A0A087XJ18_POEFO Loading...

VPS39 subunit of HOPS complex

AlphaFold DB , UniProt , Accession A0A087XJ18, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 849 aa.

						>A0A087XJ18_POEFO|A0A087XJ18
MHDAYEPVPILEKLPLQIDCLAAWEDWLLVGTKPGHLLLYRIKKDAATNRFEVTLEKSNKNFSKKIQQLYVVSQYKILVSLLENNIHVHDLLTFQQITVVSKAKGATLFACDLQQTSSGEESLRMCVAVKRKLQLYYWKDREFHELQGDLGVPDVPKSMAWCENSICVGFKRDYYLIRLDGRGSIKELFPTGKQLEPLVAPLADGKVAVGQDDLTVVLNEEGVCTQKCALNWTDIPIAMEHQPPYIIAVLPRYVEIRTLEPRLLVQNVELQRPRFIASAGPNIVYVASNHFVWRLVPVSIASQIQQLLQDKQFELALQLAKMKDDSDGEKKQQIHHIQNLYAFNLFCQKKFDDSMQVFAKLGTDPTHVIGLYPDLLPSDYRKQLHYPNPLPGLSGAELEKAHLALIDYLTQKRSHLAKQLNDTGPSTTSPLMEGTPTIKSRKKLLQIIDTTLLKCYLHTNVALVSPLLRLENNHCHIEESEFVLKKTQKYSELIILYEKKGLHQKALMVLLDQSTKANSPLKGHERTVQYLQRLGSENLGIILEFSPWVLKICPEDGLKIFTEDLPEVETLPRDKVLQFLKEGFVELAIPVQGLMKQYLNSLPEGVPAVPAGQEQGELGEFRNKLLSFLDISTSYEPARLISDFPFDGLLEERALLLGRMGKHEQALFIYVHVLNDTRMAEEYCHRHYNSSMEGNKDVYLSLLRMYLSPPDAHCLGPIKMELTEPQANLQAALHVLELHHSKLNTTKAINLLPANTQIREIKVFLESVLEEKAQMKRCNQVLKSLLQAEFLRVQEERIFHQQVKCVITEEKTCRVCKKKIGNSAFARYPNGVVVHYFCCKDRSVCPTEQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	70.9	Confident	89.7	Confident	161 Å²	161	48.5 Å²	48.5	79%	0.793	26%	0.257	S	S	*	.				0	126.9	0	-77.9	-176.5	-73.6	0	0	105.3	L264 D310	M1-L264 HydrophobicContact SD-CD2 4.33Å; M1-D310 PolarHBondContact N-OD2 2.9Å
2	H	87	Confident	89.7	Confident	5 Å²	5	55 Å²	55	2%	0.023	29%	0.285	C	S	.	.			trans	-113.3	155.5	-178.9	72.9	-76.5	0	0	0	109.6	A4 Y245 V265 Q306 L307	H2-A4 PolarHBondContact O-N 3.38Å; H2-Y245 AromaticContact NE2-CZ 3.94Å; H2-Y245 PolarHBondContact NE2-OH 2.99Å; H2-V265 WeakPolarHBondContact CE1-CG1 3.33Å; H2-V265 VanDerWaalsContact O-O 3.14Å; H2-Q306 VanDerWaalsContact CA-OE1 3.29Å; H2-Q306 HydrophobicContact CB-CB 3.78Å; H2-Q306 VanDerWaalsContact CB-OE1 3.24Å; H2-L307 HydrophobicContact CB-CG 4.45Å; H2-L307 WeakPolarHBondContact ND1-CD2 3.43Å
3	D	89.9	Confident	89.4	Confident	81 Å²	81	63.7 Å²	63.7	43%	0.433	32%	0.32	S	S	.	.			trans	-84.7	112	179.6	-64.6	-52.4	0	0	0	109.8	Q266 V298 Q303	D3-Q266 PolarHBondContact OD1-NE2 2.81Å; D3-V298 HydrophobicContact CB-CG2 4.16Å; D3-V298 WeakPolarHBondContact O-CB 3.26Å; D3-V298 WeakPolarHBondContact O-CG2 3.24Å; D3-Q303 WeakPolarHBondContact O-CG 3.41Å
4	A	92	Very high	89.4	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.303	C	S	.	.			trans	-89.2	-35.6	175.5	0	0	0	0	0	111.8	H2 Y245 V265 P297 V298	H2-A4 PolarHBondContact O-N 3.38Å; A4-Y245 HydrophobicContact CB-CD2 4.33Å; A4-Y245 HydrophobicContact CB-CE1 4.27Å; A4-Y245 HydrophobicContact CB-CE2 3.87Å; A4-V265 HydrophobicContact CB-CG1 3.6Å; A4-P297 WeakPolarHBondContact O-CA 3.44Å; A4-V298 PolarHBondContact O-N 2.9Å
5	Y	93.8	Very high	89.3	Confident	5 Å²	5	64.1 Å²	64.1	2%	0.02	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	147.3	-177.4	-67.8	-92.8	0	0	0	112.2	Q242 Y245 I247 I256 Q266 L295 V296 P297	Y5-Q242 WeakPolarHBondContact OH-CB 3.2Å; Y5-Y245 AromaticContact CE2-CD2 3.86Å; Y5-Y245 HydrophobicContact CE2-CD2 3.86Å; Y5-Y245 HydrophobicContact CE2-CG 4.34Å; Y5-I247 HydrophobicContact CE2-CD1 3.98Å; Y5-I256 HydrophobicContact CD2-CD1 3.43Å; Y5-I256 VanDerWaalsContact CD2-CD1 3.43Å; Y5-I256 HydrophobicContact CD2-CG2 4.41Å; Y5-I256 HydrophobicContact CE2-CD1 4.24Å; Y5-I256 HydrophobicContact CE2-CG2 4.4Å; Y5-I256 HydrophobicContact CG-CD1 4.06Å; Y5-Q266 PolarHBondContact O-NE2 3.13Å; Y5-Q266 PolarHBondContact O-OE1 2.79Å; Y5-Q266 VanDerWaalsContact O-OE1 3.09Å; Y5-L295 HydrophobicContact CD1-CB 3.66Å; Y5-L295 HydrophobicContact CE1-CB 4.39Å; Y5-L295 HydrophobicContact CG-CB 4.08Å; Y5-V296 CarbonylContact C-O 3.54Å; Y5-V296 VanDerWaalsContact CA-O 3.29Å; Y5-V296 WeakPolarHBondContact CA-O 3.35Å; Y5-P297 HydrophobicContact CD1-CB 4.15Å; Y5-P297 HydrophobicContact CE1-CB 3.94Å
6	E	92.2	Very high	89.3	Confident	115 Å²	115	62.9 Å²	62.9	54%	0.537	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	121.4	169.7	-170.7	179.2	177.1	0	0	109.1	V8 V296	E6-V8 PolarHBondContact O-N 2.75Å; E6-V296 PolarHBondContact N-O 2.87Å; E6-V296 PolarHBondContact O-N 2.89Å
7	P	92.8	Very high	89.5	Confident	48 Å²	48	62.5 Å²	62.5	31%	0.312	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	117.8	177.7	31.6	-35.5	0	0	0	110.8	V268 L270 L295	P7-V268 HydrophobicContact CB-CG1 3.65Å; P7-V268 HydrophobicContact CG-CG1 3.57Å; P7-L270 HydrophobicContact CB-CD2 3.88Å; P7-L295 HydrophobicContact CB-CD2 4.16Å
8	V	92.5	Very high	89.7	Confident	28 Å²	28	59 Å²	59	17%	0.17	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	123	175.1	-174	0	0	0	0	109.6	E6 I10 F51 W293 R294 V296	E6-V8 PolarHBondContact O-N 2.75Å; V8-I10 PolarHBondContact O-N 3.37Å; V8-F51 HydrophobicContact CB-CD2 4.19Å; V8-F51 HydrophobicContact CB-CE2 4Å; V8-F51 HydrophobicContact CG1-CD2 3.7Å; V8-F51 HydrophobicContact CG1-CE2 3.95Å; V8-F51 HydrophobicContact CG2-CE2 4.18Å; V8-W293 CarbonylContact O-C 3.6Å; V8-W293 VanDerWaalsContact O-CA 3.3Å; V8-W293 WeakPolarHBondContact O-CA 3.43Å; V8-R294 PolarHBondContact N-O 3.37Å; V8-R294 PolarHBondContact O-N 2.98Å; V8-V296 HydrophobicContact CB-CG2 4.31Å; V8-V296 HydrophobicContact CG2-CB 4.5Å; V8-V296 HydrophobicContact CG2-CG2 3.73Å
9	P	91.8	Very high	89.8	Confident	59 Å²	59	57.2 Å²	57.2	38%	0.383	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	130.4	175.2	27.3	-32.9	0	0	0	110.3	E12	P9-E12 HydrophobicContact CB-CG 3.96Å
10	I	92.8	Very high	89.9	Confident	14 Å²	14	54.8 Å²	54.8	7%	0.072	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	-48.1	178.2	-59.7	-56.9	0	0	0	110	V8 I42 F51 V53 Y285 V292 R294	V8-I10 PolarHBondContact O-N 3.37Å; I10-I42 HydrophobicContact CD1-CG2 4.2Å; I10-I42 HydrophobicContact CG2-CD1 3.62Å; I10-I42 HydrophobicContact CG2-CG1 4.02Å; I10-F51 HydrophobicContact CD1-CB 3.72Å; I10-F51 HydrophobicContact CD1-CD2 3.58Å; I10-F51 HydrophobicContact CD1-CE2 4.38Å; I10-F51 HydrophobicContact CD1-CG 3.67Å; I10-V53 HydrophobicContact CG2-CG1 4.06Å; I10-V53 HydrophobicContact CG2-CG2 3.64Å; I10-Y285 HydrophobicContact CG1-CE1 4.25Å; I10-V292 PolarHBondContact N-O 3.18Å; I10-R294 HydrophobicContact CD1-CB 3.77Å; I10-R294 HydrophobicContact CG1-CB 3.6Å
11	L	91.3	Very high	90.1	Very high	17 Å²	17	53 Å²	53	9%	0.089	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	127.5	175.6	-61.3	176	0	0	0	108.8	L28 V30 Y40 V53 F291 V292	L11-L28 HydrophobicContact CD1-CD2 4.36Å; L11-V30 HydrophobicContact CD1-CG2 4.03Å; L11-Y40 HydrophobicContact CD1-CD2 3.93Å; L11-Y40 HydrophobicContact CD1-CE1 4.36Å; L11-Y40 HydrophobicContact CD1-CE2 3.63Å; L11-Y40 HydrophobicContact CD1-CG 4.4Å; L11-Y40 HydrophobicContact CD2-CD1 3.9Å; L11-Y40 HydrophobicContact CD2-CE1 3.58Å; L11-Y40 HydrophobicContact CD2-CE2 4.37Å; L11-Y40 HydrophobicContact CD2-CG 4.4Å; L11-V53 HydrophobicContact CD2-CG1 3.78Å; L11-F291 CarbonylContact O-C 3.6Å; L11-F291 VanDerWaalsContact O-CA 3.27Å; L11-F291 WeakPolarHBondContact O-CA 3.27Å; L11-V292 HydrophobicContact CB-CB 3.99Å; L11-V292 HydrophobicContact CB-CG2 4.1Å; L11-V292 HydrophobicContact CD1-CB 4.3Å; L11-V292 HydrophobicContact CD1-CG2 3.88Å; L11-V292 HydrophobicContact CG-CB 4.3Å; L11-V292 HydrophobicContact CG-CG2 4.37Å; L11-V292 PolarHBondContact N-O 2.81Å; L11-V292 PolarHBondContact O-N 2.7Å
12	E	89	Confident	91.2	Very high	127 Å²	127	45.7 Å²	45.7	59%	0.593	24%	0.24	S	C	*	.			trans	-119.1	136.2	178.1	-60.6	-170.2	134.1	0	0	110.3	P9 L14 F291	P9-E12 HydrophobicContact CB-CG 3.96Å; E12-L14 VanDerWaalsContact C-N 3.3Å; E12-L14 PolarHBondContact O-N 3.41Å; E12-F291 HydrophobicContact CB-CD1 4.11Å; E12-F291 HydrophobicContact CB-CE1 4.04Å; E12-F291 HydrophobicContact CG-CD1 4.25Å; E12-F291 HydrophobicContact CG-CE1 4.42Å
13	K	86	Confident	91.4	Very high	168 Å²	168	45.9 Å²	45.9	73%	0.73	24%	0.243	S	C	*	.	S	Bend	trans	54	43.2	173.7	-55.9	176.4	-178.2	173.4	0	113.5	H290 F291	K13-H290 PolarHBondContact N-O 3.44Å; K13-F291 HydrophobicContact CG-CE1 4.08Å; K13-F291 HydrophobicContact CG-CZ 3.9Å
14	L	89.5	Confident	91.5	Very high	16 Å²	16	42.7 Å²	42.7	8%	0.084	23%	0.225	C	C	.	.			trans	-58.6	124.9	175.2	-168.6	75.1	0	0	0	109.4	E12 L16 I18 V30 L38 Y40 H290	E12-L14 VanDerWaalsContact C-N 3.3Å; E12-L14 PolarHBondContact O-N 3.41Å; L14-L16 WeakPolarHBondContact CD2-O 3.18Å; L14-L16 PolarHBondContact O-N 2.97Å; L14-I18 HydrophobicContact CD2-CD1 4.09Å; L14-I18 HydrophobicContact CD2-CG1 3.75Å; L14-V30 HydrophobicContact CD2-CG1 4.14Å; L14-L38 HydrophobicContact CD1-CD1 4.23Å; L14-L38 HydrophobicContact CD2-CD1 4.29Å; L14-Y40 WeakPolarHBondContact CD1-OH 3.27Å; L14-H290 PolarHBondContact N-O 2.81Å; L14-H290 PolarHBondContact O-ND1 2.75Å
15	P	87.9	Confident	91.3	Very high	118 Å²	118	47.8 Å²	47.8	77%	0.766	25%	0.249	S	C	*	.	S	Bend	trans	-68.2	-24.9	-175.5	25.6	-34	0	0	0	112.6
16	L	89.8	Confident	91.1	Very high	45 Å²	45	50.8 Å²	50.8	24%	0.236	27%	0.265	C	S	.	.	S	Bend	trans	-91.9	134.8	177.6	-57.2	176	0	0	0	109.8	L14 I18 T32 P34 H36 L38	L14-L16 WeakPolarHBondContact CD2-O 3.18Å; L14-L16 PolarHBondContact O-N 2.97Å; L16-I18 PolarHBondContact O-N 2.9Å; L16-T32 HydrophobicContact CB-CG2 3.72Å; L16-T32 HydrophobicContact CD1-CG2 4.08Å; L16-P34 HydrophobicContact CD2-CG 4.29Å; L16-H36 HydrophobicContact CD1-CB 4.27Å; L16-H36 VanDerWaalsContact CD1-ND1 3.29Å; L16-H36 WeakPolarHBondContact CD1-ND1 3.38Å; L16-L38 HydrophobicContact CD1-CD1 4.39Å
17	Q	91.8	Very high	91.2	Very high	55 Å²	55	47.6 Å²	47.6	26%	0.257	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-69.2	124.8	176.1	-177.8	173	20.1	0	0	110.5	T32 K33 N289	Q17-T32 CarbonylContact O-C 3.6Å; Q17-T32 VanDerWaalsContact O-CA 3.28Å; Q17-T32 WeakPolarHBondContact O-CA 3.46Å; Q17-T32 WeakPolarHBondContact O-CB 3.36Å; Q17-K33 HydrophobicContact CB-CB 4.24Å; Q17-K33 PolarHBondContact O-N 2.8Å; Q17-N289 WeakPolarHBondContact CA-O 3.46Å; Q17-N289 HydrophobicContact CG-CB 4.17Å
18	I	93.2	Very high	91.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	136.9	174.6	-54.9	175.9	0	0	0	109.6	L14 L16 L21 V30 F275 A287 N289 V292	L14-I18 HydrophobicContact CD2-CD1 4.09Å; L14-I18 HydrophobicContact CD2-CG1 3.75Å; L16-I18 PolarHBondContact O-N 2.9Å; I18-L21 HydrophobicContact CG2-CD2 3.92Å; I18-L21 HydrophobicContact CG2-CG 4.39Å; I18-V30 HydrophobicContact CB-CG1 4.32Å; I18-V30 HydrophobicContact CD1-CG1 4.07Å; I18-V30 HydrophobicContact CG1-CG1 3.71Å; I18-V30 HydrophobicContact CG2-CG1 3.94Å; I18-F275 HydrophobicContact CG2-CD2 4.14Å; I18-F275 HydrophobicContact CG2-CE2 4.24Å; I18-F275 WeakPolarHBondContact O-CE2 3.4Å; I18-A287 HydrophobicContact CD1-CB 4.19Å; I18-A287 HydrophobicContact CG2-CB 4.45Å; I18-N289 PolarHBondContact N-O 3.06Å; I18-V292 HydrophobicContact CD1-CG2 3.52Å
