact O-N 3.19Å; S906-H910 PolarHBondContact O-N 3.42Å
907	S	79	Confident	75.8	Confident	22 Å²	22	50.5 Å²	50.5	15%	0.154	31%	0.307	C	S	.	.	H	α-helix	trans	-71.6	-36.5	173	-56.5	0	0	0	0	111.6	K898 S904 C905 H910 M911	K898-S907 PolarHBondContact NZ-OG 3.5Å; S904-S907 WeakPolarHBondContact O-CB 3.17Å; S904-S907 PolarHBondContact O-N 3.4Å; S904-S907 PolarHBondContact OG-OG 2.86Å; C905-S907 VanDerWaalsContact C-N 3.32Å; C905-S907 PolarHBondContact O-N 3.34Å; S907-H910 PolarHBondContact O-N 3.07Å; S907-M911 PolarHBondContact O-N 3.07Å
908	V	82.3	Confident	76.5	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.006	27%	0.272	C	S	.	.	H	α-helix	trans	-67.7	-44.2	176.4	-176.6	0	0	0	0	110.6	V845 V853 C905 H910 M911 V912 W961 L962	V845-V908 HydrophobicContact CG2-CG2 4.47Å; V853-V908 HydrophobicContact CB-CG1 4.46Å; V853-V908 HydrophobicContact CG1-CG1 3.91Å; V853-V908 HydrophobicContact CG1-CG2 4.22Å; V853-V908 HydrophobicContact CG2-CG1 3.6Å; C905-V908 WeakPolarHBondContact O-CB 3.26Å; C905-V908 PolarHBondContact O-N 2.85Å; C905-V908 VanDerWaalsContact O-N 3.13Å; V908-H910 VanDerWaalsContact C-N 3.3Å; V908-H910 PolarHBondContact O-N 3.43Å; V908-M911 PolarHBondContact O-N 3.14Å; V908-V912 HydrophobicContact CG1-CG2 4.28Å; V908-V912 WeakPolarHBondContact O-CG2 3.5Å; V908-V912 PolarHBondContact O-N 2.96Å; V908-W961 HydrophobicContact CB-CH2 3.92Å; V908-W961 HydrophobicContact CB-CZ3 4.21Å; V908-W961 HydrophobicContact CG1-CH2 3.93Å; V908-W961 HydrophobicContact CG1-CZ3 4.37Å; V908-W961 HydrophobicContact CG2-CH2 4.41Å; V908-L962 HydrophobicContact CG1-CD1 4.33Å; V908-L962 HydrophobicContact CG1-CD2 4.32Å
909	V	82.6	Confident	77.4	Confident	36 Å²	36	43.5 Å²	43.5	22%	0.218	26%	0.26	C	S	.	.	H	α-helix	trans	-54.4	-45.7	172.9	168.8	0	0	0	0	111.5	C905 S913 W961 L962 V965	C905-V909 PolarHBondContact O-N 3.45Å; V909-S913 WeakPolarHBondContact O-CB 3.07Å; V909-S913 PolarHBondContact O-N 3.26Å; V909-W961 HydrophobicContact CG2-CE3 4.2Å; V909-W961 HydrophobicContact CG2-CZ3 4.04Å; V909-L962 HydrophobicContact CG2-CD2 4Å; V909-V965 HydrophobicContact CG1-CG2 4.1Å
910	H	80.9	Confident	78.7	Confident	114 Å²	114	43 Å²	43	53%	0.528	26%	0.257	S	S	.	.	H	α-helix	trans	-63.5	-47	179.4	-157.9	-54.2	0	0	0	111.5	S906 S907 V908 V912 S913 D914	S906-H910 PolarHBondContact O-N 3.42Å; S907-H910 PolarHBondContact O-N 3.07Å; V908-H910 VanDerWaalsContact C-N 3.3Å; V908-H910 PolarHBondContact O-N 3.43Å; H910-V912 PolarHBondContact O-N 3.38Å; H910-S913 WeakPolarHBondContact O-CB 3.4Å; H910-S913 PolarHBondContact O-N 3.46Å; H910-D914 IonicContact CE1-OD1 3.72Å; H910-D914 IonicContact CE1-OD2 3.64Å; H910-D914 PolarHBondContact CE1-OD2 3.39Å; H910-D914 IonicContact ND1-OD1 3.2Å; H910-D914 IonicContact ND1-OD2 3.84Å; H910-D914 PolarHBondContact ND1-OD2 3.44Å; H910-D914 PolarHBondContact O-N 2.84Å
911	M	86.9	Confident	80	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-60.7	-45.3	177.5	-174	-174.9	74.9	0	0	112.5	V853 F856 A891 M892 V895 S907 V908 S913 D914 V915	V853-M911 HydrophobicContact CG1-CE 3.73Å; F856-M911 HydrophobicContact CD1-CE 4.12Å; F856-M911 HydrophobicContact CE1-CE 4.46Å; A891-M911 HydrophobicContact CB-CB 4.24Å; A891-M911 HydrophobicContact CB-CG 4.46Å; M892-M911 HydrophobicContact CB-SD 4.22Å; M892-M911 HydrophobicContact CG-CG 3.83Å; M892-M911 HydrophobicContact CG-SD 3.76Å; V895-M911 HydrophobicContact CB-SD 3.86Å; V895-M911 HydrophobicContact CG1-CE 4.39Å; V895-M911 HydrophobicContact CG1-SD 4.05Å; V895-M911 HydrophobicContact CG2-CB 4.1Å; V895-M911 HydrophobicContact CG2-CG 4.48Å; V895-M911 HydrophobicContact CG2-SD 3.76Å; S907-M911 PolarHBondContact O-N 3.07Å; V908-M911 PolarHBondContact O-N 3.14Å; M911-S913 VanDerWaalsContact C-N 3.32Å; M911-S913 PolarHBondContact O-N 3.05Å; M911-D914 PolarHBondContact O-N 3.48Å; M911-V915 WeakPolarHBondContact O-CB 3.45Å; M911-V915 VanDerWaalsContact O-CG2 3.3Å; M911-V915 WeakPolarHBondContact O-CG2 3.31Å; M911-V915 PolarHBondContact O-N 2.87Å
912	V	86.7	Confident	81.6	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.3	-39.2	176.8	172.8	0	0	0	0	111	F856 V908 H910 K916 L953 L956 L962 I966	F856-V912 HydrophobicContact CD1-CG2 4.3Å; F856-V912 HydrophobicContact CE1-CB 4.4Å; F856-V912 HydrophobicContact CE1-CG2 3.85Å; F856-V912 HydrophobicContact CZ-CG2 4.4Å; V908-V912 HydrophobicContact CG1-CG2 4.28Å; V908-V912 WeakPolarHBondContact O-CG2 3.5Å; V908-V912 PolarHBondContact O-N 2.96Å; H910-V912 PolarHBondContact O-N 3.38Å; V912-K916 WeakPolarHBondContact O-CB 3.38Å; V912-K916 PolarHBondContact O-N 3.18Å; V912-L953 HydrophobicContact CG1-CD1 3.92Å; V912-L956 HydrophobicContact CG2-CD1 3.88Å; V912-L962 HydrophobicContact CG2-CD2 4.36Å; V912-I966 HydrophobicContact CG1-CG1 4.23Å
913	S	85.2	Confident	82.9	Confident	59 Å²	59	35.6 Å²	35.6	41%	0.413	21%	0.205	S	C	.	.	H	α-helix	trans	-64.8	-46.4	176.4	-172.5	0	0	0	0	112.8	V909 H910 M911 K916 A917	V909-S913 WeakPolarHBondContact O-CB 3.07Å; V909-S913 PolarHBondContact O-N 3.26Å; H910-S913 WeakPolarHBondContact O-CB 3.4Å; H910-S913 PolarHBondContact O-N 3.46Å; M911-S913 VanDerWaalsContact C-N 3.32Å; M911-S913 PolarHBondContact O-N 3.05Å; S913-K916 PolarHBondContact O-N 3.48Å; S913-A917 PolarHBondContact O-N 3.13Å
914	D	85.6	Confident	83.6	Confident	33 Å²	33	40.5 Å²	40.5	18%	0.176	23%	0.23	C	C	.	.	H	α-helix	trans	-66.7	-44.4	-179.4	-67.9	-38.9	0	0	0	111.7	S888 A891 H910 M911 K916 A917 L918	S888-D914 PolarHBondContact OG-O 3.48Å; A891-D914 HydrophobicContact CB-CB 4.42Å; A891-D914 VanDerWaalsContact CB-OD2 3.26Å; A891-D914 WeakPolarHBondContact CB-OD2 3.33Å; H910-D914 IonicContact CE1-OD1 3.72Å; H910-D914 IonicContact CE1-OD2 3.64Å; H910-D914 PolarHBondContact CE1-OD2 3.39Å; H910-D914 IonicContact ND1-OD1 3.2Å; H910-D914 IonicContact ND1-OD2 3.84Å; H910-D914 PolarHBondContact ND1-OD2 3.44Å; H910-D914 PolarHBondContact O-N 2.84Å; M911-D914 PolarHBondContact O-N 3.48Å; D914-K916 VanDerWaalsContact C-N 3.32Å; D914-K916 PolarHBondContact O-N 3.08Å; D914-A917 WeakPolarHBondContact O-CB 3.45Å; D914-A917 PolarHBondContact O-N 3.41Å; D914-A917 VanDerWaalsContact O-N 3.16Å; D914-L918 PolarHBondContact O-N 2.98Å
915	V	86.6	Confident	84	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-64.9	-36.3	177.2	172.9	0	0	0	0	111.4	F856 A860 M911 L918 L919 V949	F856-V915 HydrophobicContact CE1-CB 4.03Å; F856-V915 HydrophobicContact CE1-CG1 4Å; F856-V915 HydrophobicContact CE1-CG2 4.3Å; F856-V915 HydrophobicContact CE2-CG1 4.13Å; F856-V915 HydrophobicContact CZ-CB 3.77Å; F856-V915 HydrophobicContact CZ-CG1 3.45Å; F856-V915 VanDerWaalsContact CZ-CG1 3.45Å; A860-V915 HydrophobicContact CB-CB 4.43Å; A860-V915 HydrophobicContact CB-CG1 3.69Å; A860-V915 HydrophobicContact CB-CG2 3.78Å; M911-V915 WeakPolarHBondContact O-CB 3.45Å; M911-V915 VanDerWaalsContact O-CG2 3.3Å; M911-V915 WeakPolarHBondContact O-CG2 3.31Å; M911-V915 PolarHBondContact O-N 2.87Å; V915-L918 PolarHBondContact O-N 2.91Å; V915-L919 WeakPolarHBondContact O-CB 3.36Å; V915-L919 PolarHBondContact O-N 2.89Å; V915-V949 HydrophobicContact CG1-CG1 3.81Å