19	D	91.6	Very high	91.3	Very high	24 Å²	24	44 Å²	44	13%	0.128	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	-27.5	178.4	-160.4	79.6	0	0	0	113	G31 K65 F275	D19-G31 PolarHBondContact N-O 3.02Å; D19-K65 WeakPolarHBondContact OD1-CE 3.32Å; D19-K65 IonicContact OD1-NZ 2.85Å; D19-K65 PolarHBondContact OD1-NZ 3.39Å; D19-K65 VanDerWaalsContact OD1-NZ 3.16Å; D19-K65 WeakPolarHBondContact OD2-CE 3.35Å; D19-K65 IonicContact OD2-NZ 3.79Å; D19-K65 PolarHBondContact OD2-NZ 2.92Å; D19-F275 WeakPolarHBondContact O-CE1 3.25Å; D19-F275 VanDerWaalsContact O-CZ 3.26Å; D19-F275 WeakPolarHBondContact O-CZ 3.19Å
20	C	91.9	Very high	91.4	Very high	10 Å²	10	41.1 Å²	41.1	7%	0.068	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	160	171.1	55.8	0	0	0	0	111.6	G31 I66	C20-G31 PolarHBondContact N-O 3.31Å; C20-G31 PolarHBondContact O-N 3.44Å; C20-I66 PolarHBondContact SG-O 2.95Å
21	L	94.1	Very high	91.4	Very high	17 Å²	17	40.5 Å²	40.5	9%	0.089	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	148.6	176.2	-62.4	175.7	0	0	0	109.7	I18 L28 L29 V30 F275 A277 A287 V292	I18-L21 HydrophobicContact CG2-CD2 3.92Å; I18-L21 HydrophobicContact CG2-CG 4.39Å; L21-L28 HydrophobicContact CD2-CD1 4.49Å; L21-L29 WeakPolarHBondContact CA-O 3.1Å; L21-V30 HydrophobicContact CD2-CB 4.4Å; L21-V30 HydrophobicContact CD2-CG1 4.24Å; L21-V30 HydrophobicContact CD2-CG2 3.97Å; L21-F275 HydrophobicContact CD1-CB 4.06Å; L21-F275 HydrophobicContact CG-CB 4.34Å; L21-A277 HydrophobicContact CB-CB 3.95Å; L21-A287 HydrophobicContact CD1-CB 3.42Å; L21-A287 VanDerWaalsContact CD1-CB 3.42Å; L21-A287 HydrophobicContact CD2-CB 4.22Å; L21-A287 HydrophobicContact CG-CB 4.13Å; L21-V292 HydrophobicContact CD2-CG2 4.48Å
22	A	93.3	Very high	91.4	Very high	7 Å²	7	39.7 Å²	39.7	6%	0.058	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	152.8	160.4	0	0	0	0	0	108.4	L29 L69 V71	A22-L29 HydrophobicContact CB-CB 4.39Å; A22-L29 PolarHBondContact N-O 2.86Å; A22-L29 VanDerWaalsContact N-O 3.08Å; A22-L29 WeakPolarHBondContact O-CA 3.27Å; A22-L29 WeakPolarHBondContact O-CB 3.18Å; A22-L29 PolarHBondContact O-N 3.32Å; A22-L69 HydrophobicContact CB-CB 3.89Å; A22-V71 HydrophobicContact CB-CG2 3.77Å
23	A	92.8	Very high	91.4	Very high	10 Å²	10	38.8 Å²	38.8	8%	0.083	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	154.4	179.6	0	0	0	0	0	110.5	W27 L28 A279 Y285	A23-W27 VanDerWaalsContact CA-O 3.23Å; A23-W27 WeakPolarHBondContact CA-O 3.17Å; A23-W27 WeakPolarHBondContact CB-O 3.49Å; A23-L28 HydrophobicContact CB-CD1 4.13Å; A23-A279 HydrophobicContact CB-CB 3.5Å; A23-Y285 HydrophobicContact CB-CD2 3.77Å; A23-Y285 HydrophobicContact CB-CE2 3.81Å
24	W	92.4	Very high	91.5	Very high	13 Å²	13	34 Å²	34	5%	0.049	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	135.5	167.9	76.9	96.4	0	0	0	108.8	D26 W27 L29 L39 V71 L91 L92	W24-D26 PolarHBondContact O-N 3.34Å; W24-D26 VanDerWaalsContact O-N 3.16Å; W24-W27 HydrophobicContact CD2-CB 3.68Å; W24-W27 HydrophobicContact CD2-CG 4.29Å; W24-W27 VanDerWaalsContact CE2-CB 3.47Å; W24-W27 AromaticContact CE2-CD1 3.52Å; W24-W27 AromaticContact CE2-CG 3.6Å; W24-W27 HydrophobicContact CE3-CB 3.75Å; W24-W27 HydrophobicContact CG-CB 4.47Å; W24-W27 HydrophobicContact CH2-CB 3.57Å; W24-W27 HydrophobicContact CH2-CG 4.01Å; W24-W27 HydrophobicContact CZ2-CB 3.43Å; W24-W27 VanDerWaalsContact CZ2-CB 3.43Å; W24-W27 AromaticContact CZ2-CD1 3.71Å; W24-W27 HydrophobicContact CZ2-CD2 4.08Å; W24-W27 AromaticContact CZ2-CG 3.44Å; W24-W27 HydrophobicContact CZ2-CG 3.44Å; W24-W27 VanDerWaalsContact CZ2-CG 3.44Å; W24-W27 HydrophobicContact CZ3-CB 3.71Å; W24-W27 PolarHBondContact N-O 2.92Å; W24-W27 AromaticContact NE1-CD1 3.34Å; W24-W27 VanDerWaalsContact NE1-CD1 3.34Å; W24-W27 AromaticContact NE1-CG 3.92Å; W24-W27 WeakPolarHBondContact O-CA 3.19Å; W24-W27 WeakPolarHBondContact O-CB 3.43Å; W24-W27 PolarHBondContact O-N 2.8Å; W24-L29 HydrophobicContact CE3-CD1 4.37Å; W24-L29 HydrophobicContact CH2-CD1 4.47Å; W24-L29 HydrophobicContact CH2-CG 4.49Å; W24-L29 HydrophobicContact CZ3-CD1 3.6Å; W24-L29 HydrophobicContact CZ3-CD2 4.42Å; W24-L29 HydrophobicContact CZ3-CG 3.71Å; W24-L39 HydrophobicContact CH2-CD1 3.48Å; W24-L39 VanDerWaalsContact CH2-CD1 3.48Å; W24-L39 HydrophobicContact CZ2-CD1 4.42Å; W24-L39 HydrophobicContact CZ3-CD1 3.94Å; W24-V71 HydrophobicContact CB-CG1 3.84Å; W24-V71 HydrophobicContact CD2-CG1 4.02Å; W24-V71 HydrophobicContact CE3-CB 4.5Å; W24-V71 HydrophobicContact CE3-CG1 3.92Å; W24-V71 HydrophobicContact CE3-CG2 3.9Å; W24-V71 HydrophobicContact CG-CG1 3.99Å; W24-V71 HydrophobicContact CZ3-CG2 4.35Å; W24-L91 HydrophobicContact CD2-CD1 4.38Å; W24-L91 HydrophobicContact CD2-CD2 4.05Å; W24-L91 HydrophobicContact CD2-CG 4.47Å; W24-L91 HydrophobicContact CE3-CD1 4.02Å; W24-L91 HydrophobicContact CG-CD2 4.43Å; W24-L91 HydrophobicContact CH2-CD1 3.8Å; W24-L91 HydrophobicContact CH2-CG 3.94Å; W24-L91 HydrophobicContact CZ2-CD1 4.23Å; W24-L91 HydrophobicContact CZ2-CD2 4.1Å; W24-L91 HydrophobicContact CZ2-CG 3.89Å; W24-L91 HydrophobicContact CZ3-CD1 3.7Å; W24-L91 HydrophobicContact CZ3-CG 4.28Å; W24-L92 HydrophobicContact CZ2-CD2 4.37Å
25	E	87.5	Confident	91.4	Very high	108 Å²	108	33.2 Å²	33.2	51%	0.505	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.7	-122	-178.7	-58.4	173.6	-178.9	0	0	111.4	A279	E25-A279 PolarHBondContact N-O 2.97Å
26	D	89.8	Confident	91.5	Very high	67 Å²	67	29.5 Å²	29.5	36%	0.358	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	6.1	178.2	-66.3	-24.1	0	0	0	113.5	W24 R41 I42	W24-D26 PolarHBondContact O-N 3.34Å; W24-D26 VanDerWaalsContact O-N 3.16Å; D26-R41 WeakPolarHBondContact O-CA 3.44Å; D26-I42 PolarHBondContact O-N 2.82Å
27	W	92.5	Very high	91.6	Very high	48 Å²	48	27.3 Å²	27.3	18%	0.182	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	132.8	-173.7	-60	94.7	0	0	0	111.6	A23 W24 L39 Y40 R41 E56	A23-W27 VanDerWaalsContact CA-O 3.23Å; A23-W27 WeakPolarHBondContact CA-O 3.17Å; A23-W27 WeakPolarHBondContact CB-O 3.49Å; W24-W27 HydrophobicContact CD2-CB 3.68Å; W24-W27 HydrophobicContact CD2-CG 4.29Å; W24-W27 VanDerWaalsContact CE2-CB 3.47Å; W24-W27 AromaticContact CE2-CD1 3.52Å; W24-W27 AromaticContact CE2-CG 3.6Å; W24-W27 HydrophobicContact CE3-CB 3.75Å; W24-W27 HydrophobicContact CG-CB 4.47Å; W24-W27 HydrophobicContact CH2-CB 3.57Å; W24-W27 HydrophobicContact CH2-CG 4.01Å; W24-W27 HydrophobicContact CZ2-CB 3.43Å; W24-W27 VanDerWaalsContact CZ2-CB 3.43Å; W24-W27 AromaticContact CZ2-CD1 3.71Å; W24-W27 HydrophobicContact CZ2-CD2 4.08Å; W24-W27 AromaticContact CZ2-CG 3.44Å; W24-W27 HydrophobicContact CZ2-CG 3.44Å; W24-W27 VanDerWaalsContact CZ2-CG 3.44Å; W24-W27 HydrophobicContact CZ3-CB 3.71Å; W24-W27 PolarHBondContact N-O 2.92Å; W24-W27 AromaticContact NE1-CD1 3.34Å; W24-W27 VanDerWaalsContact NE1-CD1 3.34Å; W24-W27 AromaticContact NE1-CG 3.92Å; W24-W27 WeakPolarHBondContact O-CA 3.19Å; W24-W27 WeakPolarHBondContact O-CB 3.43Å; W24-W27 PolarHBondContact O-N 2.8Å; W27-L39 HydrophobicContact CB-CD1 4.16Å; W27-L39 HydrophobicContact CD2-CD1 4.41Å; W27-L39 HydrophobicContact CE3-CD1 3.71Å; W27-L39 HydrophobicContact CE3-CD2 3.9Å; W27-L39 HydrophobicContact CE3-CG 3.74Å; W27-L39 HydrophobicContact CZ3-CD1 4.48Å; W27-L39 HydrophobicContact CZ3-CD2 3.88Å; W27-L39 HydrophobicContact CZ3-CG 4.04Å; W27-Y40 WeakPolarHBondContact CA-O 3.42Å; W27-R41 HydrophobicContact CD2-CB 4.49Å; W27-R41 HydrophobicContact CE3-CB 3.86Å; W27-R41 HydrophobicContact CE3-CG 4.32Å; W27-R41 HydrophobicContact CH2-CB 4.14Å; W27-R41 HydrophobicContact CH2-CG 4.21Å; W27-R41 HydrophobicContact CZ2-CG 4.35Å; W27-R41 HydrophobicContact CZ3-CB 3.71Å; W27-R41 HydrophobicContact CZ3-CG 4.21Å; W27-E56 HydrophobicContact CH2-CG 4.18Å; W27-E56 HydrophobicContact CZ3-CB 3.9Å; W27-E56 HydrophobicContact CZ3-CG 3.69Å
28	L	94.1	Very high	91.7	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	123.6	176.8	175.4	70.5	0	0	0	109.9	L11 L21 A23 V30 Y40 I42 Y285 V292	L11-L28 HydrophobicContact CD1-CD2 4.36Å; L21-L28 HydrophobicContact CD2-CD1 4.49Å; A23-L28 HydrophobicContact CB-CD1 4.13Å; L28-V30 HydrophobicContact CD2-CG2 4.01Å; L28-V30 HydrophobicContact CG-CG2 4.02Å; L28-Y40 PolarHBondContact N-O 3.23Å; L28-Y40 PolarHBondContact O-N 2.69Å; L28-I42 HydrophobicContact CB-CD1 3.5Å; L28-I42 VanDerWaalsContact CB-CD1 3.5Å; L28-I42 HydrophobicContact CB-CG1 4.39Å; L28-I42 HydrophobicContact CD2-CD1 3.77Å; L28-I42 HydrophobicContact CG-CD1 4.23Å; L28-Y285 HydrophobicContact CD1-CD1 4.4Å; L28-Y285 HydrophobicContact CD1-CD2 4.1Å; L28-Y285 HydrophobicContact CD1-CE2 4.5Å; L28-Y285 HydrophobicContact CD1-CG 4.04Å; L28-Y285 HydrophobicContact CD2-CD1 4.49Å; L28-V292 HydrophobicContact CD2-CG1 3.93Å
29	L	94.1	Very high	91.7	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	126.8	169.6	-71.4	168	0	0	0	110.2	L21 A22 W24 L37 L38 L39 L69 V71 L78 L91 F94	L21-L29 WeakPolarHBondContact CA-O 3.1Å; A22-L29 HydrophobicContact CB-CB 4.39Å; A22-L29 PolarHBondContact N-O 2.86Å; A22-L29 VanDerWaalsContact N-O 3.08Å; A22-L29 WeakPolarHBondContact O-CA 3.27Å; A22-L29 WeakPolarHBondContact O-CB 3.18Å; A22-L29 PolarHBondContact O-N 3.32Å; W24-L29 HydrophobicContact CE3-CD1 4.37Å; W24-L29 HydrophobicContact CH2-CD1 4.47Å; W24-L29 HydrophobicContact CH2-CG 4.49Å; W24-L29 HydrophobicContact CZ3-CD1 3.6Å; W24-L29 HydrophobicContact CZ3-CD2 4.42Å; W24-L29 HydrophobicContact CZ3-CG 3.71Å; L29-L37 HydrophobicContact CB-CD1 4.25Å; L29-L37 HydrophobicContact CD2-CD1 4.02Å; L29-L37 HydrophobicContact CD2-CD2 4.1Å; L29-L37 HydrophobicContact CD2-CG 3.94Å; L29-L38 WeakPolarHBondContact CA-O 3.38Å; L29-L39 HydrophobicContact CD2-CB 4.1Å; L29-L39 HydrophobicContact CD2-CD1 3.66Å; L29-L39 HydrophobicContact CD2-CG 4.47Å; L29-L39 HydrophobicContact CG-CD1 4.14Å; L29-L69 HydrophobicContact CB-CD1 4.49Å; L29-V71 HydrophobicContact CD1-CG2 3.81Å; L29-L78 HydrophobicContact CD1-CD1 3.72Å; L29-L78 HydrophobicContact CD1-CD2 4.04Å; L29-L91 HydrophobicContact CD1-CD1 4.4Å; L29-F94 HydrophobicContact CD2-CE1 3.92Å; L29-F94 HydrophobicContact CD2-CZ 3.63Å
30	V	94.2	Very high	91.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	109	174.3	-175.3	0	0	0	0	108.3	L11 L14 I18 L21 L28 T32 L38 Y40	L11-V30 HydrophobicContact CD1-CG2 4.03Å; L14-V30 HydrophobicContact CD2-CG1 4.14Å; I18-V30 HydrophobicContact CB-CG1 4.32Å; I18-V30 HydrophobicContact CD1-CG1 4.07Å; I18-V30 HydrophobicContact CG1-CG1 3.71Å; I18-V30 HydrophobicContact CG2-CG1 3.94Å; L21-V30 HydrophobicContact CD2-CB 4.4Å; L21-V30 HydrophobicContact CD2-CG1 4.24Å; L21-V30 HydrophobicContact CD2-CG2 3.97Å; L28-V30 HydrophobicContact CD2-CG2 4.01Å; L28-V30 HydrophobicContact CG-CG2 4.02Å; V30-T32 HydrophobicContact CG1-CG2 4.41Å; V30-L38 HydrophobicContact CB-CB 4.32Å; V30-L38 PolarHBondContact N-O 3.49Å; V30-L38 PolarHBondContact O-N 3.35Å; V30-Y40 HydrophobicContact CB-CE2 4.49Å; V30-Y40 HydrophobicContact CG2-CD2 4.06Å; V30-Y40 HydrophobicContact CG2-CE2 4.1Å
31	G	93.1	Very high	91.8	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	123.9	171.3	0	0	0	0	0	110	D19 C20	D19-G31 PolarHBondContact N-O 3.02Å; C20-G31 PolarHBondContact N-O 3.31Å; C20-G31 PolarHBondContact O-N 3.44Å
32	T	91.4	Very high	91.8	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	153.3	-176.1	64.5	0	0	0	0	111.7	L16 Q17 V30 P34 G35 H36 L38	L16-T32 HydrophobicContact CB-CG2 3.72Å; L16-T32 HydrophobicContact CD1-CG2 4.08Å; Q17-T32 CarbonylContact O-C 3.6Å; Q17-T32 VanDerWaalsContact O-CA 3.28Å; Q17-T32 WeakPolarHBondContact O-CA 3.46Å; Q17-T32 WeakPolarHBondContact O-CB 3.36Å; V30-T32 HydrophobicContact CG1-CG2 4.41Å; T32-P34 VanDerWaalsContact C-CD 3.49Å; T32-G35 PolarHBondContact O-N 3.19Å; T32-H36 PolarHBondContact N-O 2.89Å; T32-H36 WeakPolarHBondContact OG1-CA 3.45Å; T32-H36 VanDerWaalsContact OG1-CB 3.31Å; T32-H36 WeakPolarHBondContact OG1-CB 3.36Å; T32-H36 PolarHBondContact OG1-N 3.27Å; T32-H36 PolarHBondContact OG1-O 2.87Å; T32-L38 HydrophobicContact CG2-CD1 4.12Å; T32-L38 HydrophobicContact CG2-CG 4.43Å
33	K	88.6	Confident	91.5	Very high	108 Å²	108	31.2 Å²	31.2	47%	0.47	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-37.6	178.7	-174.4	179.3	-179.4	-176.6	0	114.2	Q17 G35 K65	Q17-K33 HydrophobicContact CB-CB 4.24Å; Q17-K33 PolarHBondContact O-N 2.8Å; K33-G35 PolarHBondContact O-N 2.88Å; K33-K65 WeakPolarHBondContact O-CA 3.3Å
34	P	87.9	Confident	91.1	Very high	68 Å²	68	35.9 Å²	35.9	44%	0.442	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-5.6	173.7	-20.8	36	0	0	0	114.7	L16 T32	L16-P34 HydrophobicContact CD2-CG 4.29Å; T32-P34 VanDerWaalsContact C-CD 3.49Å
35	G	86.9	Confident	90.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.179	C	C	.	.	S	Bend	trans	87.5	29.9	-179.4	0	0	0	0	0	115	T32 K33 F62 S63 K64	T32-G35 PolarHBondContact O-N 3.19Å; K33-G35 PolarHBondContact O-N 2.88Å; G35-F62 VanDerWaalsContact O-CB 3.3Å; G35-F62 WeakPolarHBondContact O-CB 3.27Å; G35-S63 PolarHBondContact O-N 2.7Å; G35-K64 WeakPolarHBondContact CA-O 3.4Å
36	H	90.9	Very high	89.6	Confident	39 Å²	39	38.1 Å²	38.1	18%	0.181	20%	0.195	C	C	.	.			trans	-93.7	135.9	164.7	-53.4	158.4	0	0	0	109.7	L16 T32 L38 N59	L16-H36 HydrophobicContact CD1-CB 4.27Å; L16-H36 VanDerWaalsContact CD1-ND1 3.29Å; L16-H36 WeakPolarHBondContact CD1-ND1 3.38Å; T32-H36 PolarHBondContact N-O 2.89Å; T32-H36 WeakPolarHBondContact OG1-CA 3.45Å; T32-H36 VanDerWaalsContact OG1-CB 3.31Å; T32-H36 WeakPolarHBondContact OG1-CB 3.36Å; T32-H36 PolarHBondContact OG1-N 3.27Å; T32-H36 PolarHBondContact OG1-O 2.87Å; H36-L38 HydrophobicContact CB-CD2 4.44Å; H36-N59 WeakPolarHBondContact CA-O 3.21Å
37	L	92.3	Very high	88.3	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	115	168.6	-173	67.7	0	0	0	108.4	L29 N59 F62 I66 L69 L78 F94	L29-L37 HydrophobicContact CB-CD1 4.25Å; L29-L37 HydrophobicContact CD2-CD1 4.02Å; L29-L37 HydrophobicContact CD2-CD2 4.1Å; L29-L37 HydrophobicContact CD2-CG 3.94Å; L37-N59 PolarHBondContact N-O 2.9Å; L37-N59 PolarHBondContact O-N 3.27Å; L37-F62 HydrophobicContact CB-CD2 3.9Å; L37-F62 HydrophobicContact CB-CE2 3.88Å; L37-F62 HydrophobicContact CD2-CD2 4.45Å; L37-F62 HydrophobicContact CD2-CE1 4.48Å; L37-F62 HydrophobicContact CD2-CE2 3.62Å; L37-F62 HydrophobicContact CD2-CZ 3.65Å; L37-F62 HydrophobicContact CG-CE2 4.4Å; L37-I66 HydrophobicContact CB-CD1 4.04Å; L37-I66 HydrophobicContact CD1-CD1 4.12Å; L37-L69 HydrophobicContact CD1-CD1 3.56Å; L37-L69 HydrophobicContact CD1-CD2 4.44Å; L37-L78 HydrophobicContact CD2-CD2 3.67Å; L37-F94 HydrophobicContact CD2-CD1 3.89Å; L37-F94 HydrophobicContact CD2-CD2 4.49Å; L37-F94 HydrophobicContact CD2-CE1 3.82Å; L37-F94 HydrophobicContact CD2-CE2 4.41Å; L37-F94 HydrophobicContact CD2-CG 4.24Å; L37-F94 HydrophobicContact CD2-CZ 4.1Å
38	L	92.7	Very high	87	Confident	7 Å²	7	40.7 Å²	40.7	4%	0.037	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	127.8	179.5	-53.6	175.8	0	0	0	109.3	L14 L16 L29 V30 T32 H36 Y40 L55 S58	L14-L38 HydrophobicContact CD1-CD1 4.23Å; L14-L38 HydrophobicContact CD2-CD1 4.29Å; L16-L38 HydrophobicContact CD1-CD1 4.39Å; L29-L38 WeakPolarHBondContact CA-O 3.38Å; V30-L38 HydrophobicContact CB-CB 4.32Å; V30-L38 PolarHBondContact N-O 3.49Å; V30-L38 PolarHBondContact O-N 3.35Å; T32-L38 HydrophobicContact CG2-CD1 4.12Å; T32-L38 HydrophobicContact CG2-CG 4.43Å; H36-L38 HydrophobicContact CB-CD2 4.44Å; L38-Y40 HydrophobicContact CB-CD2 4.19Å; L38-Y40 HydrophobicContact CB-CE2 3.56Å; L38-Y40 HydrophobicContact CD1-CE2 4.05Å; L38-Y40 HydrophobicContact CG-CE2 4.45Å; L38-L55 HydrophobicContact CB-CD1 4.09Å; L38-L55 HydrophobicContact CD2-CD1 4.44Å; L38-S58 WeakPolarHBondContact CD2-OG 3.4Å
39	L	93.2	Very high	85.5	Confident	5 Å²	5	45.4 Å²	45.4	3%	0.026	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	114.5	176	179.4	65	0	0	0	109.5	W24 W27 L29 E56 K57 F94	W24-L39 HydrophobicContact CH2-CD1 3.48Å; W24-L39 VanDerWaalsContact CH2-CD1 3.48Å; W24-L39 HydrophobicContact CZ2-CD1 4.42Å; W24-L39 HydrophobicContact CZ3-CD1 3.94Å; W27-L39 HydrophobicContact CB-CD1 4.16Å; W27-L39 HydrophobicContact CD2-CD1 4.41Å; W27-L39 HydrophobicContact CE3-CD1 3.71Å; W27-L39 HydrophobicContact CE3-CD2 3.9Å; W27-L39 HydrophobicContact CE3-CG 3.74Å; W27-L39 HydrophobicContact CZ3-CD1 4.48Å; W27-L39 HydrophobicContact CZ3-CD2 3.88Å; W27-L39 HydrophobicContact CZ3-CG 4.04Å; L29-L39 HydrophobicContact CD2-CB 4.1Å; L29-L39 HydrophobicContact CD2-CD1 3.66Å; L29-L39 HydrophobicContact CD2-CG 4.47Å; L29-L39 HydrophobicContact CG-CD1 4.14Å; L39-E56 PolarHBondContact O-N 3.48Å; L39-K57 HydrophobicContact CB-CB 4.11Å; L39-K57 HydrophobicContact CD2-CB 4.39Å; L39-K57 HydrophobicContact CD2-CD 4.35Å; L39-K57 HydrophobicContact CD2-CG 4.4Å; L39-K57 PolarHBondContact N-O 2.68Å; L39-K57 PolarHBondContact O-N 2.78Å; L39-F94 HydrophobicContact CB-CE2 4.14Å; L39-F94 HydrophobicContact CB-CZ 3.97Å; L39-F94 HydrophobicContact CD1-CZ 4.44Å; L39-F94 HydrophobicContact CD2-CE2 4.28Å; L39-F94 HydrophobicContact CD2-CZ 3.95Å; L39-F94 HydrophobicContact CG-CZ 4.34Å
40	Y	93.6	Very high	84.9	Confident	20 Å²	20	54.2 Å²	54.2	8%	0.078	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	143.6	174.5	-66.7	-88.8	0	0	0	110.5	L11 L14 W27 L28 V30 L38 V53 T54 L55	L11-Y40 HydrophobicContact CD1-CD2 3.93Å; L11-Y40 HydrophobicContact CD1-CE1 4.36Å; L11-Y40 HydrophobicContact CD1-CE2 3.63Å; L11-Y40 HydrophobicContact CD1-CG 4.4Å; L11-Y40 HydrophobicContact CD2-CD1 3.9Å; L11-Y40 HydrophobicContact CD2-CE1 3.58Å; L11-Y40 HydrophobicContact CD2-CE2 4.37Å; L11-Y40 HydrophobicContact CD2-CG 4.4Å; L14-Y40 WeakPolarHBondContact CD1-OH 3.27Å; W27-Y40 WeakPolarHBondContact CA-O 3.42Å; L28-Y40 PolarHBondContact N-O 3.23Å; L28-Y40 PolarHBondContact O-N 2.69Å; V30-Y40 HydrophobicContact CB-CE2 4.49Å; V30-Y40 HydrophobicContact CG2-CD2 4.06Å; V30-Y40 HydrophobicContact CG2-CE2 4.1Å; L38-Y40 HydrophobicContact CB-CD2 4.19Å; L38-Y40 HydrophobicContact CB-CE2 3.56Å; L38-Y40 HydrophobicContact CD1-CE2 4.05Å; L38-Y40 HydrophobicContact CG-CE2 4.45Å; Y40-V53 HydrophobicContact CD1-CG1 3.88Å; Y40-V53 HydrophobicContact CG-CG1 4.48Å; Y40-T54 CarbonylContact C-O 3.56Å; Y40-T54 VanDerWaalsContact CA-O 3.27Å; Y40-T54 WeakPolarHBondContact CA-O 3.49Å; Y40-L55 HydrophobicContact CD1-CB 3.98Å; Y40-L55 HydrophobicContact CD1-CD1 4.05Å; Y40-L55 HydrophobicContact CD2-CD1 4.31Å; Y40-L55 HydrophobicContact CE1-CB 3.72Å; Y40-L55 HydrophobicContact CE1-CD1 3.7Å; Y40-L55 HydrophobicContact CE1-CG 4.23Å; Y40-L55 HydrophobicContact CE2-CD1 3.98Å; Y40-L55 HydrophobicContact CG-CD1 4.35Å
41	R	93.1	Very high	84.6	Confident	77 Å²	77	55.5 Å²	55.5	29%	0.291	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	127.4	166.8	-174.1	179.5	-170	177.5	3.9	109.2	D26 W27 K43 T54 E56	D26-R41 WeakPolarHBondContact O-CA 3.44Å; W27-R41 HydrophobicContact CD2-CB 4.49Å; W27-R41 HydrophobicContact CE3-CB 3.86Å; W27-R41 HydrophobicContact CE3-CG 4.32Å; W27-R41 HydrophobicContact CH2-CB 4.14Å; W27-R41 HydrophobicContact CH2-CG 4.21Å; W27-R41 HydrophobicContact CZ2-CG 4.35Å; W27-R41 HydrophobicContact CZ3-CB 3.71Å; W27-R41 HydrophobicContact CZ3-CG 4.21Å; R41-K43 HydrophobicContact CG-CG 4.42Å; R41-T54 PolarHBondContact N-O 3.46Å; R41-T54 PolarHBondContact O-N 3.34Å; R41-T54 PolarHBondContact O-OG1 3.35Å; R41-E56 HydrophobicContact CB-CG 3.82Å; R41-E56 WeakPolarHBondContact CD-OE1 3.22Å; R41-E56 IonicContact NH1-OE1 3.94Å
42	I	92.4	Very high	84.3	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	98.1	-172	-57.4	171	0	0	0	107.6	I10 D26 L28 F51 E52 Y285	I10-I42 HydrophobicContact CD1-CG2 4.2Å; I10-I42 HydrophobicContact CG2-CD1 3.62Å; I10-I42 HydrophobicContact CG2-CG1 4.02Å; D26-I42 PolarHBondContact O-N 2.82Å; L28-I42 HydrophobicContact CB-CD1 3.5Å; L28-I42 VanDerWaalsContact CB-CD1 3.5Å; L28-I42 HydrophobicContact CB-CG1 4.39Å; L28-I42 HydrophobicContact CD2-CD1 3.77Å; L28-I42 HydrophobicContact CG-CD1 4.23Å; I42-F51 HydrophobicContact CG2-CB 3.99Å; I42-F51 HydrophobicContact CG2-CD1 3.74Å; I42-F51 HydrophobicContact CG2-CG 4.08Å; I42-E52 WeakPolarHBondContact CA-O 3.22Å; I42-Y285 HydrophobicContact CD1-CD1 4.47Å; I42-Y285 HydrophobicContact CD1-CE1 3.46Å; I42-Y285 VanDerWaalsContact CD1-CE1 3.46Å; I42-Y285 VanDerWaalsContact CD1-OH 3.3Å; I42-Y285 WeakPolarHBondContact CD1-OH 3.26Å
43	K	88.8	Confident	84.3	Confident	85 Å²	85	63.3 Å²	63.3	37%	0.37	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	136.8	176	-69.6	-176	-178.2	175.6	0	110.2	R41 F51 E52	R41-K43 HydrophobicContact CG-CG 4.42Å; K43-F51 CarbonylContact O-C 3.49Å; K43-F51 VanDerWaalsContact O-CA 3.31Å; K43-F51 WeakPolarHBondContact O-CA 3.42Å; K43-E52 HydrophobicContact CB-CB 4.45Å; K43-E52 PolarHBondContact N-O 2.86Å; K43-E52 PolarHBondContact O-N 2.9Å