916	K	87.4	Confident	84.1	Confident	59 Å²	59	40.1 Å²	40.1	26%	0.257	23%	0.225	S	C	.	.	H	α-helix	trans	-64.4	-38.4	173.3	-172.6	-174	-169.6	-171	0	112.1	V912 S913 D914 S920 L953 V965 I966	V912-K916 WeakPolarHBondContact O-CB 3.38Å; V912-K916 PolarHBondContact O-N 3.18Å; S913-K916 PolarHBondContact O-N 3.48Å; D914-K916 VanDerWaalsContact C-N 3.32Å; D914-K916 PolarHBondContact O-N 3.08Å; K916-S920 PolarHBondContact O-N 3.32Å; K916-S920 VanDerWaalsContact O-N 3.16Å; K916-L953 HydrophobicContact CG-CD2 4.18Å; K916-V965 PolarHBondContact NZ-O 3.39Å; K916-I966 WeakPolarHBondContact CE-O 3.3Å; K916-I966 PolarHBondContact NZ-O 2.95Å
917	A	85.5	Confident	84.2	Confident	40 Å²	40	40.7 Å²	40.7	33%	0.331	24%	0.235	S	C	.	.	H	α-helix	trans	-63.2	-49	172.9	0	0	0	0	0	110.8	S913 D914 L919 S920 E921	S913-A917 PolarHBondContact O-N 3.13Å; D914-A917 WeakPolarHBondContact O-CB 3.45Å; D914-A917 PolarHBondContact O-N 3.41Å; D914-A917 VanDerWaalsContact O-N 3.16Å; A917-L919 VanDerWaalsContact C-N 3.34Å; A917-L919 PolarHBondContact O-N 2.9Å; A917-S920 PolarHBondContact O-N 3.26Å; A917-S920 VanDerWaalsContact O-N 3.12Å; A917-S920 PolarHBondContact O-OG 3.25Å; A917-E921 PolarHBondContact O-N 2.89Å
918	L	89.3	Confident	83.9	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-57.1	-42.8	177	176.8	61.6	0	0	0	113	I864 I867 A884 V885 D914 V915 T922	I864-L918 HydrophobicContact CD1-CD2 4.03Å; I864-L918 HydrophobicContact CG1-CD2 3.59Å; I867-L918 HydrophobicContact CD1-CD1 3.95Å; I867-L918 HydrophobicContact CD1-CG 4.38Å; A884-L918 HydrophobicContact CB-CB 4.13Å; A884-L918 HydrophobicContact CB-CD1 3.89Å; V885-L918 HydrophobicContact CG2-CD1 3.63Å; V885-L918 HydrophobicContact CG2-CD2 4.46Å; D914-L918 PolarHBondContact O-N 2.98Å; V915-L918 PolarHBondContact O-N 2.91Å; L918-T922 WeakPolarHBondContact O-CB 3.45Å; L918-T922 PolarHBondContact O-N 3.45Å; L918-T922 PolarHBondContact O-OG1 3Å
919	L	86.8	Confident	82.7	Confident	13 Å²	13	50.1 Å²	50.1	7%	0.068	28%	0.284	C	S	.	.	H	α-helix	trans	-55.1	-54.6	173.4	-178.4	73	0	0	0	110	V915 A917 E921 T922 E923 L946 V949 A950 L953	V915-L919 WeakPolarHBondContact O-CB 3.36Å; V915-L919 PolarHBondContact O-N 2.89Å; A917-L919 VanDerWaalsContact C-N 3.34Å; A917-L919 PolarHBondContact O-N 2.9Å; L919-E921 PolarHBondContact O-N 3.39Å; L919-T922 PolarHBondContact O-N 3.48Å; L919-E923 WeakPolarHBondContact O-CG 3.43Å; L919-E923 PolarHBondContact O-N 3.09Å; L919-L946 HydrophobicContact CD1-CB 4.33Å; L919-L946 HydrophobicContact CD1-CD2 3.71Å; L919-V949 HydrophobicContact CD1-CB 4.28Å; L919-V949 HydrophobicContact CD1-CG1 4.16Å; L919-A950 HydrophobicContact CD1-CB 4.4Å; L919-A950 HydrophobicContact CD2-CB 4.24Å; L919-L953 HydrophobicContact CD2-CD2 4.15Å
920	S	86	Confident	81.7	Confident	53 Å²	53	49.6 Å²	49.6	37%	0.371	28%	0.28	S	S	.	.	H	α-helix	trans	-65.7	-35.8	-176.7	73	0	0	0	0	114.2	K916 A917 L924	K916-S920 PolarHBondContact O-N 3.32Å; K916-S920 VanDerWaalsContact O-N 3.16Å; A917-S920 PolarHBondContact O-N 3.26Å; A917-S920 VanDerWaalsContact O-N 3.12Å; A917-S920 PolarHBondContact O-OG 3.25Å; S920-L924 WeakPolarHBondContact O-CB 3.28Å; S920-L924 WeakPolarHBondContact O-CD1 3.29Å; S920-L924 WeakPolarHBondContact O-CG 3.3Å; S920-L924 PolarHBondContact O-N 2.91Å
921	E	86.1	Confident	80.6	Confident	78 Å²	78	47 Å²	47	36%	0.364	28%	0.275	S	S	.	.	H	α-helix	trans	-70.4	-37.4	176.1	-71.5	-172.9	174.4	0	0	111.5	L881 A884 A917 L919 L924 L925	L881-E921 HydrophobicContact CD2-CB 3.77Å; A884-E921 VanDerWaalsContact CB-OE2 3.25Å; A884-E921 WeakPolarHBondContact CB-OE2 3.16Å; A917-E921 PolarHBondContact O-N 2.89Å; L919-E921 PolarHBondContact O-N 3.39Å; E921-L924 PolarHBondContact O-N 3.41Å; E921-L925 WeakPolarHBondContact O-CB 3.3Å; E921-L925 PolarHBondContact O-N 3.49Å
922	T	85.6	Confident	79.1	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-70.8	-41.8	177.8	-49.2	0	0	0	0	111.5	I867 L881 L918 L919 L925 L926 L942 L946	I867-T922 HydrophobicContact CD1-CG2 4.1Å; I867-T922 HydrophobicContact CG1-CG2 4.38Å; L881-T922 HydrophobicContact CD1-CG2 4.08Å; L918-T922 WeakPolarHBondContact O-CB 3.45Å; L918-T922 PolarHBondContact O-N 3.45Å; L918-T922 PolarHBondContact O-OG1 3Å; L919-T922 PolarHBondContact O-N 3.48Å; T922-L925 PolarHBondContact O-N 3.45Å; T922-L926 HydrophobicContact CG2-CD1 4.45Å; T922-L926 WeakPolarHBondContact O-CG 3.45Å; T922-L926 PolarHBondContact O-N 2.83Å; T922-L942 HydrophobicContact CG2-CD1 4.36Å; T922-L942 HydrophobicContact CG2-CD2 4.35Å; T922-L946 HydrophobicContact CG2-CD1 4.04Å; T922-L946 HydrophobicContact CG2-CD2 3.89Å; T922-L946 HydrophobicContact CG2-CG 4.44Å
923	E	85.8	Confident	77.9	Confident	95 Å²	95	61 Å²	61	44%	0.444	34%	0.342	S	S	.	.	H	α-helix	trans	-58.8	-45.6	171.8	-74.3	178.8	165.7	0	0	111.9	L919 L925 L926 A927	L919-E923 WeakPolarHBondContact O-CG 3.43Å; L919-E923 PolarHBondContact O-N 3.09Å; E923-L925 VanDerWaalsContact C-N 3.34Å; E923-L925 PolarHBondContact O-N 3.4Å; E923-L926 PolarHBondContact O-N 3.28Å; E923-A927 VanDerWaalsContact O-CB 3.29Å; E923-A927 WeakPolarHBondContact O-CB 3.35Å; E923-A927 PolarHBondContact O-N 3.4Å
924	L	83.3	Confident	77.4	Confident	124 Å²	124	59 Å²	59	65%	0.649	33%	0.327	S	S	*	.	H	α-helix	trans	-65.5	-34	176.7	-76.1	170.7	0	0	0	112.9	S920 E921 G928	S920-L924 WeakPolarHBondContact O-CB 3.28Å; S920-L924 WeakPolarHBondContact O-CD1 3.29Å; S920-L924 WeakPolarHBondContact O-CG 3.3Å; S920-L924 PolarHBondContact O-N 2.91Å; E921-L924 PolarHBondContact O-N 3.41Å; L924-G928 PolarHBondContact O-N 3.04Å
925	L	81.4	Confident	76.9	Confident	23 Å²	23	62.3 Å²	62.3	12%	0.12	35%	0.345	C	S	.	.	H	α-helix	trans	-68.4	-42.6	176.3	-173.8	69.4	0	0	0	111.6	M877 E880 L881 E921 T922 E923 G928 M930	M877-L925 HydrophobicContact CB-CD2 4.23Å; M877-L925 HydrophobicContact CE-CD2 4.23Å; M877-L925 HydrophobicContact CG-CD2 3.8Å; E880-L925 HydrophobicContact CB-CD1 4.37Å; E880-L925 HydrophobicContact CG-CD1 4.32Å; L881-L925 HydrophobicContact CD1-CD2 3.76Å; L881-L925 HydrophobicContact CD2-CD2 4.4Å; L881-L925 HydrophobicContact CG-CD2 3.91Å; E921-L925 WeakPolarHBondContact O-CB 3.3Å; E921-L925 PolarHBondContact O-N 3.49Å; T922-L925 PolarHBondContact O-N 3.45Å; E923-L925 VanDerWaalsContact C-N 3.34Å; E923-L925 PolarHBondContact O-N 3.4Å; L925-G928 PolarHBondContact O-N 2.86Å; L925-M930 HydrophobicContact CD1-CE 3.89Å; L925-M930 HydrophobicContact CD1-CG 3.71Å; L925-M930 HydrophobicContact CD2-CG 4.23Å; L925-M930 HydrophobicContact CG-CB 4.39Å; L925-M930 HydrophobicContact CG-CG 3.63Å
926	L	78.2	Confident	76.3	Confident	12 Å²	12	66.3 Å²	66.3	6%	0.063	37%	0.37	C	S	.	.	H	α-helix	trans	-69.2	-48.7	177.2	-72.2	174.1	0	0	0	112.1	T922 E923 G928 S931 L934 L942 L946	T922-L926 HydrophobicContact CG2-CD1 4.45Å; T922-L926 WeakPolarHBondContact O-CG 3.45Å; T922-L926 PolarHBondContact O-N 2.83Å; E923-L926 PolarHBondContact O-N 3.28Å; L926-G928 PolarHBondContact O-N 3.06Å; L926-G928 VanDerWaalsContact O-N 3.14Å; L926-S931 WeakPolarHBondContact O-CB 3.43Å; L926-S931 PolarHBondContact O-N 2.97Å; L926-L934 HydrophobicContact CD2-CD1 3.55Å; L926-L942 HydrophobicContact CD1-CD2 4.16Å; L926-L942 HydrophobicContact CD1-CG 4.29Å; L926-L942 HydrophobicContact CD2-CD2 4.21Å; L926-L946 HydrophobicContact CD1-CD1 3.38Å