44	K	84	Confident	84.5	Confident	109 Å²	109	60.5 Å²	60.5	47%	0.474	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	121.7	171.4	-167	178.2	179.8	-175.7	0	109.2	A46 N49 F51	K44-A46 PolarHBondContact O-N 2.8Å; K44-N49 WeakPolarHBondContact CE-OD1 3.31Å; K44-N49 PolarHBondContact NZ-OD1 2.73Å; K44-N49 VanDerWaalsContact NZ-OD1 3.17Å; K44-F51 HydrophobicContact CB-CD1 4.01Å; K44-F51 HydrophobicContact CB-CE1 3.7Å; K44-F51 HydrophobicContact CD-CE1 4.15Å; K44-F51 HydrophobicContact CD-CZ 4.36Å; K44-F51 HydrophobicContact CG-CD1 4.25Å; K44-F51 HydrophobicContact CG-CE1 3.72Å; K44-F51 HydrophobicContact CG-CZ 4.22Å
45	D	78.3	Confident	84.7	Confident	66 Å²	66	61.6 Å²	61.6	35%	0.353	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-78.5	118.1	168.6	178.3	8.2	0	0	0	109.2	A47 T48 N49 R50	D45-A47 PolarHBondContact O-N 2.94Å; D45-A47 PolarHBondContact OD1-N 3.05Å; D45-T48 WeakPolarHBondContact OD2-CB 3.46Å; D45-T48 WeakPolarHBondContact OD2-CG2 3.29Å; D45-T48 PolarHBondContact OD2-OG1 3.33Å; D45-N49 WeakPolarHBondContact O-CA 3.3Å; D45-N49 PolarHBondContact O-N 3Å; D45-N49 VanDerWaalsContact O-N 3.09Å; D45-R50 WeakPolarHBondContact CB-O 3.38Å; D45-R50 PolarHBondContact N-O 2.86Å
46	A	69.2	Low	84.9	Confident	101 Å²	101	66 Å²	66	84%	0.835	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-24.4	-179.5	0	0	0	0	0	113	K44	K44-A46 PolarHBondContact O-N 2.8Å
47	A	63.6	Low	84.8	Confident	93 Å²	93	68.6 Å²	68.6	77%	0.769	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-38.9	-175.8	0	0	0	0	0	113.2	D45	D45-A47 PolarHBondContact O-N 2.94Å; D45-A47 PolarHBondContact OD1-N 3.05Å
48	T	64.1	Low	84.7	Confident	76 Å²	76	71.6 Å²	71.6	47%	0.466	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-4.4	-175	63.8	0	0	0	0	114	D45 R50	D45-T48 WeakPolarHBondContact OD2-CB 3.46Å; D45-T48 WeakPolarHBondContact OD2-CG2 3.29Å; D45-T48 PolarHBondContact OD2-OG1 3.33Å; T48-R50 PolarHBondContact O-N 2.89Å
49	N	63.5	Low	84.4	Confident	99 Å²	99	72.3 Å²	72.3	53%	0.529	38%	0.381	S	S	.	.	S	Bend	trans	55.7	15.9	-173.5	-133.3	16.1	0	0	0	113.2	K44 D45	K44-N49 WeakPolarHBondContact CE-OD1 3.31Å; K44-N49 PolarHBondContact NZ-OD1 2.73Å; K44-N49 VanDerWaalsContact NZ-OD1 3.17Å; D45-N49 WeakPolarHBondContact O-CA 3.3Å; D45-N49 PolarHBondContact O-N 3Å; D45-N49 VanDerWaalsContact O-N 3.09Å
50	R	80.7	Confident	84	Confident	186 Å²	186	78 Å²	78	70%	0.702	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-92.6	158.9	175.1	-66.9	179.7	173.9	177.8	-2.1	109.9	D45 T48	D45-R50 WeakPolarHBondContact CB-O 3.38Å; D45-R50 PolarHBondContact N-O 2.86Å; T48-R50 PolarHBondContact O-N 2.89Å
51	F	87.6	Confident	83.3	Confident	27 Å²	27	83.8 Å²	83.8	12%	0.118	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	126.2	173.2	-65.2	-80.3	0	0	0	110.1	V8 I10 I42 K43 K44 V53 V296	V8-F51 HydrophobicContact CB-CD2 4.19Å; V8-F51 HydrophobicContact CB-CE2 4Å; V8-F51 HydrophobicContact CG1-CD2 3.7Å; V8-F51 HydrophobicContact CG1-CE2 3.95Å; V8-F51 HydrophobicContact CG2-CE2 4.18Å; I10-F51 HydrophobicContact CD1-CB 3.72Å; I10-F51 HydrophobicContact CD1-CD2 3.58Å; I10-F51 HydrophobicContact CD1-CE2 4.38Å; I10-F51 HydrophobicContact CD1-CG 3.67Å; I42-F51 HydrophobicContact CG2-CB 3.99Å; I42-F51 HydrophobicContact CG2-CD1 3.74Å; I42-F51 HydrophobicContact CG2-CG 4.08Å; K43-F51 CarbonylContact O-C 3.49Å; K43-F51 VanDerWaalsContact O-CA 3.31Å; K43-F51 WeakPolarHBondContact O-CA 3.42Å; K44-F51 HydrophobicContact CB-CD1 4.01Å; K44-F51 HydrophobicContact CB-CE1 3.7Å; K44-F51 HydrophobicContact CD-CE1 4.15Å; K44-F51 HydrophobicContact CD-CZ 4.36Å; K44-F51 HydrophobicContact CG-CD1 4.25Å; K44-F51 HydrophobicContact CG-CE1 3.72Å; K44-F51 HydrophobicContact CG-CZ 4.22Å; F51-V53 HydrophobicContact CB-CG2 4.28Å; F51-V296 HydrophobicContact CE2-CG2 3.56Å; F51-V296 HydrophobicContact CZ-CG2 3.6Å
52	E	87.8	Confident	82.6	Confident	118 Å²	118	80.8 Å²	80.8	55%	0.551	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.3	118.8	164.9	-171.4	-175.5	-172.1	0	0	107.9	I42 K43 T54	I42-E52 WeakPolarHBondContact CA-O 3.22Å; K43-E52 HydrophobicContact CB-CB 4.45Å; K43-E52 PolarHBondContact N-O 2.86Å; K43-E52 PolarHBondContact O-N 2.9Å; E52-T54 HydrophobicContact CG-CG2 4.4Å
53	V	92	Very high	81.6	Confident	46 Å²	46	84.7 Å²	84.7	28%	0.279	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	115.7	-176.4	-174.2	0	0	0	0	108.5	I10 L11 Y40 F51	I10-V53 HydrophobicContact CG2-CG1 4.06Å; I10-V53 HydrophobicContact CG2-CG2 3.64Å; L11-V53 HydrophobicContact CD2-CG1 3.78Å; Y40-V53 HydrophobicContact CD1-CG1 3.88Å; Y40-V53 HydrophobicContact CG-CG1 4.48Å; F51-V53 HydrophobicContact CB-CG2 4.28Å
54	T	91.8	Very high	81.3	Confident	48 Å²	48	85.6 Å²	85.6	29%	0.294	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	130	-178.8	48	0	0	0	0	109.8	Y40 R41 E52 E56	Y40-T54 CarbonylContact C-O 3.56Å; Y40-T54 VanDerWaalsContact CA-O 3.27Å; Y40-T54 WeakPolarHBondContact CA-O 3.49Å; R41-T54 PolarHBondContact N-O 3.46Å; R41-T54 PolarHBondContact O-N 3.34Å; R41-T54 PolarHBondContact O-OG1 3.35Å; E52-T54 HydrophobicContact CG-CG2 4.4Å; T54-E56 PolarHBondContact O-N 2.88Å
55	L	92.6	Very high	81.4	Confident	92 Å²	92	85.1 Å²	85.1	48%	0.482	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	112.3	171.9	177.8	68.4	0	0	0	108.3	L38 Y40	L38-L55 HydrophobicContact CB-CD1 4.09Å; L38-L55 HydrophobicContact CD2-CD1 4.44Å; Y40-L55 HydrophobicContact CD1-CB 3.98Å; Y40-L55 HydrophobicContact CD1-CD1 4.05Å; Y40-L55 HydrophobicContact CD2-CD1 4.31Å; Y40-L55 HydrophobicContact CE1-CB 3.72Å; Y40-L55 HydrophobicContact CE1-CD1 3.7Å; Y40-L55 HydrophobicContact CE1-CG 4.23Å; Y40-L55 HydrophobicContact CE2-CD1 3.98Å; Y40-L55 HydrophobicContact CG-CD1 4.35Å
56	E	91.5	Very high	81.9	Confident	91 Å²	91	82 Å²	82	43%	0.425	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	-40.9	-172.9	-71	-91.7	-160.1	0	0	111.2	W27 L39 R41 T54	W27-E56 HydrophobicContact CH2-CG 4.18Å; W27-E56 HydrophobicContact CZ3-CB 3.9Å; W27-E56 HydrophobicContact CZ3-CG 3.69Å; L39-E56 PolarHBondContact O-N 3.48Å; R41-E56 HydrophobicContact CB-CG 3.82Å; R41-E56 WeakPolarHBondContact CD-OE1 3.22Å; R41-E56 IonicContact NH1-OE1 3.94Å; T54-E56 PolarHBondContact O-N 2.88Å
57	K	89	Confident	82.9	Confident	95 Å²	95	80.6 Å²	80.6	41%	0.413	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	144.2	177.8	-61.9	-175.4	-177.6	-178.4	0	111.8	L39 L92 F94	L39-K57 HydrophobicContact CB-CB 4.11Å; L39-K57 HydrophobicContact CD2-CB 4.39Å; L39-K57 HydrophobicContact CD2-CD 4.35Å; L39-K57 HydrophobicContact CD2-CG 4.4Å; L39-K57 PolarHBondContact N-O 2.68Å; L39-K57 PolarHBondContact O-N 2.78Å; K57-L92 PolarHBondContact NZ-O 2.89Å; K57-F94 HydrophobicContact CB-CE2 4.16Å; K57-F94 HydrophobicContact CD-CE2 4.28Å
58	S	89.9	Confident	84.2	Confident	63 Å²	63	78.3 Å²	78.3	44%	0.441	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	110	169.5	-175.5	0	0	0	0	108.4	L38	L38-S58 WeakPolarHBondContact CD2-OG 3.4Å
59	N	86.3	Confident	85.7	Confident	21 Å²	21	75.3 Å²	75.3	11%	0.112	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	118.2	-179.6	-168.6	-12.3	0	0	0	110.4	H36 L37 N61 F62 F94	H36-N59 WeakPolarHBondContact CA-O 3.21Å; L37-N59 PolarHBondContact N-O 2.9Å; L37-N59 PolarHBondContact O-N 3.27Å; N59-N61 WeakPolarHBondContact OD1-CB 3.49Å; N59-N61 VanDerWaalsContact OD1-CG 3.27Å; N59-N61 PolarHBondContact OD1-N 3.26Å; N59-F62 HydrophobicContact CB-CD2 4.43Å; N59-F62 HydrophobicContact CB-CE2 4.34Å; N59-F94 HydrophobicContact CB-CD2 4.06Å; N59-F94 VanDerWaalsContact ND2-CB 3.27Å; N59-F94 WeakPolarHBondContact ND2-CB 3.44Å
60	K	85.1	Confident	87.1	Confident	126 Å²	126	74.8 Å²	74.8	55%	0.548	36%	0.362	S	S	.	.			trans	-96.7	-5.5	178.3	-56.7	-175.3	179.2	173.6	0	113.2	F62 S63	K60-F62 PolarHBondContact O-N 3.3Å; K60-F62 VanDerWaalsContact O-N 3.13Å; K60-S63 PolarHBondContact O-N 3.39Å; K60-S63 PolarHBondContact O-OG 2.86Å
61	N	78	Confident	87.7	Confident	140 Å²	140	67 Å²	67	75%	0.749	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-14.6	-174.2	-62.8	-9.1	0	0	0	113.1	N59 S63	N59-N61 WeakPolarHBondContact OD1-CB 3.49Å; N59-N61 VanDerWaalsContact OD1-CG 3.27Å; N59-N61 PolarHBondContact OD1-N 3.26Å; N61-S63 VanDerWaalsContact C-N 3.3Å
62	F	79.4	Confident	88	Confident	15 Å²	15	65.8 Å²	65.8	7%	0.066	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-33.3	172.1	-70	-99.3	0	0	0	111.2	G35 L37 N59 K60 K64 I66 L82 H89	G35-F62 VanDerWaalsContact O-CB 3.3Å; G35-F62 WeakPolarHBondContact O-CB 3.27Å; L37-F62 HydrophobicContact CB-CD2 3.9Å; L37-F62 HydrophobicContact CB-CE2 3.88Å; L37-F62 HydrophobicContact CD2-CD2 4.45Å; L37-F62 HydrophobicContact CD2-CE1 4.48Å; L37-F62 HydrophobicContact CD2-CE2 3.62Å; L37-F62 HydrophobicContact CD2-CZ 3.65Å; L37-F62 HydrophobicContact CG-CE2 4.4Å; N59-F62 HydrophobicContact CB-CD2 4.43Å; N59-F62 HydrophobicContact CB-CE2 4.34Å; K60-F62 PolarHBondContact O-N 3.3Å; K60-F62 VanDerWaalsContact O-N 3.13Å; F62-K64 PolarHBondContact O-N 2.88Å; F62-I66 HydrophobicContact CB-CD1 4.13Å; F62-I66 HydrophobicContact CB-CG1 4.38Å; F62-I66 HydrophobicContact CD1-CD1 4Å; F62-I66 HydrophobicContact CD1-CG1 4.43Å; F62-I66 HydrophobicContact CG-CD1 4.03Å; F62-L82 HydrophobicContact CD1-CD1 3.47Å; F62-L82 VanDerWaalsContact CD1-CD1 3.47Å; F62-L82 HydrophobicContact CD1-CD2 3.82Å; F62-L82 HydrophobicContact CD1-CG 4.24Å; F62-L82 HydrophobicContact CE1-CD1 3.88Å; F62-H89 AromaticContact CE1-CE1 3.52Å; F62-H89 AromaticContact CE1-ND1 3.93Å; F62-H89 AromaticContact CE1-NE2 3.92Å; F62-H89 AromaticContact CZ-CE1 3.88Å; F62-H89 AromaticContact CZ-NE2 3.98Å
63	S	71.7	Confident	88.1	Confident	82 Å²	82	61.7 Å²	61.7	57%	0.573	31%	0.314	S	S	*	.			trans	51.7	2.6	168	-66.3	0	0	0	0	117.3	G35 K60 N61	G35-S63 PolarHBondContact O-N 2.7Å; K60-S63 PolarHBondContact O-N 3.39Å; K60-S63 PolarHBondContact O-OG 2.86Å; N61-S63 VanDerWaalsContact C-N 3.3Å
64	K	82.2	Confident	87.9	Confident	104 Å²	104	64 Å²	64	45%	0.452	32%	0.322	S	S	.	.	S	Bend	trans	-148.9	156.6	-172.4	-61	-65.7	-177.8	133.5	0	109.6	G35 F62 I66 E83	G35-K64 WeakPolarHBondContact CA-O 3.4Å; F62-K64 PolarHBondContact O-N 2.88Å; K64-I66 PolarHBondContact O-N 3.16Å; K64-E83 HydrophobicContact CB-CG 4.06Å; K64-E83 HydrophobicContact CD-CG 4.43Å; K64-E83 WeakPolarHBondContact CD-OE1 3.37Å; K64-E83 WeakPolarHBondContact CE-OE1 3.5Å; K64-E83 HydrophobicContact CG-CG 3.98Å; K64-E83 WeakPolarHBondContact CG-OE1 3.41Å; K64-E83 IonicContact NZ-OE1 2.77Å; K64-E83 PolarHBondContact NZ-OE1 2.87Å
65	K	84.8	Confident	87.9	Confident	98 Å²	98	65.2 Å²	65.2	43%	0.426	32%	0.321	S	S	.	.			trans	-52.8	123.1	180	-175.6	-176.2	178.2	-177.3	0	111.4	D19 K33	D19-K65 WeakPolarHBondContact OD1-CE 3.32Å; D19-K65 IonicContact OD1-NZ 2.85Å; D19-K65 PolarHBondContact OD1-NZ 3.39Å; D19-K65 VanDerWaalsContact OD1-NZ 3.16Å; D19-K65 WeakPolarHBondContact OD2-CE 3.35Å; D19-K65 IonicContact OD2-NZ 3.79Å; D19-K65 PolarHBondContact OD2-NZ 2.92Å; K33-K65 WeakPolarHBondContact O-CA 3.3Å
66	I	89.3	Confident	87.9	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	106.5	176.1	-47.8	-175.1	0	0	0	108.5	C20 L37 F62 K64 L69 L82	C20-I66 PolarHBondContact SG-O 2.95Å; L37-I66 HydrophobicContact CB-CD1 4.04Å; L37-I66 HydrophobicContact CD1-CD1 4.12Å; F62-I66 HydrophobicContact CB-CD1 4.13Å; F62-I66 HydrophobicContact CB-CG1 4.38Å; F62-I66 HydrophobicContact CD1-CD1 4Å; F62-I66 HydrophobicContact CD1-CG1 4.43Å; F62-I66 HydrophobicContact CG-CD1 4.03Å; K64-I66 PolarHBondContact O-N 3.16Å; I66-L69 HydrophobicContact CG2-CD1 4.15Å; I66-L69 HydrophobicContact CG2-CD2 3.55Å; I66-L69 HydrophobicContact CG2-CG 3.64Å; I66-L82 HydrophobicContact CB-CD2 4.08Å; I66-L82 HydrophobicContact CG1-CD2 3.76Å; I66-L82 HydrophobicContact CG2-CD2 4.09Å
67	Q	89.5	Confident	88	Confident	73 Å²	73	61.2 Å²	61.2	34%	0.341	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	-38.3	-172.2	-63.5	178.8	3.7	0	0	112.7	L81 N84	Q67-L81 HydrophobicContact CB-CB 4.39Å; Q67-L81 HydrophobicContact CB-CD2 4.09Å; Q67-L81 HydrophobicContact CB-CG 4.11Å; Q67-L81 PolarHBondContact N-O 2.9Å; Q67-N84 PolarHBondContact NE2-OD1 3.29Å
68	Q	92.4	Very high	88.3	Confident	45 Å²	45	56.7 Å²	56.7	21%	0.21	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	142.3	-179.1	-171.9	-179.6	-4.8	0	0	109.8	S80 L81 F109	Q68-S80 WeakPolarHBondContact O-CA 3.46Å; Q68-L81 HydrophobicContact CB-CB 4.11Å; Q68-L81 PolarHBondContact O-N 2.85Å; Q68-F109 HydrophobicContact CB-CD1 4.33Å; Q68-F109 HydrophobicContact CB-CE1 3.71Å; Q68-F109 HydrophobicContact CB-CZ 4.43Å; Q68-F109 HydrophobicContact CG-CD1 4.23Å; Q68-F109 HydrophobicContact CG-CE1 3.6Å; Q68-F109 HydrophobicContact CG-CZ 3.93Å; Q68-F109 PolarHBondContact NE2-O 3.35Å; Q68-F109 PolarHBondContact OE1-O 2.81Å
69	L	94.1	Very high	88.5	Confident	13 Å²	13	53.7 Å²	53.7	7%	0.068	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	142.4	175.2	-69.7	173.7	0	0	0	109.3	A22 L29 L37 I66 L78 V79	A22-L69 HydrophobicContact CB-CB 3.89Å; L29-L69 HydrophobicContact CB-CD1 4.49Å; L37-L69 HydrophobicContact CD1-CD1 3.56Å; L37-L69 HydrophobicContact CD1-CD2 4.44Å; I66-L69 HydrophobicContact CG2-CD1 4.15Å; I66-L69 HydrophobicContact CG2-CD2 3.55Å; I66-L69 HydrophobicContact CG2-CG 3.64Å; L69-L78 HydrophobicContact CD2-CD1 4.16Å; L69-L78 HydrophobicContact CD2-CD2 4.32Å; L69-L78 HydrophobicContact CD2-CG 4.37Å; L69-V79 WeakPolarHBondContact CA-O 3.4Å
70	Y	93.6	Very high	88.9	Confident	87 Å²	87	52.7 Å²	52.7	34%	0.341	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	126.2	171.7	-167	-87.1	0	0	0	109.8	V72 V79 F109 C111	Y70-V72 HydrophobicContact CD1-CG2 3.75Å; Y70-V72 HydrophobicContact CE1-CG2 3.87Å; Y70-V79 PolarHBondContact N-O 2.86Å; Y70-V79 PolarHBondContact O-N 2.85Å; Y70-F109 HydrophobicContact CG-CE2 4.33Å; Y70-C111 HydrophobicContact CD1-CB 3.59Å; Y70-C111 HydrophobicContact CD2-CB 4.36Å; Y70-C111 HydrophobicContact CE1-CB 3.41Å; Y70-C111 VanDerWaalsContact CE1-CB 3.41Å; Y70-C111 HydrophobicContact CE2-CB 4.21Å; Y70-C111 HydrophobicContact CG-CB 4.07Å
71	V	94.3	Very high	89.3	Confident	22 Å²	22	46.8 Å²	46.8	13%	0.133	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	132.6	-179.8	173.3	0	0	0	0	109	A22 W24 L29 L78 L91	A22-V71 HydrophobicContact CB-CG2 3.77Å; W24-V71 HydrophobicContact CB-CG1 3.84Å; W24-V71 HydrophobicContact CD2-CG1 4.02Å; W24-V71 HydrophobicContact CE3-CB 4.5Å; W24-V71 HydrophobicContact CE3-CG1 3.92Å; W24-V71 HydrophobicContact CE3-CG2 3.9Å; W24-V71 HydrophobicContact CG-CG1 3.99Å; W24-V71 HydrophobicContact CZ3-CG2 4.35Å; L29-V71 HydrophobicContact CD1-CG2 3.81Å; V71-L78 HydrophobicContact CG2-CD1 3.76Å; V71-L91 HydrophobicContact CB-CD1 4.37Å; V71-L91 HydrophobicContact CG1-CD1 3.68Å; V71-L91 HydrophobicContact CG1-CD2 3.71Å; V71-L91 HydrophobicContact CG1-CG 4.36Å; V71-L91 HydrophobicContact CG2-CD1 3.91Å
72	V	92.6	Very high	89.9	Confident	3 Å²	3	40.7 Å²	40.7	2%	0.018	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	92.6	170.3	-162.3	0	0	0	0	108.4	Y70 Q74 Y75 K76 I77 L113 L123	Y70-V72 HydrophobicContact CD1-CG2 3.75Å; Y70-V72 HydrophobicContact CE1-CG2 3.87Å; V72-Q74 VanDerWaalsContact C-N 3.31Å; V72-Q74 PolarHBondContact O-N 3.24Å; V72-Y75 HydrophobicContact CG1-CD2 3.74Å; V72-Y75 PolarHBondContact O-N 3.13Å; V72-K76 PolarHBondContact O-N 2.99Å; V72-I77 HydrophobicContact CB-CD1 4.38Å; V72-I77 HydrophobicContact CB-CG1 3.78Å; V72-I77 HydrophobicContact CG2-CD1 4.4Å; V72-I77 HydrophobicContact CG2-CG1 4.08Å; V72-I77 PolarHBondContact N-O 2.95Å; V72-I77 PolarHBondContact O-N 3.16Å; V72-I77 VanDerWaalsContact O-N 3.16Å; V72-L113 HydrophobicContact CG1-CD1 4.49Å; V72-L123 HydrophobicContact CB-CD2 4.37Å; V72-L123 HydrophobicContact CG1-CD1 4.19Å; V72-L123 HydrophobicContact CG1-CD2 4.12Å; V72-L123 HydrophobicContact CG2-CD1 4.07Å; V72-L123 HydrophobicContact CG2-CD2 3.85Å
73	S	90.3	Very high	90.2	Very high	31 Å²	31	45 Å²	45	22%	0.217	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-25.9	-169.5	61.2	0	0	0	0	113.4	K76	S73-K76 WeakPolarHBondContact O-CD 3.41Å; S73-K76 WeakPolarHBondContact O-CE 3.47Å; S73-K76 PolarHBondContact O-N 2.93Å; S73-K76 PolarHBondContact O-NZ 3Å
74	Q	88.6	Confident	91.1	Very high	95 Å²	95	44.5 Å²	44.5	44%	0.444	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-42	177.2	-64.3	81.4	-1.6	0	0	111.2	V72 L113 E121	V72-Q74 VanDerWaalsContact C-N 3.31Å; V72-Q74 PolarHBondContact O-N 3.24Å; Q74-L113 HydrophobicContact CB-CD2 4.45Å; Q74-L113 HydrophobicContact CG-CD2 3.85Å; Q74-E121 WeakPolarHBondContact CB-OE2 3.48Å; Q74-E121 VanDerWaalsContact CG-OE2 3.27Å; Q74-E121 WeakPolarHBondContact CG-OE2 3.33Å
75	Y	90.8	Very high	91.6	Very high	74 Å²	74	41.3 Å²	41.3	29%	0.29	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-3.4	176.9	-67.6	-67.6	0	0	0	113.9	V72 I77 L113 E121 L123 W138	V72-Y75 HydrophobicContact CG1-CD2 3.74Å; V72-Y75 PolarHBondContact O-N 3.13Å; Y75-I77 WeakPolarHBondContact O-CG2 3.37Å; Y75-I77 PolarHBondContact O-N 2.92Å; Y75-L113 HydrophobicContact CD2-CD1 4.36Å; Y75-L113 HydrophobicContact CE2-CD1 3.73Å; Y75-E121 PolarHBondContact OH-O 2.86Å; Y75-L123 HydrophobicContact CD2-CB 4.02Å; Y75-L123 HydrophobicContact CD2-CD2 4.27Å; Y75-L123 HydrophobicContact CE2-CB 3.59Å; Y75-W138 AromaticContact CD1-CD1 3.63Å; Y75-W138 AromaticContact CD1-NE1 3.59Å; Y75-W138 AromaticContact CE1-CD1 3.72Å; Y75-W138 AromaticContact CG-CD1 3.78Å; Y75-W138 AromaticContact CG-NE1 3.77Å; Y75-W138 AromaticContact CZ-CD1 3.99Å
76	K	92.1	Very high	92.1	Very high	95 Å²	95	36.6 Å²	36.6	41%	0.413	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	39.3	-174.8	-54	-64.6	173.3	-154.2	0	112.7	V72 S73 L91	V72-K76 PolarHBondContact O-N 2.99Å; S73-K76 WeakPolarHBondContact O-CD 3.41Å; S73-K76 WeakPolarHBondContact O-CE 3.47Å; S73-K76 PolarHBondContact O-N 2.93Å; S73-K76 PolarHBondContact O-NZ 3Å; K76-L91 VanDerWaalsContact C-CB 3.43Å; K76-L91 WeakPolarHBondContact O-CB 3.5Å; K76-L91 PolarHBondContact O-N 3.04Å
77	I	94.7	Very high	92.3	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.021	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	153.3	178	64.7	178.4	0	0	0	112.2	V72 Y75 V88 H89 I97 L123 W138	V72-I77 HydrophobicContact CB-CD1 4.38Å; V72-I77 HydrophobicContact CB-CG1 3.78Å; V72-I77 HydrophobicContact CG2-CD1 4.4Å; V72-I77 HydrophobicContact CG2-CG1 4.08Å; V72-I77 PolarHBondContact N-O 2.95Å; V72-I77 PolarHBondContact O-N 3.16Å; V72-I77 VanDerWaalsContact O-N 3.16Å; Y75-I77 WeakPolarHBondContact O-CG2 3.37Å; Y75-I77 PolarHBondContact O-N 2.92Å; I77-V88 HydrophobicContact CB-CG1 3.93Å; I77-V88 HydrophobicContact CD1-CG1 4.15Å; I77-V88 HydrophobicContact CG2-CG1 4.18Å; I77-H89 CarbonylContact C-O 3.58Å; I77-H89 WeakPolarHBondContact CA-O 3.08Å; I77-I97 HydrophobicContact CG2-CD1 3.76Å; I77-L123 HydrophobicContact CD1-CD2 3.85Å; I77-W138 HydrophobicContact CD1-CD2 3.92Å; I77-W138 HydrophobicContact CD1-CE3 4.13Å; I77-W138 HydrophobicContact CD1-CH2 4.05Å; I77-W138 HydrophobicContact CD1-CZ2 3.82Å; I77-W138 HydrophobicContact CD1-CZ3 4.21Å; I77-W138 HydrophobicContact CG2-CH2 4.2Å; I77-W138 HydrophobicContact CG2-CZ2 3.78Å
78	L	94.5	Very high	92.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	117.1	171.9	177.1	66.8	0	0	0	108.8	L29 L37 L69 V71 H89 L91 F94	L29-L78 HydrophobicContact CD1-CD1 3.72Å; L29-L78 HydrophobicContact CD1-CD2 4.04Å; L37-L78 HydrophobicContact CD2-CD2 3.67Å; L69-L78 HydrophobicContact CD2-CD1 4.16Å; L69-L78 HydrophobicContact CD2-CD2 4.32Å; L69-L78 HydrophobicContact CD2-CG 4.37Å; V71-L78 HydrophobicContact CG2-CD1 3.76Å; L78-H89 HydrophobicContact CB-CB 4.42Å; L78-H89 PolarHBondContact N-O 2.83Å; L78-H89 PolarHBondContact O-N 3.45Å; L78-L91 HydrophobicContact CB-CD1 4.07Å; L78-F94 HydrophobicContact CD2-CD1 4.16Å; L78-F94 HydrophobicContact CD2-CE1 4.17Å
79	V	95.2	Very high	92.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	128.2	173.4	-172.9	0	0	0	0	108.5	L69 Y70 I86 F109 M125 F143	L69-V79 WeakPolarHBondContact CA-O 3.4Å; Y70-V79 PolarHBondContact N-O 2.86Å; Y70-V79 PolarHBondContact O-N 2.85Å; V79-I86 HydrophobicContact CG1-CG2 3.69Å; V79-F109 HydrophobicContact CB-CE2 4.04Å; V79-F109 HydrophobicContact CB-CZ 4.13Å; V79-F109 HydrophobicContact CG1-CD2 4.17Å; V79-F109 HydrophobicContact CG1-CE1 4.37Å; V79-F109 HydrophobicContact CG1-CE2 3.68Å; V79-F109 HydrophobicContact CG1-CZ 3.79Å; V79-M125 HydrophobicContact CG1-SD 3.97Å; V79-F143 HydrophobicContact CG2-CE2 4.18Å; V79-F143 HydrophobicContact CG2-CZ 4.29Å
80	S	94.1	Very high	92.6	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	136.7	-176.6	58.8	0	0	0	0	111.6	Q68 H87 H89	Q68-S80 WeakPolarHBondContact O-CA 3.46Å; S80-H87 PolarHBondContact N-O 2.76Å; S80-H87 PolarHBondContact O-N 3.42Å; S80-H87 PolarHBondContact OG-O 3.31Å; S80-H89 PolarHBondContact OG-CE1 3.33Å; S80-H89 VanDerWaalsContact OG-CE1 3.27Å; S80-H89 PolarHBondContact OG-ND1 3.11Å