927	A	76.7	Confident	75.8	Confident	91 Å²	91	67.9 Å²	67.9	75%	0.752	39%	0.387	S	S	*	.	H	α-helix	trans	-63.4	-15.9	172.9	0	0	0	0	0	113.1	E923	E923-A927 VanDerWaalsContact O-CB 3.29Å; E923-A927 WeakPolarHBondContact O-CB 3.35Å; E923-A927 PolarHBondContact O-N 3.4Å
928	G	72.4	Confident	75.3	Confident	42 Å²	42	67.9 Å²	67.9	43%	0.433	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-137	171	0	0	0	0	0	113.4	L924 L925 L926	L924-G928 PolarHBondContact O-N 3.04Å; L925-G928 PolarHBondContact O-N 2.86Å; L926-G928 PolarHBondContact O-N 3.06Å; L926-G928 VanDerWaalsContact O-N 3.14Å
929	K	58.3	Low	74.8	Confident	178 Å²	178	69.6 Å²	69.6	77%	0.774	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-13.5	-171.4	-68.9	-176.8	177.7	-179.4	0	114.6
930	M	60.4	Low	74.6	Confident	26 Å²	26	74.1 Å²	74.1	13%	0.128	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-81.5	-20.8	-169.9	-55.7	-48.3	-177.8	0	0	113.6	L925 M932 Q933 L934	L925-M930 HydrophobicContact CD1-CE 3.89Å; L925-M930 HydrophobicContact CD1-CG 3.71Å; L925-M930 HydrophobicContact CD2-CG 4.23Å; L925-M930 HydrophobicContact CG-CB 4.39Å; L925-M930 HydrophobicContact CG-CG 3.63Å; M930-M932 PolarHBondContact O-N 3.37Å; M930-Q933 PolarHBondContact O-N 3.31Å; M930-L934 PolarHBondContact O-N 2.83Å
931	S	58.2	Low	74.4	Confident	59 Å²	59	76.3 Å²	76.3	41%	0.413	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-63.6	-1.5	171.5	-174.6	0	0	0	0	114.5	L926 Q939	L926-S931 WeakPolarHBondContact O-CB 3.43Å; L926-S931 PolarHBondContact O-N 2.97Å; S931-Q939 PolarHBondContact OG-NE2 3.02Å
932	M	55	Low	74.4	Confident	181 Å²	181	72.6 Å²	72.6	89%	0.892	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-115.8	13	170.1	-58	-160	78.9	0	0	113.6	M930	M930-M932 PolarHBondContact O-N 3.37Å
933	Q	63.2	Low	74.4	Confident	114 Å²	114	76 Å²	76	53%	0.533	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.8	-13.1	-175.2	-63.2	-164.1	-25.5	0	0	114.9	H874 M930	H874-Q933 PolarHBondContact CE1-O 3.03Å; M930-Q933 PolarHBondContact O-N 3.31Å
934	L	72.9	Confident	74.4	Confident	16 Å²	16	74.5 Å²	74.5	8%	0.084	42%	0.422	C	S	.	.	S	Bend	trans	-90.3	147.6	177.3	-64	173.2	0	0	0	111.1	V870 M877 L926 M930 Q939	V870-L934 HydrophobicContact CG1-CD2 3.42Å; V870-L934 VanDerWaalsContact CG1-CD2 3.42Å; M877-L934 HydrophobicContact CE-CD1 4.15Å; M877-L934 HydrophobicContact CE-CD2 4.15Å; L926-L934 HydrophobicContact CD2-CD1 3.55Å; M930-L934 PolarHBondContact O-N 2.83Å; L934-Q939 HydrophobicContact CB-CB 4.15Å; L934-Q939 HydrophobicContact CD1-CB 4.42Å
935	D	75.8	Confident	74.7	Confident	104 Å²	104	69.3 Å²	69.3	56%	0.556	40%	0.396	S	S	*	.			trans	-71.1	139.2	168.7	-85.8	-34.8	0	0	0	110.2	Q938 Q939	D935-Q938 WeakPolarHBondContact O-CB 3.41Å; D935-Q938 PolarHBondContact O-N 2.87Å; D935-Q939 PolarHBondContact O-N 3.17Å
936	P	73.8	Confident	74.9	Confident	84 Å²	84	68.7 Å²	68.7	55%	0.545	39%	0.393	S	S	.	.	H	α-helix	trans	-47	-48.8	-176.5	-29.5	34.7	0	0	0	116.2	Q938 Q939 D940	P936-Q938 VanDerWaalsContact C-N 3.28Å; P936-Q938 PolarHBondContact O-N 3.14Å; P936-Q939 PolarHBondContact O-N 2.9Å; P936-D940 WeakPolarHBondContact O-CB 3.33Å; P936-D940 PolarHBondContact O-N 3.03Å
937	P	76.4	Confident	75.3	Confident	93 Å²	93	70 Å²	70	60%	0.604	41%	0.409	S	S	*	.	H	α-helix	trans	-64	-29.9	179.4	25.5	-35.9	0	0	0	113.8	Q941	P937-Q941 VanDerWaalsContact O-CB 3.31Å; P937-Q941 WeakPolarHBondContact O-CB 3.47Å; P937-Q941 PolarHBondContact O-N 2.79Å
938	Q	75.4	Confident	75.9	Confident	40 Å²	40	68 Å²	68	19%	0.187	39%	0.39	C	S	.	.	H	α-helix	trans	-74.8	-39.4	175.4	-66.6	-179.2	-20.7	0	0	111.1	V870 D935 P936 Q941 L942	V870-Q938 HydrophobicContact CG2-CB 4.27Å; D935-Q938 WeakPolarHBondContact O-CB 3.41Å; D935-Q938 PolarHBondContact O-N 2.87Å; P936-Q938 VanDerWaalsContact C-N 3.28Å; P936-Q938 PolarHBondContact O-N 3.14Å; Q938-Q941 PolarHBondContact O-N 2.99Å; Q938-L942 WeakPolarHBondContact O-CB 3.44Å; Q938-L942 PolarHBondContact O-N 3.27Å
939	Q	79.8	Confident	76.7	Confident	36 Å²	36	66.1 Å²	66.1	17%	0.168	37%	0.37	C	S	.	.	H	α-helix	trans	-64.6	-42.1	175.2	-173.7	169.4	5.4	0	0	111.4	S931 L934 D935 P936 L942 N943	S931-Q939 PolarHBondContact OG-NE2 3.02Å; L934-Q939 HydrophobicContact CB-CB 4.15Å; L934-Q939 HydrophobicContact CD1-CB 4.42Å; D935-Q939 PolarHBondContact O-N 3.17Å; P936-Q939 PolarHBondContact O-N 2.9Å; Q939-L942 PolarHBondContact O-N 2.86Å; Q939-N943 VanDerWaalsContact O-CB 3.3Å; Q939-N943 WeakPolarHBondContact O-CB 3.42Å; Q939-N943 PolarHBondContact O-N 2.78Å; Q939-N943 PolarHBondContact O-ND2 2.79Å; Q939-N943 VanDerWaalsContact O-ND2 3.13Å
940	D	81.5	Confident	78	Confident	107 Å²	107	58.8 Å²	58.8	57%	0.572	34%	0.342	S	S	*	.	H	α-helix	trans	-66.5	-41.6	176.2	-71.2	-25.6	0	0	0	112.1	P936 N943 A944	P936-D940 WeakPolarHBondContact O-CB 3.33Å; P936-D940 PolarHBondContact O-N 3.03Å; D940-N943 PolarHBondContact O-N 3.15Å; D940-A944 WeakPolarHBondContact O-CB 3.42Å; D940-A944 PolarHBondContact O-N 3.47Å
941	Q	83.4	Confident	79.3	Confident	100 Å²	100	62.7 Å²	62.7	47%	0.467	36%	0.361	S	S	.	.	H	α-helix	trans	-60.6	-44.9	174.5	-177.5	-177.1	-12.4	0	0	111.8	P937 Q938 A944 A945	P937-Q941 VanDerWaalsContact O-CB 3.31Å; P937-Q941 WeakPolarHBondContact O-CB 3.47Å; P937-Q941 PolarHBondContact O-N 2.79Å; Q938-Q941 PolarHBondContact O-N 2.99Å; Q941-A944 PolarHBondContact O-N 2.79Å; Q941-A945 PolarHBondContact O-N 2.8Å; Q941-A945 VanDerWaalsContact O-N 3.08Å
942	L	84.9	Confident	80.6	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-69.4	-41.2	179.2	-177	57.2	0	0	0	111.8	L863 I867 M877 T922 L926 Q938 Q939 A944 A945 L946	L863-L942 HydrophobicContact CD1-CD1 3.69Å; I867-L942 HydrophobicContact CG1-CD1 3.75Å; M877-L942 HydrophobicContact CE-CD2 3.97Å; M877-L942 HydrophobicContact SD-CD2 4.41Å; T922-L942 HydrophobicContact CG2-CD1 4.36Å; T922-L942 HydrophobicContact CG2-CD2 4.35Å; L926-L942 HydrophobicContact CD1-CD2 4.16Å; L926-L942 HydrophobicContact CD1-CG 4.29Å; L926-L942 HydrophobicContact CD2-CD2 4.21Å; Q938-L942 WeakPolarHBondContact O-CB 3.44Å; Q938-L942 PolarHBondContact O-N 3.27Å; Q939-L942 PolarHBondContact O-N 2.86Å; L942-A944 VanDerWaalsContact C-N 3.32Å; L942-A944 PolarHBondContact O-N 2.85Å; L942-A945 PolarHBondContact O-N 3.2Å; L942-L946 HydrophobicContact CG-CD1 4.35Å; L942-L946 VanDerWaalsContact O-CG 3.31Å; L942-L946 WeakPolarHBondContact O-CG 3.31Å; L942-L946 PolarHBondContact O-N 3.03Å
943	N	85.6	Confident	82.1	Confident	70 Å²	70	52.8 Å²	52.8	37%	0.374	31%	0.306	S	S	.	.	H	α-helix	trans	-60.9	-38.8	173	-76.7	-31.1	0	0	0	112.2	Q939 D940 L946 G947	Q939-N943 VanDerWaalsContact O-CB 3.3Å; Q939-N943 WeakPolarHBondContact O-CB 3.42Å; Q939-N943 PolarHBondContact O-N 2.78Å; Q939-N943 PolarHBondContact O-ND2 2.79Å; Q939-N943 VanDerWaalsContact O-ND2 3.13Å; D940-N943 PolarHBondContact O-N 3.15Å; N943-L946 PolarHBondContact O-N 2.67Å; N943-G947 PolarHBondContact O-N 3.09Å
944	A	86.9	Confident	83	Confident	65 Å²	65	55 Å²	55	54%	0.537	31%	0.309	S	S	.	.	H	α-helix	trans	-65.6	-40.9	175.7	0	0	0	0	0	112.1	D940 Q941 L942 G947 S948	D940-A944 WeakPolarHBondContact O-CB 3.42Å; D940-A944 PolarHBondContact O-N 3.47Å; Q941-A944 PolarHBondContact O-N 2.79Å; L942-A944 VanDerWaalsContact C-N 3.32Å; L942-A944 PolarHBondContact O-N 2.85Å; A944-G947 PolarHBondContact O-N 3.38Å; A944-S948 PolarHBondContact O-N 3.42Å
945	A	87.8	Confident	83.4	Confident	14 Å²	14	58.5 Å²	58.5	12%	0.116	32%	0.322	C	S	.	.	H	α-helix	trans	-65.1	-43	175.2	0	0	0	0	0	112.3	L863 Q941 L942 S948 V949	L863-A945 HydrophobicContact CB-CB 4.29Å; L863-A945 HydrophobicContact CD1-CB 4.05Å; Q941-A945 PolarHBondContact O-N 2.8Å; Q941-A945 VanDerWaalsContact O-N 3.08Å; L942-A945 PolarHBondContact O-N 3.2Å; A945-S948 PolarHBondContact O-N 3.45Å; A945-V949 PolarHBondContact O-N 2.83Å
946	L	87.3	Confident	83.7	Confident	10 Å²	10	53.6 Å²	53.6	5%	0.052	30%	0.295	C	S	.	.	H	α-helix	trans	-60.8	-46	173.5	-69.2	167.3	0	0	0	111.6	L863 L919 T922 L926 L942 N943 S948 V949 A950	L863-L946 HydrophobicContact CD1-CD2 3.57Å; L863-L946 HydrophobicContact CD1-CG 3.83Å; L863-L946 HydrophobicContact CD2-CD2 3.82Å; L863-L946 HydrophobicContact CG-CD2 4.36Å; L919-L946 HydrophobicContact CD1-CB 4.33Å; L919-L946 HydrophobicContact CD1-CD2 3.71Å; T922-L946 HydrophobicContact CG2-CD1 4.04Å; T922-L946 HydrophobicContact CG2-CD2 3.89Å; T922-L946 HydrophobicContact CG2-CG 4.44Å; L926-L946 HydrophobicContact CD1-CD1 3.38Å; L942-L946 HydrophobicContact CG-CD1 4.35Å; L942-L946 VanDerWaalsContact O-CG 3.31Å; L942-L946 WeakPolarHBondContact O-CG 3.31Å; L942-L946 PolarHBondContact O-N 3.03Å; N943-L946 PolarHBondContact O-N 2.67Å; L946-S948 VanDerWaalsContact C-N 3.29Å; L946-S948 PolarHBondContact O-N 3.24Å; L946-V949 PolarHBondContact O-N 2.76Å; L946-A950 VanDerWaalsContact O-CB 3.3Å; L946-A950 WeakPolarHBondContact O-CB 3.43Å; L946-A950 PolarHBondContact O-N 3.01Å
947	G	85.8	Confident	83.7	Confident	39 Å²	39	50.9 Å²	50.9	40%	0.402	28%	0.278	S	S	.	.	H	α-helix	trans	-60.2	-36.9	176.8	0	0	0	0	0	113.2	N943 A944 Q951	N943-G947 PolarHBondContact O-N 3.09Å; A944-G947 PolarHBondContact O-N 3.38Å; G947-Q951 WeakPolarHBondContact O-CB 3Å; G947-Q951 PolarHBondContact O-N 3.45Å
948	S	89.4	Confident	83.5	Confident	51 Å²	51	52.9 Å²	52.9	36%	0.357	28%	0.284	S	S	.	.	H	α-helix	trans	-66.2	-49.6	173.7	178.4	0	0	0	0	111.9	A944 A945 L946 A950 Q951 E952	A944-S948 PolarHBondContact O-N 3.42Å; A945-S948 PolarHBondContact O-N 3.45Å; L946-S948 VanDerWaalsContact C-N 3.29Å; L946-S948 PolarHBondContact O-N 3.24Å; S948-A950 VanDerWaalsContact C-N 3.32Å; S948-A950 PolarHBondContact O-N 3.14Å; S948-Q951 WeakPolarHBondContact O-CB 3.49Å; S948-Q951 PolarHBondContact O-N 2.93Å; S948-E952 PolarHBondContact O-N 3.24Å
949	V	88.9	Confident	83.6	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.006	28%	0.277	C	S	.	.	H	α-helix	trans	-61.3	-41.5	176.5	174.7	0	0	0	0	111.4	F856 A859 L863 V915 L919 A945 L946 Q951 E952 L953	F856-V949 HydrophobicContact CE2-CG1 4.22Å; A859-V949 VanDerWaalsContact C-CG2 3.45Å; A859-V949 HydrophobicContact CB-CG2 3.91Å; A859-V949 WeakPolarHBondContact O-CG2 3.25Å; L863-V949 HydrophobicContact CB-CG2 3.93Å; L863-V949 HydrophobicContact CD2-CB 4.39Å; L863-V949 HydrophobicContact CD2-CG2 3.95Å; V915-V949 HydrophobicContact CG1-CG1 3.81Å; L919-V949 HydrophobicContact CD1-CB 4.28Å; L919-V949 HydrophobicContact CD1-CG1 4.16Å; A945-V949 PolarHBondContact O-N 2.83Å; L946-V949 PolarHBondContact O-N 2.76Å; V949-Q951 VanDerWaalsContact C-N 3.26Å; V949-Q951 PolarHBondContact O-N 3.06Å; V949-E952 PolarHBondContact O-N 2.95Å; V949-L953 VanDerWaalsContact O-CB 3.3Å; V949-L953 WeakPolarHBondContact O-CB 3.37Å; V949-L953 PolarHBondContact O-N 3.35Å
950	A	86.6	Confident	83.1	Confident	24 Å²	24	54.8 Å²	54.8	20%	0.198	30%	0.303	C	S	.	.	H	α-helix	trans	-70.5	-17.6	176	0	0	0	0	0	113.6	L919 L946 S948 R954	L919-A950 HydrophobicContact CD1-CB 4.4Å; L919-A950 HydrophobicContact CD2-CB 4.24Å; L946-A950 VanDerWaalsContact O-CB 3.3Å; L946-A950 WeakPolarHBondContact O-CB 3.43Å; L946-A950 PolarHBondContact O-N 3.01Å; S948-A950 VanDerWaalsContact C-N 3.32Å; S948-A950 PolarHBondContact O-N 3.14Å; A950-R954 PolarHBondContact O-NE 2.96Å; A950-R954 PolarHBondContact O-NH2 2.7Å
951	Q	87.1	Confident	82.8	Confident	109 Å²	109	51.1 Å²	51.1	51%	0.509	28%	0.281	S	S	.	.	H	α-helix	trans	-80.5	-47.8	169.7	178.4	175.3	-48.9	0	0	111	G947 S948 V949 L953 R954 R955	G947-Q951 WeakPolarHBondContact O-CB 3Å; G947-Q951 PolarHBondContact O-N 3.45Å; S948-Q951 WeakPolarHBondContact O-CB 3.49Å; S948-Q951 PolarHBondContact O-N 2.93Å; V949-Q951 VanDerWaalsContact C-N 3.26Å; V949-Q951 PolarHBondContact O-N 3.06Å; Q951-L953 VanDerWaalsContact C-N 3.35Å; Q951-L953 PolarHBondContact O-N 2.69Å; Q951-R954 WeakPolarHBondContact O-CB 3.31Å; Q951-R954 PolarHBondContact O-N 2.92Å; Q951-R954 VanDerWaalsContact O-N 3.08Å; Q951-R955 PolarHBondContact O-N 3.37Å
952	E	86.4	Confident	82.3	Confident	16 Å²	16	46.4 Å²	46.4	8%	0.075	26%	0.259	C	S	.	.	H	α-helix	trans	-67.9	-33.8	-179.8	-63.8	-49.3	126.4	0	0	112.6	F856 A859 S948 V949 R954 R955 L956	F856-E952 HydrophobicContact CB-CB 4.2Å; F856-E952 HydrophobicContact CD2-CB 3.94Å; A859-E952 HydrophobicContact CB-CG 4.22Å; S948-E952 PolarHBondContact O-N 3.24Å; V949-E952 PolarHBondContact O-N 2.95Å; E952-R954 PolarHBondContact O-N 3.36Å; E952-R955 PolarHBondContact O-N 3.03Å; E952-R955 IonicContact OE1-CZ 2.71Å; E952-R955 IonicContact OE1-NH1 3.5Å; E952-R955 PolarHBondContact OE1-NH1 3.38Å; E952-R955 WeakPolarHBondContact OE2-CD 3.36Å; E952-R955 IonicContact OE2-CZ 3.81Å; E952-R955 IonicContact OE2-NE 3.45Å; E952-R955 IonicContact OE2-NH1 2.75Å; E952-R955 PolarHBondContact OE2-NH1 3.26Å; E952-L956 PolarHBondContact O-N 3.08Å
953	L	85.1	Confident	81.5	Confident	15 Å²	15	49 Å²	49	8%	0.079	28%	0.276	C	S	.	.	H	α-helix	trans	-59.7	-31.8	171.2	-170.5	64.6	0	0	0	112.4	F856 V912 K916 L919 V949 Q951 L956 S957 I966	F856-L953 HydrophobicContact CE2-CB 4.04Å; F856-L953 HydrophobicContact CE2-CD1 3.91Å; F856-L953 HydrophobicContact CZ-CD1 4.2Å; V912-L953 HydrophobicContact CG1-CD1 3.92Å; K916-L953 HydrophobicContact CG-CD2 4.18Å; L919-L953 HydrophobicContact CD2-CD2 4.15Å; V949-L953 VanDerWaalsContact O-CB 3.3Å; V949-L953 WeakPolarHBondContact O-CB 3.37Å; V949-L953 PolarHBondContact O-N 3.35Å; Q951-L953 VanDerWaalsContact C-N 3.35Å; Q951-L953 PolarHBondContact O-N 2.69Å; L953-L956 PolarHBondContact O-N 3.46Å; L953-S957 PolarHBondContact O-N 3.01Å; L953-I966 HydrophobicContact CD1-CD1 4.24Å; L953-I966 HydrophobicContact CD1-CG1 3.97Å; L953-I966 HydrophobicContact CD1-CG2 4.34Å; L953-I966 HydrophobicContact CG-CG2 4.11Å