81	L	93.5	Very high	92.4	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.005	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	113	173.1	178.5	61.8	0	0	0	110.2	Q67 Q68 N85 I86 A106 F109	Q67-L81 HydrophobicContact CB-CB 4.39Å; Q67-L81 HydrophobicContact CB-CD2 4.09Å; Q67-L81 HydrophobicContact CB-CG 4.11Å; Q67-L81 PolarHBondContact N-O 2.9Å; Q68-L81 HydrophobicContact CB-CB 4.11Å; Q68-L81 PolarHBondContact O-N 2.85Å; L81-N85 WeakPolarHBondContact CA-O 3.4Å; L81-I86 HydrophobicContact CB-CD1 4.21Å; L81-I86 HydrophobicContact CD1-CD1 3.74Å; L81-I86 HydrophobicContact CG-CD1 4.5Å; L81-A106 HydrophobicContact CD1-CB 3.79Å; L81-F109 HydrophobicContact CB-CD1 4.03Å; L81-F109 HydrophobicContact CB-CE1 3.89Å
82	L	90.2	Very high	92	Very high	12 Å²	12	33.6 Å²	33.6	6%	0.063	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	126.5	-175.7	-57.7	164.2	0	0	0	109.3	F62 I66 N84 N85 H87	F62-L82 HydrophobicContact CD1-CD1 3.47Å; F62-L82 VanDerWaalsContact CD1-CD1 3.47Å; F62-L82 HydrophobicContact CD1-CD2 3.82Å; F62-L82 HydrophobicContact CD1-CG 4.24Å; F62-L82 HydrophobicContact CE1-CD1 3.88Å; I66-L82 HydrophobicContact CB-CD2 4.08Å; I66-L82 HydrophobicContact CG1-CD2 3.76Å; I66-L82 HydrophobicContact CG2-CD2 4.09Å; L82-N84 PolarHBondContact O-N 2.78Å; L82-N85 PolarHBondContact N-O 2.82Å; L82-N85 PolarHBondContact O-N 2.96Å; L82-H87 HydrophobicContact CD1-CB 4.25Å
83	E	86.4	Confident	91.8	Very high	107 Å²	107	36.7 Å²	36.7	50%	0.5	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	46	40.4	179.5	-61.6	-163.9	144.2	0	0	114.3	K64 N85	K64-E83 HydrophobicContact CB-CG 4.06Å; K64-E83 HydrophobicContact CD-CG 4.43Å; K64-E83 WeakPolarHBondContact CD-OE1 3.37Å; K64-E83 WeakPolarHBondContact CE-OE1 3.5Å; K64-E83 HydrophobicContact CG-CG 3.98Å; K64-E83 WeakPolarHBondContact CG-OE1 3.41Å; K64-E83 IonicContact NZ-OE1 2.77Å; K64-E83 PolarHBondContact NZ-OE1 2.87Å; E83-N85 VanDerWaalsContact C-N 3.28Å; E83-N85 PolarHBondContact O-N 2.93Å
84	N	90.6	Very high	91.8	Very high	71 Å²	71	35.7 Å²	35.7	38%	0.38	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	64	25.7	-177.3	-46.4	-27	0	0	0	114.7	Q67 L82 G105 A106	Q67-N84 PolarHBondContact NE2-OD1 3.29Å; L82-N84 PolarHBondContact O-N 2.78Å; N84-G105 CarbonylContact O-C 3.6Å; N84-G105 WeakPolarHBondContact O-CA 3.09Å; N84-G105 PolarHBondContact O-N 2.95Å; N84-A106 WeakPolarHBondContact CA-O 3.42Å; N84-A106 WeakPolarHBondContact CB-O 3.31Å; N84-A106 PolarHBondContact O-N 2.85Å
85	N	92.6	Very high	91.9	Very high	36 Å²	36	37.8 Å²	37.8	19%	0.193	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	147.2	170.4	-62.1	-53.8	0	0	0	110.2	L81 L82 E83 H87 K104	L81-N85 WeakPolarHBondContact CA-O 3.4Å; L82-N85 PolarHBondContact N-O 2.82Å; L82-N85 PolarHBondContact O-N 2.96Å; E83-N85 VanDerWaalsContact C-N 3.28Å; E83-N85 PolarHBondContact O-N 2.93Å; N85-H87 PolarHBondContact O-CD2 3.11Å; N85-K104 WeakPolarHBondContact OD1-CA 3.3Å; N85-K104 WeakPolarHBondContact OD1-CG 3.46Å
86	I	94.9	Very high	91.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	117.1	174.4	-57.7	-66.8	0	0	0	108.9	V79 L81 V100 A103 A106 F109 M125 V127	V79-I86 HydrophobicContact CG1-CG2 3.69Å; L81-I86 HydrophobicContact CB-CD1 4.21Å; L81-I86 HydrophobicContact CD1-CD1 3.74Å; L81-I86 HydrophobicContact CG-CD1 4.5Å; I86-V100 HydrophobicContact CB-CB 4.17Å; I86-V100 HydrophobicContact CB-CG2 4.18Å; I86-V100 HydrophobicContact CG2-CG2 3.97Å; I86-V100 PolarHBondContact O-N 3.24Å; I86-A103 HydrophobicContact CG1-CB 4.38Å; I86-A106 HydrophobicContact CD1-CB 4.19Å; I86-A106 HydrophobicContact CG1-CB 4.04Å; I86-F109 HydrophobicContact CD1-CB 3.94Å; I86-F109 HydrophobicContact CD1-CD1 3.53Å; I86-F109 HydrophobicContact CD1-CE1 4.28Å; I86-F109 HydrophobicContact CD1-CG 3.91Å; I86-M125 HydrophobicContact CG2-CE 4.05Å; I86-M125 HydrophobicContact CG2-SD 4.09Å; I86-V127 HydrophobicContact CD1-CG1 4.31Å; I86-V127 HydrophobicContact CG1-CG1 3.97Å; I86-V127 HydrophobicContact CG1-CG2 4.25Å
87	H	93.4	Very high	92	Very high	31 Å²	31	38 Å²	38	14%	0.144	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	140	175.4	-63.1	-107.8	0	0	0	109.8	S80 L82 N85 H89 Q96	S80-H87 PolarHBondContact N-O 2.76Å; S80-H87 PolarHBondContact O-N 3.42Å; S80-H87 PolarHBondContact OG-O 3.31Å; L82-H87 HydrophobicContact CD1-CB 4.25Å; N85-H87 PolarHBondContact O-CD2 3.11Å; H87-H89 WeakPolarHBondContact CB-CE1 3.41Å; H87-Q96 PolarHBondContact ND1-OE1 3.05Å
88	V	94.9	Very high	91.9	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	123.8	173.8	-171.3	0	0	0	0	108.4	I77 I97 T98 W138 F143	I77-V88 HydrophobicContact CB-CG1 3.93Å; I77-V88 HydrophobicContact CD1-CG1 4.15Å; I77-V88 HydrophobicContact CG2-CG1 4.18Å; V88-I97 HydrophobicContact CG1-CD1 4.5Å; V88-I97 PolarHBondContact O-N 2.69Å; V88-T98 HydrophobicContact CB-CG2 3.9Å; V88-T98 HydrophobicContact CG2-CG2 3.91Å; V88-T98 PolarHBondContact N-O 3.04Å; V88-T98 PolarHBondContact O-N 2.89Å; V88-W138 HydrophobicContact CB-CZ3 4.46Å; V88-W138 HydrophobicContact CG1-CH2 3.74Å; V88-W138 HydrophobicContact CG1-CZ3 3.9Å; V88-W138 HydrophobicContact CG2-CZ3 4.22Å; V88-F143 HydrophobicContact CG2-CD2 3.72Å; V88-F143 HydrophobicContact CG2-CE2 3.58Å
89	H	93.9	Very high	91.9	Very high	13 Å²	13	41 Å²	41	6%	0.06	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	154.7	179	-57.8	87.2	0	0	0	110.2	F62 I77 L78 S80 H87 F94 Q95	F62-H89 AromaticContact CE1-CE1 3.52Å; F62-H89 AromaticContact CE1-ND1 3.93Å; F62-H89 AromaticContact CE1-NE2 3.92Å; F62-H89 AromaticContact CZ-CE1 3.88Å; F62-H89 AromaticContact CZ-NE2 3.98Å; I77-H89 CarbonylContact C-O 3.58Å; I77-H89 WeakPolarHBondContact CA-O 3.08Å; L78-H89 HydrophobicContact CB-CB 4.42Å; L78-H89 PolarHBondContact N-O 2.83Å; L78-H89 PolarHBondContact O-N 3.45Å; S80-H89 PolarHBondContact OG-CE1 3.33Å; S80-H89 VanDerWaalsContact OG-CE1 3.27Å; S80-H89 PolarHBondContact OG-ND1 3.11Å; H87-H89 WeakPolarHBondContact CB-CE1 3.41Å; H89-F94 PolarHBondContact CD2-O 2.8Å; H89-Q95 CarbonylContact C-O 3.55Å; H89-Q95 VanDerWaalsContact CA-O 3.25Å; H89-Q95 WeakPolarHBondContact CA-O 3.43Å
90	D	92.8	Very high	91.8	Very high	46 Å²	46	41.4 Å²	41.4	25%	0.246	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	131.2	165	176.7	-88.4	0	0	0	109.4	L92 T93 F94 Q95 I97	D90-L92 VanDerWaalsContact C-N 3.27Å; D90-L92 PolarHBondContact O-N 2.79Å; D90-L92 PolarHBondContact OD1-N 2.87Å; D90-L92 VanDerWaalsContact OD1-N 3.13Å; D90-T93 VanDerWaalsContact CB-OG1 3.27Å; D90-T93 WeakPolarHBondContact CB-OG1 3.23Å; D90-T93 VanDerWaalsContact CG-OG1 3.23Å; D90-T93 WeakPolarHBondContact OD1-CB 3.48Å; D90-T93 PolarHBondContact OD1-N 2.87Å; D90-T93 PolarHBondContact OD1-OG1 2.85Å; D90-F94 WeakPolarHBondContact O-CA 3.42Å; D90-F94 PolarHBondContact O-N 2.98Å; D90-Q95 PolarHBondContact N-O 3.39Å; D90-I97 HydrophobicContact CB-CD1 4.12Å; D90-I97 HydrophobicContact CB-CG1 4.3Å
91	L	90.3	Very high	91.5	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-28.7	-170.4	-177.8	62	0	0	0	113.2	W24 L29 V71 K76 L78 F94	W24-L91 HydrophobicContact CD2-CD1 4.38Å; W24-L91 HydrophobicContact CD2-CD2 4.05Å; W24-L91 HydrophobicContact CD2-CG 4.47Å; W24-L91 HydrophobicContact CE3-CD1 4.02Å; W24-L91 HydrophobicContact CG-CD2 4.43Å; W24-L91 HydrophobicContact CH2-CD1 3.8Å; W24-L91 HydrophobicContact CH2-CG 3.94Å; W24-L91 HydrophobicContact CZ2-CD1 4.23Å; W24-L91 HydrophobicContact CZ2-CD2 4.1Å; W24-L91 HydrophobicContact CZ2-CG 3.89Å; W24-L91 HydrophobicContact CZ3-CD1 3.7Å; W24-L91 HydrophobicContact CZ3-CG 4.28Å; L29-L91 HydrophobicContact CD1-CD1 4.4Å; V71-L91 HydrophobicContact CB-CD1 4.37Å; V71-L91 HydrophobicContact CG1-CD1 3.68Å; V71-L91 HydrophobicContact CG1-CD2 3.71Å; V71-L91 HydrophobicContact CG1-CG 4.36Å; V71-L91 HydrophobicContact CG2-CD1 3.91Å; K76-L91 VanDerWaalsContact C-CB 3.43Å; K76-L91 WeakPolarHBondContact O-CB 3.5Å; K76-L91 PolarHBondContact O-N 3.04Å; L78-L91 HydrophobicContact CB-CD1 4.07Å; L91-F94 WeakPolarHBondContact O-CE1 2.89Å
92	L	86.1	Confident	91.3	Very high	86 Å²	86	52 Å²	52	45%	0.45	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-40.7	-174.7	-62.9	178.6	0	0	0	112.2	W24 K57 D90	W24-L92 HydrophobicContact CZ2-CD2 4.37Å; K57-L92 PolarHBondContact NZ-O 2.89Å; D90-L92 VanDerWaalsContact C-N 3.27Å; D90-L92 PolarHBondContact O-N 2.79Å; D90-L92 PolarHBondContact OD1-N 2.87Å; D90-L92 VanDerWaalsContact OD1-N 3.13Å
93	T	88.2	Confident	91.4	Very high	68 Å²	68	51.5 Å²	51.5	42%	0.417	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-18.8	-176.8	64	0	0	0	0	112.9	D90 Q95	D90-T93 VanDerWaalsContact CB-OG1 3.27Å; D90-T93 WeakPolarHBondContact CB-OG1 3.23Å; D90-T93 VanDerWaalsContact CG-OG1 3.23Å; D90-T93 WeakPolarHBondContact OD1-CB 3.48Å; D90-T93 PolarHBondContact OD1-N 2.87Å; D90-T93 PolarHBondContact OD1-OG1 2.85Å; T93-Q95 PolarHBondContact O-N 2.83Å; T93-Q95 PolarHBondContact OG1-N 2.89Å
94	F	89.8	Confident	91.7	Very high	11 Å²	11	54 Å²	54	5%	0.048	28%	0.276	C	S	.	.			trans	56.1	20.4	-170.9	-52.3	-47.3	0	0	0	114	L29 L37 L39 K57 N59 L78 H89 D90 L91	L29-F94 HydrophobicContact CD2-CE1 3.92Å; L29-F94 HydrophobicContact CD2-CZ 3.63Å; L37-F94 HydrophobicContact CD2-CD1 3.89Å; L37-F94 HydrophobicContact CD2-CD2 4.49Å; L37-F94 HydrophobicContact CD2-CE1 3.82Å; L37-F94 HydrophobicContact CD2-CE2 4.41Å; L37-F94 HydrophobicContact CD2-CG 4.24Å; L37-F94 HydrophobicContact CD2-CZ 4.1Å; L39-F94 HydrophobicContact CB-CE2 4.14Å; L39-F94 HydrophobicContact CB-CZ 3.97Å; L39-F94 HydrophobicContact CD1-CZ 4.44Å; L39-F94 HydrophobicContact CD2-CE2 4.28Å; L39-F94 HydrophobicContact CD2-CZ 3.95Å; L39-F94 HydrophobicContact CG-CZ 4.34Å; K57-F94 HydrophobicContact CB-CE2 4.16Å; K57-F94 HydrophobicContact CD-CE2 4.28Å; N59-F94 HydrophobicContact CB-CD2 4.06Å; N59-F94 VanDerWaalsContact ND2-CB 3.27Å; N59-F94 WeakPolarHBondContact ND2-CB 3.44Å; L78-F94 HydrophobicContact CD2-CD1 4.16Å; L78-F94 HydrophobicContact CD2-CE1 4.17Å; H89-F94 PolarHBondContact CD2-O 2.8Å; D90-F94 WeakPolarHBondContact O-CA 3.42Å; D90-F94 PolarHBondContact O-N 2.98Å; L91-F94 WeakPolarHBondContact O-CE1 2.89Å
95	Q	90.3	Very high	91.7	Very high	139 Å²	139	51.6 Å²	51.6	65%	0.65	27%	0.269	S	S	*	.			trans	-71.8	136.7	169.8	-69.7	-173.6	-5.7	0	0	109.3	H89 D90 T93 I97	H89-Q95 CarbonylContact C-O 3.55Å; H89-Q95 VanDerWaalsContact CA-O 3.25Å; H89-Q95 WeakPolarHBondContact CA-O 3.43Å; D90-Q95 PolarHBondContact N-O 3.39Å; T93-Q95 PolarHBondContact O-N 2.83Å; T93-Q95 PolarHBondContact OG1-N 2.89Å; Q95-I97 PolarHBondContact O-N 2.96Å