954	R	83.3	Confident	80.4	Confident	161 Å²	161	49 Å²	49	61%	0.608	28%	0.28	S	S	*	.	H	α-helix	trans	-83.5	-5.6	174.2	-75.8	178.6	-70.3	148.5	2.1	114.3	A950 Q951 E952 S957	A950-R954 PolarHBondContact O-NE 2.96Å; A950-R954 PolarHBondContact O-NH2 2.7Å; Q951-R954 WeakPolarHBondContact O-CB 3.31Å; Q951-R954 PolarHBondContact O-N 2.92Å; Q951-R954 VanDerWaalsContact O-N 3.08Å; E952-R954 PolarHBondContact O-N 3.36Å; R954-S957 VanDerWaalsContact C-OG 3.3Å; R954-S957 WeakPolarHBondContact CA-OG 3.48Å; R954-S957 PolarHBondContact O-OG 2.74Å
955	R	81.6	Confident	79.4	Confident	90 Å²	90	47.8 Å²	47.8	34%	0.34	27%	0.266	S	S	.	.	H	α-helix	trans	-92.1	-29.5	165.9	-68.3	174.2	60	-153.4	-4.6	111	L852 E855 Q951 E952 S957	L852-R955 VanDerWaalsContact CD2-NH2 3.3Å; E855-R955 IonicContact OE2-CZ 3.97Å; E855-R955 IonicContact OE2-NH1 2.83Å; E855-R955 PolarHBondContact OE2-NH1 2.71Å; E855-R955 IonicContact OE2-NH2 3.61Å; E855-R955 PolarHBondContact OE2-NH2 3.39Å; Q951-R955 PolarHBondContact O-N 3.37Å; E952-R955 PolarHBondContact O-N 3.03Å; E952-R955 IonicContact OE1-CZ 2.71Å; E952-R955 IonicContact OE1-NH1 3.5Å; E952-R955 PolarHBondContact OE1-NH1 3.38Å; E952-R955 WeakPolarHBondContact OE2-CD 3.36Å; E952-R955 IonicContact OE2-CZ 3.81Å; E952-R955 IonicContact OE2-NE 3.45Å; E952-R955 IonicContact OE2-NH1 2.75Å; E952-R955 PolarHBondContact OE2-NH1 3.26Å; R955-S957 VanDerWaalsContact C-N 3.33Å
956	L	81.2	Confident	78.4	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-73.4	-18.2	171.6	-68.2	-178.9	0	0	0	114	L852 V853 F856 V912 E952 L953 D958 V959 L962 I966	L852-L956 HydrophobicContact CB-CD2 3.91Å; V853-L956 HydrophobicContact CG2-CD2 4.29Å; F856-L956 HydrophobicContact CB-CD1 3.71Å; F856-L956 HydrophobicContact CB-CG 4.35Å; F856-L956 HydrophobicContact CD1-CD1 3.75Å; F856-L956 HydrophobicContact CD2-CD1 3.7Å; F856-L956 HydrophobicContact CE1-CD1 4.26Å; F856-L956 HydrophobicContact CE2-CD1 4.22Å; F856-L956 HydrophobicContact CG-CD1 3.43Å; F856-L956 VanDerWaalsContact CG-CD1 3.43Å; F856-L956 HydrophobicContact CG-CG 4.46Å; F856-L956 HydrophobicContact CZ-CD1 4.46Å; V912-L956 HydrophobicContact CG2-CD1 3.88Å; E952-L956 PolarHBondContact O-N 3.08Å; L953-L956 PolarHBondContact O-N 3.46Å; L956-D958 PolarHBondContact O-N 2.96Å; L956-V959 WeakPolarHBondContact O-CB 3.35Å; L956-V959 PolarHBondContact O-N 3.37Å; L956-V959 VanDerWaalsContact O-N 3.12Å; L956-L962 HydrophobicContact CB-CD1 4.31Å; L956-L962 HydrophobicContact CD2-CD1 4.08Å; L956-I966 HydrophobicContact CB-CD1 3.64Å; L956-I966 WeakPolarHBondContact O-CD1 3.46Å
957	S	74.1	Confident	77.1	Confident	28 Å²	28	52.5 Å²	52.5	20%	0.196	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-21.2	173.6	43.1	0	0	0	0	113.7	L953 R954 R955 V959 C963	L953-S957 PolarHBondContact O-N 3.01Å; R954-S957 VanDerWaalsContact C-OG 3.3Å; R954-S957 WeakPolarHBondContact CA-OG 3.48Å; R954-S957 PolarHBondContact O-OG 2.74Å; R955-S957 VanDerWaalsContact C-N 3.33Å; S957-V959 PolarHBondContact O-N 3.5Å; S957-C963 WeakPolarHBondContact O-CB 3.44Å
958	D	71.3	Confident	75.6	Confident	134 Å²	134	55.1 Å²	55.1	72%	0.717	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-13.4	173.9	-64.6	-32.7	0	0	0	112.4	L956 P960	L956-D958 PolarHBondContact O-N 2.96Å; D958-P960 WeakPolarHBondContact O-CD 3.35Å
959	V	77.7	Confident	73.2	Confident	9 Å²	9	59.9 Å²	59.9	6%	0.055	32%	0.32	C	S	.	.	S	Bend	trans	-83.2	112.4	177.2	178.2	0	0	0	0	109.8	E849 L852 L956 S957 W961 L962 C963	E849-V959 WeakPolarHBondContact OE1-CG1 3.43Å; L852-V959 HydrophobicContact CD1-CG2 4.38Å; L956-V959 WeakPolarHBondContact O-CB 3.35Å; L956-V959 PolarHBondContact O-N 3.37Å; L956-V959 VanDerWaalsContact O-N 3.12Å; S957-V959 PolarHBondContact O-N 3.5Å; V959-W961 VanDerWaalsContact C-N 3.25Å; V959-W961 HydrophobicContact CG1-CD2 4.1Å; V959-W961 HydrophobicContact CG1-CG 4.14Å; V959-W961 HydrophobicContact CG1-CZ2 4.09Å; V959-W961 PolarHBondContact O-N 3Å; V959-L962 HydrophobicContact CB-CB 4.16Å; V959-L962 HydrophobicContact CB-CD1 4.11Å; V959-L962 HydrophobicContact CB-CG 4.36Å; V959-L962 HydrophobicContact CG1-CB 4.22Å; V959-L962 HydrophobicContact CG1-CD1 3.99Å; V959-L962 HydrophobicContact CG1-CG 4.02Å; V959-L962 PolarHBondContact O-N 3.33Å; V959-C963 PolarHBondContact O-N 2.96Å
960	P	68.7	Low	70.5	Confident	108 Å²	108	67.1 Å²	67.1	70%	0.701	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-23.9	-165.6	-27.3	36.3	0	0	0	116	D958	D958-P960 WeakPolarHBondContact O-CD 3.35Å
961	W	75.4	Confident	67.9	Low	30 Å²	30	75.3 Å²	75.3	11%	0.114	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-11.4	178.6	58.9	-89.5	0	0	0	113.9	V845 E849 C905 V908 V909 V959	V845-W961 HydrophobicContact CG2-CH2 4.19Å; V845-W961 HydrophobicContact CG2-CZ2 4.1Å; E849-W961 PolarHBondContact OE1-NE1 3.25Å; C905-W961 HydrophobicContact CB-CE3 4.13Å; C905-W961 HydrophobicContact CB-CH2 3.98Å; C905-W961 HydrophobicContact CB-CZ3 3.74Å; V908-W961 HydrophobicContact CB-CH2 3.92Å; V908-W961 HydrophobicContact CB-CZ3 4.21Å; V908-W961 HydrophobicContact CG1-CH2 3.93Å; V908-W961 HydrophobicContact CG1-CZ3 4.37Å; V908-W961 HydrophobicContact CG2-CH2 4.41Å; V909-W961 HydrophobicContact CG2-CE3 4.2Å; V909-W961 HydrophobicContact CG2-CZ3 4.04Å; V959-W961 VanDerWaalsContact C-N 3.25Å; V959-W961 HydrophobicContact CG1-CD2 4.1Å; V959-W961 HydrophobicContact CG1-CG 4.14Å; V959-W961 HydrophobicContact CG1-CZ2 4.09Å; V959-W961 PolarHBondContact O-N 3Å
962	L	73.3	Confident	65.2	Low	0 Å²	0	78.8 Å²	78.8	0%	0	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-30.2	171.1	-69.9	175.8	0	0	0	112.4	V908 V909 V912 L956 V959 P964 V965 I966	V908-L962 HydrophobicContact CG1-CD1 4.33Å; V908-L962 HydrophobicContact CG1-CD2 4.32Å; V909-L962 HydrophobicContact CG2-CD2 4Å; V912-L962 HydrophobicContact CG2-CD2 4.36Å; L956-L962 HydrophobicContact CB-CD1 4.31Å; L956-L962 HydrophobicContact CD2-CD1 4.08Å; V959-L962 HydrophobicContact CB-CB 4.16Å; V959-L962 HydrophobicContact CB-CD1 4.11Å; V959-L962 HydrophobicContact CB-CG 4.36Å; V959-L962 HydrophobicContact CG1-CB 4.22Å; V959-L962 HydrophobicContact CG1-CD1 3.99Å; V959-L962 HydrophobicContact CG1-CG 4.02Å; V959-L962 PolarHBondContact O-N 3.33Å; L962-P964 VanDerWaalsContact C-CD 3.43Å; L962-P964 VanDerWaalsContact C-N 3.33Å; L962-P964 VanDerWaalsContact O-N 3.14Å; L962-V965 WeakPolarHBondContact O-CA 3.49Å; L962-V965 WeakPolarHBondContact O-CB 3.39Å; L962-V965 PolarHBondContact O-N 2.78Å; L962-I966 HydrophobicContact CB-CD1 4Å; L962-I966 PolarHBondContact O-N 2.99Å
963	C	67.6	Low	62.4	Low	54 Å²	54	81 Å²	81	37%	0.365	44%	0.436	S	S	.	.	H	α-helix	trans	-42	-47.3	178.2	177.1	0	0	0	0	114.4	S957 V959 V965 I966 D967	S957-C963 WeakPolarHBondContact O-CB 3.44Å; V959-C963 PolarHBondContact O-N 2.96Å; C963-V965 PolarHBondContact O-N 3.04Å; C963-V965 VanDerWaalsContact O-N 3.15Å; C963-I966 PolarHBondContact O-N 3.12Å; C963-D967 PolarHBondContact O-N 3.33Å
964	P	62.6	Low	60	Low	71 Å²	71	86.7 Å²	86.7	46%	0.461	47%	0.474	S	S	.	.	H	α-helix	trans	-65.5	-17.1	178.7	-21.4	34.5	0	0	0	115.6	L962	L962-P964 VanDerWaalsContact C-CD 3.43Å; L962-P964 VanDerWaalsContact C-N 3.33Å; L962-P964 VanDerWaalsContact O-N 3.14Å
965	V	66.8	Low	57.4	Low	39 Å²	39	87.1 Å²	87.1	24%	0.236	49%	0.487	C	S	.	.	H	α-helix	trans	-89	-26.4	176.1	-171.2	0	0	0	0	110.5	V909 K916 L962 C963	V909-V965 HydrophobicContact CG1-CG2 4.1Å; K916-V965 PolarHBondContact NZ-O 3.39Å; L962-V965 WeakPolarHBondContact O-CA 3.49Å; L962-V965 WeakPolarHBondContact O-CB 3.39Å; L962-V965 PolarHBondContact O-N 2.78Å; C963-V965 PolarHBondContact O-N 3.04Å; C963-V965 VanDerWaalsContact O-N 3.15Å
966	I	66.4	Low	54.8	Low	8 Å²	8	87.8 Å²	87.8	4%	0.041	51%	0.512	C	S	.	.	H	α-helix	trans	-88.3	-50.8	-174	-62.7	169.1	0	0	0	110.8	V912 K916 L953 L956 L962 C963 P968	V912-I966 HydrophobicContact CG1-CG1 4.23Å; K916-I966 WeakPolarHBondContact CE-O 3.3Å; K916-I966 PolarHBondContact NZ-O 2.95Å; L953-I966 HydrophobicContact CD1-CD1 4.24Å; L953-I966 HydrophobicContact CD1-CG1 3.97Å; L953-I966 HydrophobicContact CD1-CG2 4.34Å; L953-I966 HydrophobicContact CG-CG2 4.11Å; L956-I966 HydrophobicContact CB-CD1 3.64Å; L956-I966 WeakPolarHBondContact O-CD1 3.46Å; L962-I966 HydrophobicContact CB-CD1 4Å; L962-I966 PolarHBondContact O-N 2.99Å; C963-I966 PolarHBondContact O-N 3.12Å; I966-P968 WeakPolarHBondContact O-CD 3.37Å
967	D	60	Low	52.2	Low	115 Å²	115	95 Å²	95	62%	0.615	55%	0.551	S	S	*	*			trans	-121.6	89.6	178.1	-81.1	-49.5	0	0	0	112.7	C963 L969	C963-D967 PolarHBondContact O-N 3.33Å; D967-L969 VanDerWaalsContact C-N 3.3Å; D967-L969 PolarHBondContact O-N 3.19Å
968	P	55.4	Low	50.1	Low	95 Å²	95	103.7 Å²	103.7	62%	0.617	59%	0.585	S	S	*	*			trans	-88.1	38.9	-175.2	37	-37.8	0	0	0	114.1	I966	I966-P968 WeakPolarHBondContact O-CD 3.37Å
969	L	38.8	Very low	48	Very low	150 Å²	150	102.3 Å²	102.3	79%	0.785	59%	0.586	S	S	*	*			trans	-160.6	107.2	167.6	-149.3	76.9	0	0	0	114.2	D967	D967-L969 VanDerWaalsContact C-N 3.3Å; D967-L969 PolarHBondContact O-N 3.19Å
970	D	31.9	Very low	45.7	Very low	153 Å²	153	111.9 Å²	111.9	82%	0.818	63%	0.627	S	S	*	*			trans	-164.9	96.1	134	-124.7	-8.7	0	0	0	112.3
971	Q	32	Very low	44	Very low	197 Å²	197	118.6 Å²	118.6	92%	0.921	64%	0.638	S	S	*	*			trans	-155.5	56.4	165.1	-163.9	166.3	106.5	0	0	110.7	G973	Q971-G973 PolarHBondContact O-N 3.05Å
972	E	30.8	Very low	41.9	Very low	182 Å²	182	122.1 Å²	122.1	85%	0.85	67%	0.668	S	S	*	*			trans	-70.8	123.7	170.8	-73.4	-149.4	139.4	0	0	111.7
973	G	27.5	Very low	39.8	Very low	61 Å²	61	131.4 Å²	131.4	63%	0.629	71%	0.711	S	S	*	*			trans	-103.3	136.6	157.2	0	0	0	0	0	109.3	Q971 L975	Q971-G973 PolarHBondContact O-N 3.05Å; G973-L975 PolarHBondContact O-N 3.18Å; G973-L975 VanDerWaalsContact O-N 3.1Å
974	P	34.5	Very low	38.1	Very low	136 Å²	136	134.9 Å²	134.9	88%	0.883	74%	0.736	S	S	*	*			trans	-74.6	105.5	-165.3	28.3	-35.6	0	0	0	113.4
975	L	27.3	Very low	36.5	Very low	169 Å²	169	134.6 Å²	134.6	89%	0.885	75%	0.746	S	S	*	*			trans	-141.4	74.6	164.6	-103.9	174.2	0	0	0	111	G973 D977	G973-L975 PolarHBondContact O-N 3.18Å; G973-L975 VanDerWaalsContact O-N 3.1Å; L975-D977 PolarHBondContact O-N 2.97Å; L975-D977 VanDerWaalsContact O-N 3.17Å
976	A	27.4	Very low	34.7	Very low	105 Å²	105	142.5 Å²	142.5	87%	0.868	78%	0.777	S	S	*	*			trans	-79.6	92.4	177.1	0	0	0	0	0	111.9
977	D	27.2	Very low	32.7	Very low	152 Å²	152	151.7 Å²	151.7	81%	0.813	82%	0.817	S	S	*	*			trans	-166.4	150.9	131.2	-123.2	-30.8	0	0	0	112.5	L975	L975-D977 PolarHBondContact O-N 2.97Å; L975-D977 VanDerWaalsContact O-N 3.17Å
978	F	30.2	Very low	31.1	Very low	209 Å²	209	157.1 Å²	157.1	92%	0.917	83%	0.829	S	S	*	*			trans	103.3	43.9	-177.7	-65.6	-66	0	0	0	119.5
979	S	26.9	Very low	29.7	Very low	105 Å²	105	160.9 Å²	160.9	73%	0.734	84%	0.843	S	S	*	*			trans	-121.2	72.9	167.2	-163	0	0	0	0	114.3
980	K	30	Very low	29.1	Very low	210 Å²	210	159.5 Å²	159.5	91%	0.913	84%	0.841	S	S	*	*	S	Bend	trans	-144.1	37.8	168.2	-74.1	-163.4	177.5	176.4	0	114.4
981	R	31.3	Very low	28.7	Very low	249 Å²	249	156.5 Å²	156.5	94%	0.94	83%	0.832	S	S	*	*	S	Bend	trans	-154.9	38.7	173.6	-137.9	174.3	-172	174	3.1	118.5
982	S	31.7	Very low	28.5	Very low	104 Å²	104	156.7 Å²	156.7	73%	0.727	83%	0.829	S	S	*	*			trans	-141.6	24.8	-177.6	50	0	0	0	0	116.4
983	Q	29.3	Very low	28.2	Very low	196 Å²	196	157.1 Å²	157.1	92%	0.916	83%	0.829	S	S	*	*			trans	-124.1	71.8	173.8	-75.1	-166.9	-9.4	0	0	113.7
984	S	31.1	Very low	28.4	Very low	126 Å²	126	163.6 Å²	163.6	88%	0.881	84%	0.84	S	S	*	*			trans	-159.3	54.7	164.8	50.9	0	0	0	0	112.6
985	G	29.3	Very low	28	Very low	66 Å²	66	166.6 Å²	166.6	68%	0.68	84%	0.839	S	S	*	*			trans	-121.3	11	-174.1	0	0	0	0	0	116.9	F987	G985-F987 PolarHBondContact O-N 3.21Å
986	K	29.4	Very low	27.9	Very low	204 Å²	204	165.5 Å²	165.5	89%	0.887	83%	0.834	S	S	*	*			trans	-71.4	112.5	179.6	-73.1	-163.3	173.2	-168.3	0	110.8	R988	K986-R988 PolarHBondContact O-N 3.29Å
987	F	24.9	Very low	27.9	Very low	201 Å²	201	170.8 Å²	170.8	88%	0.882	84%	0.837	S	S	*	*			trans	-59.1	126.5	172.1	-83.7	-103.2	0	0	0	110.1	G985	G985-F987 PolarHBondContact O-N 3.21Å
988	R	25.7	Very low	27.7	Very low	229 Å²	229	171.3 Å²	171.3	86%	0.864	84%	0.84	S	S	*	*			trans	-106.3	108.4	172.1	-162	178	-163.7	175.6	6.3	108.4	K986 V990	K986-R988 PolarHBondContact O-N 3.29Å; R988-V990 PolarHBondContact O-N 3.24Å
989	L	25.8	Very low	27.5	Very low	175 Å²	175	167.6 Å²	167.6	92%	0.916	83%	0.83	S	S	*	*			trans	-66	105.7	179.7	-169	70.5	0	0	0	109.6	S991	L989-S991 PolarHBondContact O-N 2.92Å
990	V	26.1	Very low	27.5	Very low	120 Å²	120	172.2 Å²	172.2	73%	0.727	84%	0.837	S	S	*	*			trans	-81.5	89.4	-176.6	-176.7	0	0	0	0	110.2	R988 K992	R988-V990 PolarHBondContact O-N 3.24Å; V990-K992 PolarHBondContact O-N 3.42Å
991	S	24.6	Very low	27.3	Very low	91 Å²	91	169 Å²	169	64%	0.636	83%	0.83	S	S	*	*			trans	-60.6	119.3	162.5	-178.9	0	0	0	0	109.7	L989 F993	L989-S991 PolarHBondContact O-N 2.92Å; S991-F993 PolarHBondContact O-N 3.17Å
992	K	26.9	Very low	27.1	Very low	200 Å²	200	166 Å²	166	87%	0.87	82%	0.823	S	S	*	*			trans	-83.6	92.7	177.4	-75.6	-177.7	178.2	174.6	0	110.4	V990	V990-K992 PolarHBondContact O-N 3.42Å
993	F	26.2	Very low	26.7	Very low	191 Å²	191	167.6 Å²	167.6	84%	0.838	82%	0.819	S	S	*	*			trans	-102.1	121.9	160.8	-97.5	-90.1	0	0	0	111.8	S991	S991-F993 PolarHBondContact O-N 3.17Å
994	K	30.1	Very low	26.5	Very low	198 Å²	198	165 Å²	165	86%	0.861	81%	0.809	S	S	*	*			trans	-74.3	125.4	176.2	-171.4	179.5	-178.8	-176.8	0	108.2
995	K	26.8	Very low	26.1	Very low	198 Å²	198	164.2 Å²	164.2	86%	0.861	80%	0.802	S	S	*	*			trans	-132.9	126.7	178.8	-171.2	168.2	-175.5	171.4	0	111
996	D	24.9	Very low	25.7	Very low	146 Å²	146	164.8 Å²	164.8	78%	0.781	80%	0.801	S	S	*	*			trans	-71.6	150.6	-172.8	-61	-73.2	0	0	0	113.9
997	K	27.1	Very low	25.4	Very low	217 Å²	217	161.1 Å²	161.1	94%	0.943	80%	0.795	S	S	*	*			trans	-98.8	90.5	-172.1	-168.1	-179.8	-172.7	-178.8	0	110.3
998	N	23.7	Very low	25.3	Very low	162 Å²	162	158.9 Å²	158.9	87%	0.866	79%	0.792	S	S	*	*			trans	-98.9	149.1	168.1	-161.9	2.1	0	0	0	111
999	N	26.7	Very low	25.2	Very low	131 Å²	131	153.5 Å²	153.5	70%	0.701	79%	0.789	S	S	*	*			trans	-113.7	137.2	-166	-165	18.6	0	0	0	111.3
1000	K	26.1	Very low	25.1	Very low	203 Å²	203	152.8 Å²	152.8	88%	0.883	79%	0.786	S	S	*	*			trans	-165.9	121.1	164.9	-114.5	163	-171.5	176.5	0	112.5