96	Q	91.5	Very high	91.8	Very high	112 Å²	112	49.9 Å²	49.9	52%	0.523	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	124.1	177.7	-171.2	-177.8	-90.9	0	0	109.5	H87 V99	H87-Q96 PolarHBondContact ND1-OE1 3.05Å; Q96-V99 VanDerWaalsContact CD-CG2 3.49Å; Q96-V99 HydrophobicContact CG-CG2 4.3Å
97	I	93.5	Very high	91.8	Very high	60 Å²	60	52.6 Å²	52.6	31%	0.308	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-55.4	175.6	-60.8	172.6	0	0	0	109.1	I77 V88 D90 Q95 W138 R141	I77-I97 HydrophobicContact CG2-CD1 3.76Å; V88-I97 HydrophobicContact CG1-CD1 4.5Å; V88-I97 PolarHBondContact O-N 2.69Å; D90-I97 HydrophobicContact CB-CD1 4.12Å; D90-I97 HydrophobicContact CB-CG1 4.3Å; Q95-I97 PolarHBondContact O-N 2.96Å; I97-W138 HydrophobicContact CG2-CH2 4.5Å; I97-R141 HydrophobicContact CG2-CB 4.11Å
98	T	93.9	Very high	91.8	Very high	21 Å²	21	52.4 Å²	52.4	13%	0.129	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	165.4	-177.6	-168.1	0	0	0	0	111.8	V88 W138 E142	V88-T98 HydrophobicContact CB-CG2 3.9Å; V88-T98 HydrophobicContact CG2-CG2 3.91Å; V88-T98 PolarHBondContact N-O 3.04Å; V88-T98 PolarHBondContact O-N 2.89Å; T98-W138 HydrophobicContact CG2-CZ3 4.33Å; T98-E142 HydrophobicContact CG2-CG 4.5Å
99	V	92.9	Very high	91.9	Very high	46 Å²	46	52.5 Å²	52.5	28%	0.279	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	128.8	173.7	-177.9	0	0	0	0	108	Q96 S101	Q96-V99 VanDerWaalsContact CD-CG2 3.49Å; Q96-V99 HydrophobicContact CG-CG2 4.3Å; V99-S101 PolarHBondContact O-N 3.28Å
100	V	94	Very high	91.9	Very high	10 Å²	10	52.3 Å²	52.3	6%	0.061	28%	0.278	C	S	.	.			trans	-78.7	79.8	178.8	-168.4	0	0	0	0	108.9	I86 K102 A103 M125 Y136 F143	I86-V100 HydrophobicContact CB-CB 4.17Å; I86-V100 HydrophobicContact CB-CG2 4.18Å; I86-V100 HydrophobicContact CG2-CG2 3.97Å; I86-V100 PolarHBondContact O-N 3.24Å; V100-K102 VanDerWaalsContact C-N 3.25Å; V100-K102 PolarHBondContact O-N 2.9Å; V100-A103 HydrophobicContact CB-CB 4.15Å; V100-A103 HydrophobicContact CG1-CB 3.8Å; V100-A103 WeakPolarHBondContact O-CB 3.38Å; V100-A103 PolarHBondContact O-N 2.91Å; V100-M125 HydrophobicContact CG2-CE 4.22Å; V100-Y136 HydrophobicContact CG1-CD1 4.14Å; V100-Y136 HydrophobicContact CG1-CE1 3.63Å; V100-Y136 HydrophobicContact CG1-CE2 4.15Å; V100-F143 HydrophobicContact CG2-CB 3.94Å; V100-F143 HydrophobicContact CG2-CD2 3.85Å; V100-F143 HydrophobicContact CG2-CG 4.27Å
101	S	88.4	Confident	92	Very high	95 Å²	95	50.7 Å²	50.7	66%	0.664	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-59	-33	-172.4	58.6	0	0	0	0	113.7	V99 A103 K104	V99-S101 PolarHBondContact O-N 3.28Å; S101-A103 PolarHBondContact O-N 2.99Å; S101-K104 WeakPolarHBondContact O-CB 3.5Å; S101-K104 PolarHBondContact O-N 2.76Å
102	K	89.1	Confident	92	Very high	129 Å²	129	52.4 Å²	52.4	56%	0.561	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-64.1	-24.3	174.2	-73.9	-174.2	172.7	-177.4	0	113.6	V100 K104 Q134 Y136 E145	V100-K102 VanDerWaalsContact C-N 3.25Å; V100-K102 PolarHBondContact O-N 2.9Å; K102-K104 VanDerWaalsContact C-N 3.3Å; K102-K104 PolarHBondContact O-N 3.08Å; K102-Q134 PolarHBondContact O-OE1 3.22Å; K102-Y136 WeakPolarHBondContact CB-OH 3.28Å; K102-E145 IonicContact NZ-OE2 2.69Å; K102-E145 PolarHBondContact NZ-OE2 2.97Å
103	A	92.1	Very high	92.2	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-91.9	21.6	179.8	0	0	0	0	0	113.4	I86 V100 S101 G105 A106 V127 V129 Y136	I86-A103 HydrophobicContact CG1-CB 4.38Å; V100-A103 HydrophobicContact CB-CB 4.15Å; V100-A103 HydrophobicContact CG1-CB 3.8Å; V100-A103 WeakPolarHBondContact O-CB 3.38Å; V100-A103 PolarHBondContact O-N 2.91Å; S101-A103 PolarHBondContact O-N 2.99Å; A103-G105 PolarHBondContact O-N 2.93Å; A103-A106 VanDerWaalsContact O-CB 3.32Å; A103-A106 WeakPolarHBondContact O-CB 3.42Å; A103-A106 PolarHBondContact O-N 2.81Å; A103-A106 VanDerWaalsContact O-N 3.11Å; A103-V127 HydrophobicContact CB-CG1 4.06Å; A103-V129 HydrophobicContact CB-CG2 4.45Å; A103-Y136 HydrophobicContact CB-CE2 4.33Å
104	K	91.9	Very high	91.9	Very high	159 Å²	159	50.1 Å²	50.1	69%	0.691	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	126.3	177.2	-178.1	171	-173	179.5	0	111.1	N85 S101 K102	N85-K104 WeakPolarHBondContact OD1-CA 3.3Å; N85-K104 WeakPolarHBondContact OD1-CG 3.46Å; S101-K104 WeakPolarHBondContact O-CB 3.5Å; S101-K104 PolarHBondContact O-N 2.76Å; K102-K104 VanDerWaalsContact C-N 3.3Å; K102-K104 PolarHBondContact O-N 3.08Å
105	G	92	Very high	91.3	Very high	22 Å²	22	56.6 Å²	56.6	23%	0.227	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.1	17.7	-171.4	0	0	0	0	0	113.8	N84 A103	N84-G105 CarbonylContact O-C 3.6Å; N84-G105 WeakPolarHBondContact O-CA 3.09Å; N84-G105 PolarHBondContact O-N 2.95Å; A103-G105 PolarHBondContact O-N 2.93Å
106	A	94.6	Very high	90.3	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	137.3	173.8	0	0	0	0	0	111.7	L81 N84 I86 A103 V127 A128 V129	L81-A106 HydrophobicContact CD1-CB 3.79Å; N84-A106 WeakPolarHBondContact CA-O 3.42Å; N84-A106 WeakPolarHBondContact CB-O 3.31Å; N84-A106 PolarHBondContact O-N 2.85Å; I86-A106 HydrophobicContact CD1-CB 4.19Å; I86-A106 HydrophobicContact CG1-CB 4.04Å; A103-A106 VanDerWaalsContact O-CB 3.32Å; A103-A106 WeakPolarHBondContact O-CB 3.42Å; A103-A106 PolarHBondContact O-N 2.81Å; A103-A106 VanDerWaalsContact O-N 3.11Å; A106-V127 HydrophobicContact CB-CG1 3.5Å; A106-A128 CarbonylContact C-O 3.54Å; A106-A128 VanDerWaalsContact CA-O 3.27Å; A106-A128 WeakPolarHBondContact CA-O 2.97Å; A106-V129 HydrophobicContact CB-CG2 4.4Å
107	T	93.9	Very high	89	Confident	56 Å²	56	53.9 Å²	53.9	34%	0.344	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	-22.2	176.4	54	0	0	0	0	113	A128	T107-A128 PolarHBondContact N-O 2.89Å; T107-A128 PolarHBondContact OG1-O 2.88Å
108	L	94.6	Very high	87.8	Confident	27 Å²	27	55.1 Å²	55.1	14%	0.141	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	147.9	-175.1	179.8	69.5	0	0	0	108.9	A128 S158 M159	L108-A128 HydrophobicContact CB-CB 4.16Å; L108-A128 PolarHBondContact O-N 2.85Å; L108-S158 VanDerWaalsContact CD2-CA 3.5Å; L108-M159 HydrophobicContact CD2-CB 4.08Å; L108-M159 HydrophobicContact CD2-CG 3.52Å; L108-M159 HydrophobicContact CD2-SD 3.64Å; L108-M159 HydrophobicContact CG-CG 4.02Å; L108-M159 HydrophobicContact CG-SD 3.93Å
109	F	96.2	Very high	86.7	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.009	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	161.6	167.5	74.3	-87.7	0	0	0	111.5	Q68 Y70 V79 L81 I86 M125 C126 V127	Q68-F109 HydrophobicContact CB-CD1 4.33Å; Q68-F109 HydrophobicContact CB-CE1 3.71Å; Q68-F109 HydrophobicContact CB-CZ 4.43Å; Q68-F109 HydrophobicContact CG-CD1 4.23Å; Q68-F109 HydrophobicContact CG-CE1 3.6Å; Q68-F109 HydrophobicContact CG-CZ 3.93Å; Q68-F109 PolarHBondContact NE2-O 3.35Å; Q68-F109 PolarHBondContact OE1-O 2.81Å; Y70-F109 HydrophobicContact CG-CE2 4.33Å; V79-F109 HydrophobicContact CB-CE2 4.04Å; V79-F109 HydrophobicContact CB-CZ 4.13Å; V79-F109 HydrophobicContact CG1-CD2 4.17Å; V79-F109 HydrophobicContact CG1-CE1 4.37Å; V79-F109 HydrophobicContact CG1-CE2 3.68Å; V79-F109 HydrophobicContact CG1-CZ 3.79Å; L81-F109 HydrophobicContact CB-CD1 4.03Å; L81-F109 HydrophobicContact CB-CE1 3.89Å; I86-F109 HydrophobicContact CD1-CB 3.94Å; I86-F109 HydrophobicContact CD1-CD1 3.53Å; I86-F109 HydrophobicContact CD1-CE1 4.28Å; I86-F109 HydrophobicContact CD1-CG 3.91Å; F109-M125 HydrophobicContact CB-CG 4.4Å; F109-M125 HydrophobicContact CB-SD 4.38Å; F109-M125 HydrophobicContact CD2-CG 4.35Å; F109-M125 HydrophobicContact CD2-SD 4.08Å; F109-M125 HydrophobicContact CG-SD 4.45Å; F109-C126 CarbonylContact C-O 3.48Å; F109-C126 VanDerWaalsContact CA-O 3.22Å; F109-C126 WeakPolarHBondContact CA-O 3.27Å; F109-C126 WeakPolarHBondContact CB-O 3.45Å; F109-V127 HydrophobicContact CB-CG2 4.16Å
110	A	94.9	Very high	85.9	Confident	10 Å²	10	61.4 Å²	61.4	8%	0.083	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	130.1	175.6	0	0	0	0	0	108.1	M125 C126 M159 W161	A110-M125 WeakPolarHBondContact O-CA 3.43Å; A110-C126 PolarHBondContact N-O 2.87Å; A110-C126 PolarHBondContact O-N 2.89Å; A110-M159 HydrophobicContact CB-CE 3.62Å; A110-M159 HydrophobicContact CB-CG 3.81Å; A110-M159 VanDerWaalsContact N-CE 3.33Å; A110-W161 PolarHBondContact O-NE1 3.1Å
111	C	93.8	Very high	85.5	Confident	12 Å²	12	64.4 Å²	64.4	8%	0.081	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	149.4	179.4	-67.2	0	0	0	0	110	Y70 L123 R124	Y70-C111 HydrophobicContact CD1-CB 3.59Å; Y70-C111 HydrophobicContact CD2-CB 4.36Å; Y70-C111 HydrophobicContact CE1-CB 3.41Å; Y70-C111 VanDerWaalsContact CE1-CB 3.41Å; Y70-C111 HydrophobicContact CE2-CB 4.21Å; Y70-C111 HydrophobicContact CG-CB 4.07Å; C111-L123 HydrophobicContact CB-CD1 4.08Å; C111-R124 CarbonylContact C-O 3.52Å; C111-R124 WeakPolarHBondContact CA-O 3.37Å
112	D	91.5	Very high	85.5	Confident	36 Å²	36	61.4 Å²	61.4	19%	0.193	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	129.7	175.9	173.3	48.3	0	0	0	109	R124 W161	D112-R124 PolarHBondContact N-O 2.84Å; D112-R124 PolarHBondContact O-N 2.82Å; D112-R124 IonicContact OD2-CZ 2.69Å; D112-R124 IonicContact OD2-NE 3.82Å; D112-R124 IonicContact OD2-NH2 2.86Å; D112-R124 PolarHBondContact OD2-NH2 3.41Å; D112-W161 HydrophobicContact CB-CB 3.93Å; D112-W161 HydrophobicContact CB-CD2 3.77Å; D112-W161 HydrophobicContact CB-CE3 4.4Å; D112-W161 HydrophobicContact CB-CG 3.51Å
113	L	88.5	Confident	85.7	Confident	49 Å²	49	55.3 Å²	55.3	26%	0.257	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	101.2	178.6	-173.7	73.4	0	0	0	108.2	V72 Q74 Y75 E121 L123	V72-L113 HydrophobicContact CG1-CD1 4.49Å; Q74-L113 HydrophobicContact CB-CD2 4.45Å; Q74-L113 HydrophobicContact CG-CD2 3.85Å; Y75-L113 HydrophobicContact CD2-CD1 4.36Å; Y75-L113 HydrophobicContact CE2-CD1 3.73Å; L113-E121 HydrophobicContact CD1-CB 4.31Å; L113-L123 HydrophobicContact CD1-CB 3.99Å
114	Q	81.8	Confident	85.7	Confident	57 Å²	57	56.5 Å²	56.5	27%	0.266	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	146.2	177.8	-97.7	-171.6	-5.9	0	0	111.5	E121 S122 R124	Q114-E121 CarbonylContact O-C 3.55Å; Q114-E121 WeakPolarHBondContact O-CA 3.43Å; Q114-S122 PolarHBondContact N-O 2.87Å; Q114-S122 PolarHBondContact O-N 3.35Å; Q114-R124 VanDerWaalsContact OE1-NH2 3.1Å
115	Q	77.9	Confident	85.9	Confident	147 Å²	147	48.9 Å²	48.9	69%	0.687	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.2	121.8	160.6	-78	175.6	0	0	0	108.6	E121	Q115-E121 HydrophobicContact CG-CG 4.11Å