1001	N	26.4	Very low	25.3	Very low	143 Å²	143	153 Å²	153	77%	0.765	79%	0.789	S	S	*	*			trans	-76.2	157	170.1	-56	-10.5	0	0	0	110.7
1002	K	26	Very low	25.2	Very low	185 Å²	185	151.6 Å²	151.6	80%	0.804	79%	0.789	S	S	*	*				-159.2	156	109.9	-145.4	167.6	-177.4	-177.9	0	113.3
1003	E	23.4	Very low	25.8	Very low	138 Å²	138	147.7 Å²	147.7	65%	0.645	79%	0.785	S	S	*	*			trans	-78	179.9	172	-30.3	100	111.8	0	0	111.9
1004	M	25.3	Very low	25.8	Very low	140 Å²	140	149.7 Å²	149.7	69%	0.69	79%	0.786	S	S	*	*				168.2	125.9	103.2	-170.5	50.6	68.1	0	0	115.3
1005	C	22.6	Very low	25.6	Very low	111 Å²	111	143.9 Å²	143.9	75%	0.75	78%	0.783	S	S	*	*			trans	41	133	151.1	-86.7	0	0	0	0	126.8
1006	A	21.8	Very low	25.5	Very low	78 Å²	78	140.8 Å²	140.8	65%	0.645	78%	0.776	S	S	*	*				79.6	113.9	115.5	0	0	0	0	0	123.6
1007	T	21.8	Very low	25.6	Very low	126 Å²	126	143 Å²	143	77%	0.773	78%	0.781	S	S	*	*				38.6	117	113.8	-26.5	0	0	0	0	120.1
1008	L	24	Very low	25.5	Very low	155 Å²	155	135.6 Å²	135.6	81%	0.812	77%	0.767	S	S	*	*				178	156.1	107.2	-98.1	170.3	0	0	0	115.5
1009	S	22.3	Very low	25.5	Very low	116 Å²	116	139.7 Å²	139.7	81%	0.811	77%	0.77	S	S	*	*			trans	85.6	138	153.2	-62.5	0	0	0	0	122.4
1010	L	24.2	Very low	25.5	Very low	160 Å²	160	137.9 Å²	137.9	84%	0.838	76%	0.764	S	S	*	*			trans	-89.5	164.3	177.2	-105.3	153.4	0	0	0	110.8
1011	P	31	Very low	25.5	Very low	124 Å²	124	135.9 Å²	135.9	81%	0.805	76%	0.757	S	S	*	*				-139.4	174.5	65.5	33.3	-12.2	0	0	0	116.9
1012	G	22.3	Very low	25.5	Very low	62 Å²	62	136.9 Å²	136.9	64%	0.639	76%	0.757	S	S	*	*			trans	-90.8	-150.2	173.5	0	0	0	0	0	113.6
1013	P	39.1	Very low	25.4	Very low	118 Å²	118	132.4 Å²	132.4	77%	0.766	76%	0.755	S	S	*	*			cis	-143.8	164.8	31	42.4	-23.6	0	0	0	119.4
1014	R	26.1	Very low	25.7	Very low	232 Å²	232	132.9 Å²	132.9	88%	0.875	76%	0.762	S	S	*	*			trans	47.2	139	140.5	-66.4	176	-171.2	-119.8	5.5	123.9
1015	G	25.1	Very low	26.6	Very low	76 Å²	76	131.7 Å²	131.7	78%	0.784	77%	0.765	S	S	*	*				146.2	139.2	126.2	0	0	0	0	0	115.2
1016	D	26.6	Very low	26.8	Very low	133 Å²	133	131.1 Å²	131.1	71%	0.711	77%	0.768	S	S	*	*			cis	-162.5	-179.1	-44	-133.7	-51.2	0	0	0	108.3
1017	E	26.4	Very low	27	Very low	193 Å²	193	131.3 Å²	131.3	90%	0.902	78%	0.777	S	S	*	*			trans	68.7	141.8	173.1	-50	-176.8	178.4	0	0	117.1
1018	G	24.9	Very low	27.3	Very low	62 Å²	62	136.6 Å²	136.6	64%	0.639	78%	0.783	S	S	*	*			cis	-168.7	129.7	-11	0	0	0	0	0	108.7
1019	W	24.4	Very low	27.4	Very low	247 Å²	247	138.2 Å²	138.2	94%	0.936	79%	0.787	S	S	*	*				60.1	134.7	92.4	-75.2	53.8	0	0	0	115.4
1020	T	25.8	Very low	27.6	Very low	93 Å²	93	136.3 Å²	136.3	57%	0.571	79%	0.785	S	S	*	*			cis	-173.7	151.4	-7.2	21.9	0	0	0	0	110.3
1021	H	26	Very low	27.7	Very low	161 Å²	161	133 Å²	133	75%	0.745	78%	0.781	S	S	*	*			trans	65.9	157.6	147	-79.2	-127.6	0	0	0	119
1022	E	25.5	Very low	27.5	Very low	164 Å²	164	134.3 Å²	134.3	77%	0.766	78%	0.781	S	S	*	*			cis	-157.7	-176.5	-7.9	-136.9	175	124.6	0	0	112.3
1023	A	25.8	Very low	27.6	Very low	91 Å²	91	141 Å²	141	75%	0.752	80%	0.796	S	S	*	*			trans	80.5	101.6	150.7	0	0	0	0	0	121.8
1024	D	27.9	Very low	27	Very low	149 Å²	149	142.9 Å²	142.9	80%	0.797	79%	0.794	S	S	*	*			trans	-70.5	175.2	140.5	-126.4	-23.3	0	0	0	109.4
1025	P	44.8	Very low	26.9	Very low	114 Å²	114	138.2 Å²	138.2	74%	0.74	78%	0.783	S	S	*	*			cis	-150.3	169.9	37.8	43.8	-22.7	0	0	0	120.2
1026	A	27.8	Very low	27	Very low	99 Å²	99	141 Å²	141	82%	0.818	78%	0.775	S	S	*	*			trans	75	131.5	139.7	0	0	0	0	0	122.8
1027	G	24.7	Very low	26.9	Very low	82 Å²	82	144.1 Å²	144.1	85%	0.845	78%	0.777	S	S	*	*			trans	-175.6	124.9	162	0	0	0	0	0	112
1028	R	28.2	Very low	27	Very low	237 Å²	237	142.3 Å²	142.3	89%	0.894	77%	0.769	S	S	*	*			trans	-105.8	152.6	-175.4	-61.9	173.4	171.4	178.6	-4.5	112.6
1029	Q	26.5	Very low	27.1	Very low	189 Å²	189	150.9 Å²	150.9	88%	0.883	78%	0.782	S	S	*	*				142.5	146.4	123	-83.1	-179.8	-37.8	0	0	115.8
1030	G	25.6	Very low	27.2	Very low	76 Å²	76	142.8 Å²	142.8	78%	0.784	78%	0.775	S	S	*	*			trans	79.1	118.3	161	0	0	0	0	0	115.5
1031	A	27.2	Very low	27.1	Very low	90 Å²	90	147.1 Å²	147.1	74%	0.744	79%	0.793	S	S	*	*			cis	95.4	123.4	29.4	0	0	0	0	0	114.7
1032	D	26.5	Very low	27.1	Very low	152 Å²	152	143.7 Å²	143.7	81%	0.813	79%	0.793	S	S	*	*			trans	40.9	122.8	156.3	-45.9	-32	0	0	0	121.6
1033	E	25.5	Very low	27.1	Very low	202 Å²	202	140.6 Å²	140.6	94%	0.944	80%	0.796	S	S	*	*				-172.1	175.5	94.6	-111.7	-164.7	140.7	0	0	113.1
1034	E	25.4	Very low	27	Very low	158 Å²	158	142.8 Å²	142.8	74%	0.738	80%	0.804	S	S	*	*			trans	-114	166.1	-169.8	-151	-163.7	114	0	0	113.6
1035	Q	25	Very low	26.9	Very low	135 Å²	135	146.1 Å²	146.1	63%	0.631	81%	0.805	S	S	*	*			trans	80.4	119.9	156.4	-62.6	-163.6	20	0	0	123.1
1036	Q	26.2	Very low	26.1	Very low	135 Å²	135	146.7 Å²	146.7	63%	0.631	80%	0.802	S	S	*	*				90.7	135.7	128.6	-78	-172.6	53.7	0	0	123.4
1037	R	25.9	Very low	25.9	Very low	197 Å²	197	153.8 Å²	153.8	74%	0.743	81%	0.807	S	S	*	*			trans	80.2	96.7	142.6	-81	175.8	160.8	155.4	-3.1	122.2
1038	Q	26.9	Very low	25.9	Very low	155 Å²	155	154.5 Å²	154.5	72%	0.724	80%	0.798	S	S	*	*				52	120.7	108.3	-70.4	-178.6	-22	0	0	120.8
1039	R	27.5	Very low	26.4	Very low	243 Å²	243	149.4 Å²	149.4	92%	0.917	80%	0.796	S	S	*	*			trans	69.4	126.2	163.1	-52.3	172	-177.6	-178.5	1.2	114
1040	G	25.9	Very low	26.4	Very low	76 Å²	76	147.5 Å²	147.5	78%	0.784	79%	0.791	S	S	*	*			cis	115.7	113.1	6.3	0	0	0	0	0	111.2
1041	L	24.9	Very low	26.6	Very low	184 Å²	184	148.2 Å²	148.2	96%	0.963	78%	0.784	S	S	*	*			trans	-148.4	171.5	177.8	-113.8	167.7	0	0	0	111
1042	A	24.7	Very low	26.6	Very low	89 Å²	89	153 Å²	153	74%	0.736	78%	0.784	S	S	*	*			trans	-112.4	176.2	-154.2	0	0	0	0	0	115.3
1043	A	25.6	Very low	26.7	Very low	100 Å²	100	154.5 Å²	154.5	83%	0.826	78%	0.78	S	S	*	*			trans	84.9	112.7	155.3	0	0	0	0	0	118.8
1044	C	24.5	Very low	26.7	Very low	136 Å²	136	151.2 Å²	151.2	92%	0.919	77%	0.768	S	S	*	*			trans	-133	134.5	130.7	-153.6	0	0	0	0	110.1
1045	R	26.4	Very low	26.6	Very low	220 Å²	220	148.2 Å²	148.2	83%	0.83	76%	0.764	S	S	*	*			trans	-131.6	143.4	179.2	-112.4	-173.4	160.7	175.5	-4.6	103.1
1046	N	26.7	Very low	26.5	Very low	125 Å²	125	146.2 Å²	146.2	67%	0.668	76%	0.763	S	S	*	*			cis	-171.6	163.7	34.1	-86.5	-48.6	0	0	0	106.3
1047	R	24.8	Very low	26.5	Very low	248 Å²	248	147.4 Å²	147.4	94%	0.936	77%	0.773	S	S	*	*				177.2	150.6	107.2	-94.9	178.8	-170.6	-127.6	1.7	112.6
1048	C	25.2	Very low	26.3	Very low	97 Å²	97	143.3 Å²	143.3	66%	0.655	77%	0.774	S	S	*	*			trans	-100.3	171.6	174.7	-155.8	0	0	0	0	108.6
1049	P	38.4	Very low	26.4	Very low	131 Å²	131	143.1 Å²	143.1	85%	0.851	78%	0.778	S	S	*	*				-142.3	-168	88.7	38.8	-22.2	0	0	0	114.4
1050	L	26.3	Very low	26.7	Very low	149 Å²	149	137.5 Å²	137.5	78%	0.78	77%	0.773	S	S	*	*			trans	-139.1	173	-156.1	-140	148.5	0	0	0	111
1051	S	28.5	Very low	26.7	Very low	90 Å²	90	144.9 Å²	144.9	63%	0.629	78%	0.777	S	S	*	*			trans	88.8	157.6	162.6	87.4	0	0	0	0	117
1052	Y	28.8	Very low	27.3	Very low	192 Å²	192	141.9 Å²	141.9	75%	0.753	77%	0.769	S	S	*	*			cis	-163.9	160.5	13.5	-133.8	-34.7	0	0	0	113.2
1053	Y	27.3	Very low	27.2	Very low	183 Å²	183	142 Å²	142	72%	0.718	77%	0.769	S	S	*	*			trans	67.8	159	163.7	-78.8	-107.3	0	0	0	120
1054	L	25.3	Very low	27.3	Very low	132 Å²	132	147.5 Å²	147.5	69%	0.691	77%	0.769	S	S	*	*			cis	-168.1	149	-49	-137	151.8	0	0	0	112.4
1055	C	24.3	Very low	27.3	Very low	96 Å²	96	146.5 Å²	146.5	65%	0.649	75%	0.754	S	S	*	*			trans	99.2	142.1	143.6	-148.3	0	0	0	0	123.7
1056	C	23.5	Very low	27.3	Very low	92 Å²	92	142.7 Å²	142.7	62%	0.622	75%	0.745	S	S	*	*				94.2	104.8	129.4	-68.1	0	0	0	0	121.1
1057	L	25.2	Very low	27.3	Very low	161 Å²	161	147 Å²	147	84%	0.843	75%	0.752	S	S	*	*				64.4	151.8	128	-59.3	168.9	0	0	0	119.2
1058	S	22.5	Very low	27.3	Very low	110 Å²	110	141.5 Å²	141.5	77%	0.769	75%	0.746	S	S	*	*			cis	-154.6	176	9.3	-134.4	0	0	0	0	114.1
1059	L	29.1	Very low	27.5	Very low	151 Å²	151	148.1 Å²	148.1	79%	0.791	76%	0.758	S	S	*	*			trans	-77	161.6	171	-89.3	166.5	0	0	0	112.2
1060	P	32.7	Very low	27.4	Very low	125 Å²	125	148 Å²	148	81%	0.812	76%	0.756	S	S	*	*				-155.1	-176.1	74.3	41.7	-19.3	0	0	0	119.9
1061	R	26	Very low	27.3	Very low	232 Å²	232	144 Å²	144	88%	0.875	75%	0.752	S	S	*	*			trans	-83.8	176.5	170.7	-54.5	169.2	167.7	170.3	-4.5	110.9
1062	P	36.7	Very low	28.1	Very low	121 Å²	121	145.4 Å²	145.4	79%	0.786	76%	0.759	S	S	*	*			cis	-131.5	175.2	45.5	18.9	8.9	0	0	0	114.3
1063	A	23.5	Very low	28.2	Very low	90 Å²	90	144.6 Å²	144.6	74%	0.744	76%	0.762	S	S	*	*			cis	74.1	146.2	45.3	0	0	0	0	0	114.2
1064	R	26.9	Very low	28.8	Very low	217 Å²	217	141.7 Å²	141.7	82%	0.819	77%	0.765	S	S	*	*			cis	-172.3	150.6	2.4	-140.8	-175	-177.2	174.6	-0.3	111.3
1065	N	26.1	Very low	29	Very low	115 Å²	115	142.5 Å²	142.5	62%	0.615	77%	0.766	S	S	*	*			trans	63.3	166.9	152.5	-70.8	5.6	0	0	0	118.8
1066	H	26.5	Very low	29.9	Very low	139 Å²	139	143.7 Å²	143.7	64%	0.644	77%	0.772	S	S	*	*			cis	-163.9	146.4	-6.9	-117	-19.7	0	0	0	112.3
1067	R	25.6	Very low	30.2	Very low	216 Å²	216	142.6 Å²	142.6	82%	0.815	77%	0.769	S	S	*	*			trans	63.1	164.4	150.6	-61.7	-179.7	174.7	-174.1	-3.2	117.3
1068	T	25.6	Very low	30.6	Very low	133 Å²	133	141.9 Å²	141.9	82%	0.816	77%	0.766	S	S	*	*			cis	-151.4	169.7	-1.8	-9.7	0	0	0	0	112.4
1069	R	27.8	Very low	30.9	Very low	236 Å²	236	148.7 Å²	148.7	89%	0.891	77%	0.774	S	S	*	*			trans	-58.1	158.4	163.1	-89.2	-178	-178.7	-178.3	-0.2	112.7
1070	P	36.2	Very low	31	Very low	127 Å²	127	148.1 Å²	148.1	83%	0.825	77%	0.772	S	S	*	*				-144.2	-174	55.4	41.8	-22	0	0	0	117.6
1071	G	25.7	Very low	31	Very low	66 Å²	66	149.1 Å²	149.1	68%	0.68	78%	0.776	S	S	*	*			trans	-116.6	-147.8	162.2	0	0	0	0	0	110.2
1072	P	45.8	Very low	31.1	Very low	120 Å²	120	141.5 Å²	141.5	78%	0.779	77%	0.77	S	S	*	*			cis	-137.4	178.3	-0.1	43.5	-26.8	0	0	0	116.2
1073	E	29.6	Very low	31	Very low	175 Å²	175	144 Å²	144	82%	0.818	77%	0.771	S	S	*	*			trans	66.1	163	150.7	-105.8	173.7	-119.4	0	0	119.8
1074	P	40.9	Very low	31.5	Very low	121 Å²	121	145.8 Å²	145.8	79%	0.786	77%	0.768	S	S	*	*			cis	-135.8	177.1	46.9	43	-25.2	0	0	0	119.6
1075	E	28.9	Very low	31.8	Very low	150 Å²	150	141.7 Å²	141.7	70%	0.701	76%	0.762	S	S	*	*			trans	-37.4	166.5	168.5	-131.2	-159.3	-109.1	0	0	118.5	A1077	E1075-A1077 PolarHBondContact OE2-N 3.1Å
1076	P	43.2	Very low	32	Very low	121 Å²	121	143.8 Å²	143.8	79%	0.786	77%	0.772	S	S	*	*				-145.5	156.1	77.4	40.5	-23.6	0	0	0	118.3
1077	A	29.6	Very low	32.1	Very low	68 Å²	68	144.6 Å²	144.6	56%	0.562	78%	0.776	S	S	*	*			trans	-81.3	-169.7	160.2	0	0	0	0	0	111.7	E1075	E1075-A1077 PolarHBondContact OE2-N 3.1Å
1078	L	33.2	Very low	32.2	Very low	146 Å²	146	141.6 Å²	141.6	76%	0.764	77%	0.772	S	S	*	*			cis	-169.2	144.9	11.5	-150	170.9	0	0	0	109.2
1079	R	28.7	Very low	33	Very low	253 Å²	253	141 Å²	141	96%	0.955	77%	0.769	S	S	*	*			trans	-167.3	156.9	144.2	-111.2	170.1	-165.8	-136.8	0.5	113.7
1080	N	32.5	Very low	34.1	Very low	139 Å²	139	135.6 Å²	135.6	74%	0.743	77%	0.765	S	S	*	*			trans	-160.2	136.4	-159.8	-176.1	10.4	0	0	0	112.9
1081	T	32.3	Very low	33.7	Very low	146 Å²	146	133 Å²	133	90%	0.896	76%	0.761	S	S	*	*			trans	173.5	140.3	162.5	39.4	0	0	0	0	109.9
1082	G	28.1	Very low	33.9	Very low	72 Å²	72	135.7 Å²	135.7	74%	0.742	77%	0.77	S	S	*	*			cis	170.2	132.3	-11.8	0	0	0	0	0	115.2
1083	Q	35.3	Very low	33.1	Very low	175 Å²	175	137.4 Å²	137.4	82%	0.818	77%	0.772	S	S	*	*			trans	59.2	140.4	146.6	-85.8	-173.4	-1.4	0	0	126.5
1084	N	33.9	Very low	34.1	Very low	126 Å²	126	134 Å²	134	67%	0.674	77%	0.766	S	S	*	*			trans	77.9	150.7	144.1	-63.1	-10.5	0	0	0	120.2
1085	L	32.4	Very low	33.5	Very low	132 Å²	132	135.1 Å²	135.1	69%	0.691	76%	0.76	S	S	*	*			cis	-161.9	-175.7	-3.4	-120.8	170.3	0	0	0	112.7
1086	L	29.8	Very low	33.6	Very low	159 Å²	159	135.9 Å²	135.9	83%	0.832	76%	0.761	S	S	*	*			trans	84.4	135.5	175.4	-57.3	160	0	0	0	116.5
1087	Q	29.5	Very low	33	Very low	156 Å²	156	136 Å²	136	73%	0.729	76%	0.755	S	S	*	*			cis	124.4	117	-10.1	-81.3	-161.2	-74.4	0	0	117
1088	E	27.3	Very low	33.2	Very low	153 Å²	153	140.6 Å²	140.6	72%	0.715	77%	0.765	S	S	*	*			trans	63.5	163.4	147.6	-64.7	-68.9	125.8	0	0	119.9
1089	P	43.2	Very low	33.3	Very low	119 Å²	119	138.1 Å²	138.1	77%	0.773	76%	0.76	S	S	*	*			cis	-125.5	178.9	-4.9	31.7	-10.6	0	0	0	115.4
1090	P	49.9	Very low	34	Very low	124 Å²	124	133.3 Å²	133.3	81%	0.805	75%	0.754	S	S	*	*			trans	-108.8	177.4	-172.2	40.9	-35.8	0	0	0	116.8
1091	G	28.3	Very low	34.1	Very low	72 Å²	72	134.1 Å²	134.1	74%	0.742	76%	0.758	S	S	*	*			trans	-152	109	177.7	0	0	0	0	0	117.5
1092	S	28.6	Very low	35.6	Very low	122 Å²	122	136.2 Å²	136.2	85%	0.853	77%	0.774	S	S	*	*			trans	24.7	118.1	153	58.1	0	0	0	0	124.3
1093	N	29.4	Very low	36	Very low	156 Å²	156	139.5 Å²	139.5	83%	0.834	78%	0.776	S	S	*	*			trans	-50	-178.2	144.3	-113.6	-9	0	0	0	114.9
1094	P	51	Low	36	Very low	105 Å²	105	137.6 Å²	137.6	68%	0.682	77%	0.773	S	S	*	*			cis	-138.7	178.9	-4.3	38.9	-19.9	0	0	0	116.5
1095	E	29.1	Very low	36.1	Very low	144 Å²	144	138.2 Å²	138.2	67%	0.673	78%	0.779	S	S	*	*				168.5	124.2	121.2	-84.1	-143.9	116.7	0	0	110.9
1096	K	31	Very low	36.3	Very low	166 Å²	166	138.6 Å²	138.6	72%	0.722	78%	0.784	S	S	*	*				55.6	133.8	111.2	-65.2	-176.4	-167.1	144.8	0	116.2
1097	N	30.8	Very low	36.7	Very low	123 Å²	123	137.3 Å²	137.3	66%	0.658	78%	0.781	S	S	*	*			cis	-151.3	171.1	19	-112.1	-2.5	0	0	0	113.5
1098	Q	33.5	Very low	37.2	Very low	164 Å²	164	136.1 Å²	136.1	77%	0.766	79%	0.785	S	S	*	*			trans	-20.7	156.4	148	-64.7	155.5	-35.6	0	0	116.7
1099	S	34.3	Very low	37.9	Very low	94 Å²	94	134.9 Å²	134.9	66%	0.657	79%	0.789	S	S	*	*			cis	-174.3	-168.8	-8.6	53.5	0	0	0	0	107.5
1100	D	42.8	Very low	37.5	Very low	153 Å²	153	136.1 Å²	136.1	82%	0.818	79%	0.791	S	S	*	*			cis	-153.5	176.8	9.1	-103.5	-50.4	0	0	0	109.7
1101	D	36.4	Very low	36.5	Very low	155 Å²	155	137.1 Å²	137.1	83%	0.829	79%	0.79	S	S	*	*			trans	-73.8	172.5	170.4	-88.6	-31.4	0	0	0	113.5
1102	P	62.8	Low	37.3	Very low	191 Å²	191	143 Å²	143	100%	1.24	79%	0.794	S	S	*	*			cis	-131.8	0	13.3	43.8	-28	0	0	0	117.7

Retrieved 1,102 of 1,102 residues in 573.1 ms (Link to these results)

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