116	T	68.8	Low	86.1	Confident	52 Å²	52	47.9 Å²	47.9	32%	0.319	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-72.9	162.2	174.2	62.9	0	0	0	0	110.5	S118 G119 E120	T116-S118 PolarHBondContact O-N 2.9Å; T116-S118 PolarHBondContact OG1-OG 2.94Å; T116-G119 PolarHBondContact O-N 2.64Å; T116-E120 WeakPolarHBondContact CB-O 3.42Å; T116-E120 WeakPolarHBondContact CG2-O 3.47Å; T116-E120 PolarHBondContact N-O 3.49Å; T116-E120 PolarHBondContact OG1-N 3.09Å; T116-E120 PolarHBondContact OG1-O 3.37Å
117	S	65.8	Low	86.2	Confident	141 Å²	141	47.9 Å²	47.9	99%	0.986	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-18	175.1	50.1	0	0	0	0	114	G119	S117-G119 VanDerWaalsContact C-N 3.32Å
118	S	66.9	Low	86.3	Confident	86 Å²	86	45.2 Å²	45.2	60%	0.601	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-6	174	71.8	0	0	0	0	114.1	T116 E120	T116-S118 PolarHBondContact O-N 2.9Å; T116-S118 PolarHBondContact OG1-OG 2.94Å; S118-E120 VanDerWaalsContact C-N 3.27Å
119	G	70.7	Confident	86.3	Confident	57 Å²	57	44.7 Å²	44.7	59%	0.588	26%	0.262	S	S	*	.	S	Bend	trans	84.2	-7	-173.8	0	0	0	0	0	114.2	T116 S117	T116-G119 PolarHBondContact O-N 2.64Å; S117-G119 VanDerWaalsContact C-N 3.32Å
120	E	77.5	Confident	86.1	Confident	142 Å²	142	52.1 Å²	52.1	66%	0.664	29%	0.294	S	S	*	.			trans	-74.7	131.8	174	-66.4	-172.9	167.1	0	0	110.9	T116 S118	T116-E120 WeakPolarHBondContact CB-O 3.42Å; T116-E120 WeakPolarHBondContact CG2-O 3.47Å; T116-E120 PolarHBondContact N-O 3.49Å; T116-E120 PolarHBondContact OG1-N 3.09Å; T116-E120 PolarHBondContact OG1-O 3.37Å; S118-E120 VanDerWaalsContact C-N 3.27Å
121	E	84.1	Confident	86	Confident	73 Å²	73	58.8 Å²	58.8	34%	0.341	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	135.6	173.2	-63.9	-178.6	155	0	0	109.9	Q74 Y75 L113 Q114 Q115	Q74-E121 WeakPolarHBondContact CB-OE2 3.48Å; Q74-E121 VanDerWaalsContact CG-OE2 3.27Å; Q74-E121 WeakPolarHBondContact CG-OE2 3.33Å; Y75-E121 PolarHBondContact OH-O 2.86Å; L113-E121 HydrophobicContact CD1-CB 4.31Å; Q114-E121 CarbonylContact O-C 3.55Å; Q114-E121 WeakPolarHBondContact O-CA 3.43Å; Q115-E121 HydrophobicContact CG-CG 4.11Å
122	S	88.5	Confident	86	Confident	33 Å²	33	62.9 Å²	62.9	23%	0.231	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	116.2	178.5	171.4	0	0	0	0	109.6	Q114	Q114-S122 PolarHBondContact N-O 2.87Å; Q114-S122 PolarHBondContact O-N 3.35Å
123	L	93.6	Very high	86.1	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	125.1	174.4	172.5	71.1	0	0	0	110.1	V72 Y75 I77 C111 L113 Y137 W138 F143	V72-L123 HydrophobicContact CB-CD2 4.37Å; V72-L123 HydrophobicContact CG1-CD1 4.19Å; V72-L123 HydrophobicContact CG1-CD2 4.12Å; V72-L123 HydrophobicContact CG2-CD1 4.07Å; V72-L123 HydrophobicContact CG2-CD2 3.85Å; Y75-L123 HydrophobicContact CD2-CB 4.02Å; Y75-L123 HydrophobicContact CD2-CD2 4.27Å; Y75-L123 HydrophobicContact CE2-CB 3.59Å; I77-L123 HydrophobicContact CD1-CD2 3.85Å; C111-L123 HydrophobicContact CB-CD1 4.08Å; L113-L123 HydrophobicContact CD1-CB 3.99Å; L123-Y137 CarbonylContact O-C 3.6Å; L123-Y137 WeakPolarHBondContact O-CA 3.41Å; L123-W138 HydrophobicContact CB-CB 3.85Å; L123-W138 HydrophobicContact CD2-CB 3.88Å; L123-W138 HydrophobicContact CD2-CG 4.14Å; L123-W138 HydrophobicContact CG-CB 4.14Å; L123-W138 PolarHBondContact O-N 3.39Å; L123-F143 HydrophobicContact CD2-CE1 4.12Å; L123-F143 HydrophobicContact CD2-CZ 3.86Å; L123-F143 HydrophobicContact CG-CE1 4.39Å
124	R	93.1	Very high	86.4	Confident	25 Å²	25	59.9 Å²	59.9	9%	0.094	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	148.3	171.9	-62	179	-61.1	172.5	14.3	110	C111 D112 Q114 Y136 W161	C111-R124 CarbonylContact C-O 3.52Å; C111-R124 WeakPolarHBondContact CA-O 3.37Å; D112-R124 PolarHBondContact N-O 2.84Å; D112-R124 PolarHBondContact O-N 2.82Å; D112-R124 IonicContact OD2-CZ 2.69Å; D112-R124 IonicContact OD2-NE 3.82Å; D112-R124 IonicContact OD2-NH2 2.86Å; D112-R124 PolarHBondContact OD2-NH2 3.41Å; Q114-R124 VanDerWaalsContact OE1-NH2 3.1Å; R124-Y136 CarbonylContact C-O 3.43Å; R124-Y136 VanDerWaalsContact CA-O 3.3Å; R124-Y136 WeakPolarHBondContact CA-O 3.28Å; R124-W161 HydrophobicContact CB-CH2 4.29Å; R124-W161 HydrophobicContact CB-CZ2 4.34Å
125	M	95.4	Very high	86.9	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	129.3	179.3	-179.9	177.8	60.9	0	0	109.5	V79 I86 V100 F109 A110 V127 Y136 F143	V79-M125 HydrophobicContact CG1-SD 3.97Å; I86-M125 HydrophobicContact CG2-CE 4.05Å; I86-M125 HydrophobicContact CG2-SD 4.09Å; V100-M125 HydrophobicContact CG2-CE 4.22Å; F109-M125 HydrophobicContact CB-CG 4.4Å; F109-M125 HydrophobicContact CB-SD 4.38Å; F109-M125 HydrophobicContact CD2-CG 4.35Å; F109-M125 HydrophobicContact CD2-SD 4.08Å; F109-M125 HydrophobicContact CG-SD 4.45Å; A110-M125 WeakPolarHBondContact O-CA 3.43Å; M125-V127 HydrophobicContact CE-CG2 3.73Å; M125-V127 HydrophobicContact CG-CG2 3.87Å; M125-V127 HydrophobicContact SD-CG2 3.94Å; M125-Y136 HydrophobicContact CE-CD2 4.18Å; M125-Y136 HydrophobicContact CE-CG 4.41Å; M125-Y136 PolarHBondContact N-O 2.85Å; M125-Y136 PolarHBondContact O-N 2.89Å; M125-F143 HydrophobicContact CB-CD1 4.37Å; M125-F143 HydrophobicContact CB-CE1 3.81Å; M125-F143 HydrophobicContact CB-CZ 4.22Å; M125-F143 HydrophobicContact CE-CB 4.47Å; M125-F143 HydrophobicContact CE-CD1 3.9Å; M125-F143 HydrophobicContact CE-CD2 3.69Å; M125-F143 HydrophobicContact CE-CE1 3.98Å; M125-F143 HydrophobicContact CE-CE2 3.77Å; M125-F143 HydrophobicContact CE-CG 3.76Å; M125-F143 HydrophobicContact CE-CZ 3.91Å; M125-F143 HydrophobicContact SD-CE1 4.48Å; M125-F143 HydrophobicContact SD-CE2 4.24Å; M125-F143 HydrophobicContact SD-CZ 4.11Å
126	C	95.4	Very high	87.7	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	136.5	167.5	-178.6	0	0	0	0	108	F109 A110 Q134 L135 M159 W161 I166	F109-C126 CarbonylContact C-O 3.48Å; F109-C126 VanDerWaalsContact CA-O 3.22Å; F109-C126 WeakPolarHBondContact CA-O 3.27Å; F109-C126 WeakPolarHBondContact CB-O 3.45Å; A110-C126 PolarHBondContact N-O 2.87Å; A110-C126 PolarHBondContact O-N 2.89Å; C126-Q134 CarbonylContact C-O 3.54Å; C126-Q134 WeakPolarHBondContact CA-O 3.21Å; C126-L135 HydrophobicContact CB-CD2 3.66Å; C126-M159 VanDerWaalsContact C-CE 3.42Å; C126-M159 HydrophobicContact CB-CE 3.57Å; C126-M159 WeakPolarHBondContact O-CE 3.22Å; C126-M159 VanDerWaalsContact SG-CE 3.54Å; C126-W161 HydrophobicContact CB-CH2 4.46Å; C126-W161 HydrophobicContact CB-CZ2 3.57Å; C126-I166 HydrophobicContact CB-CD1 3.77Å
127	V	96.5	Very high	88.9	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	127.4	178.7	-171.3	0	0	0	0	109.5	I86 A103 A106 F109 M125 V129 L133 Q134 Y136	I86-V127 HydrophobicContact CD1-CG1 4.31Å; I86-V127 HydrophobicContact CG1-CG1 3.97Å; I86-V127 HydrophobicContact CG1-CG2 4.25Å; A103-V127 HydrophobicContact CB-CG1 4.06Å; A106-V127 HydrophobicContact CB-CG1 3.5Å; F109-V127 HydrophobicContact CB-CG2 4.16Å; M125-V127 HydrophobicContact CE-CG2 3.73Å; M125-V127 HydrophobicContact CG-CG2 3.87Å; M125-V127 HydrophobicContact SD-CG2 3.94Å; V127-V129 HydrophobicContact CG1-CG2 4.16Å; V127-L133 WeakPolarHBondContact O-CA 3.04Å; V127-Q134 PolarHBondContact N-O 3.08Å; V127-Q134 PolarHBondContact O-N 3.16Å; V127-Y136 HydrophobicContact CB-CE2 4.26Å; V127-Y136 HydrophobicContact CG2-CD2 3.92Å; V127-Y136 HydrophobicContact CG2-CE2 3.93Å
128	A	96.3	Very high	90.3	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	119.9	174.3	0	0	0	0	0	110.5	A106 T107 L108 L133 P156 M159	A106-A128 CarbonylContact C-O 3.54Å; A106-A128 VanDerWaalsContact CA-O 3.27Å; A106-A128 WeakPolarHBondContact CA-O 2.97Å; T107-A128 PolarHBondContact N-O 2.89Å; T107-A128 PolarHBondContact OG1-O 2.88Å; L108-A128 HydrophobicContact CB-CB 4.16Å; L108-A128 PolarHBondContact O-N 2.85Å; A128-L133 HydrophobicContact CB-CD2 3.91Å; A128-P156 HydrophobicContact CB-CB 3.75Å; A128-P156 HydrophobicContact CB-CG 3.69Å; A128-M159 HydrophobicContact CB-SD 4.28Å
129	V	95.2	Very high	91.4	Very high	16 Å²	16	46.8 Å²	46.8	10%	0.097	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	104.4	176.5	-177.7	0	0	0	0	108.4	A103 A106 V127 R131 K132 Q134	A103-V129 HydrophobicContact CB-CG2 4.45Å; A106-V129 HydrophobicContact CB-CG2 4.4Å; V127-V129 HydrophobicContact CG1-CG2 4.16Å; V129-R131 PolarHBondContact O-N 2.93Å; V129-K132 PolarHBondContact N-O 3.39Å; V129-K132 PolarHBondContact O-N 3.2Å; V129-K132 VanDerWaalsContact O-N 3.11Å; V129-Q134 HydrophobicContact CG2-CG 4.44Å
130	K	91.6	Very high	92.3	Very high	158 Å²	158	50.2 Å²	50.2	69%	0.687	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.9	-119.3	-173.8	-55.8	176.9	-179.6	176.4	0	110.9	V155 P156	K130-V155 WeakPolarHBondContact O-CA 3.21Å; K130-P156 WeakPolarHBondContact O-CD 3.15Å
131	R	93.3	Very high	92.9	Very high	150 Å²	150	52.5 Å²	52.5	57%	0.566	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.5	35.6	179	-66.1	177.7	72	-168.8	4.6	112	V129 V152 P153 V155	V129-R131 PolarHBondContact O-N 2.93Å; R131-V152 WeakPolarHBondContact O-CG2 2.7Å; R131-V152 PolarHBondContact O-N 3.42Å; R131-P153 VanDerWaalsContact CZ-O 3.23Å; R131-P153 PolarHBondContact NE-O 2.76Å; R131-P153 VanDerWaalsContact NE-O 3.11Å; R131-P153 PolarHBondContact NH2-O 3.35Å; R131-V155 HydrophobicContact CG-CG2 4.16Å
132	K	93.3	Very high	93.3	Very high	99 Å²	99	53.8 Å²	53.8	43%	0.43	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	149.4	179.4	-58.9	-179.6	168.8	-166.6	0	111.2	V129 D149 L150	V129-K132 PolarHBondContact N-O 3.39Å; V129-K132 PolarHBondContact O-N 3.2Å; V129-K132 VanDerWaalsContact O-N 3.11Å; K132-D149 HydrophobicContact CD-CB 4.16Å; K132-D149 WeakPolarHBondContact CD-OD2 3.25Å; K132-D149 IonicContact NZ-OD2 2.95Å; K132-D149 PolarHBondContact NZ-OD2 3.21Å; K132-L150 CarbonylContact C-O 3.53Å; K132-L150 VanDerWaalsContact CA-O 3.25Å; K132-L150 WeakPolarHBondContact CA-O 3.44Å
133	L	94	Very high	93.6	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	131.1	168.5	-58.3	176.8	0	0	0	109.6	V127 A128 L150 V152 P156 M159 V168 I177	V127-L133 WeakPolarHBondContact O-CA 3.04Å; A128-L133 HydrophobicContact CB-CD2 3.91Å; L133-L150 HydrophobicContact CB-CB 4.27Å; L133-L150 PolarHBondContact N-O 3.28Å; L133-L150 PolarHBondContact O-N 3.14Å; L133-V152 HydrophobicContact CD1-CG1 3.8Å; L133-V152 HydrophobicContact CG-CG1 3.81Å; L133-P156 HydrophobicContact CD2-CG 3.75Å; L133-M159 HydrophobicContact CD2-SD 4.43Å; L133-V168 HydrophobicContact CD1-CG2 4Å; L133-I177 HydrophobicContact CD1-CD1 3.37Å
134	Q	94.4	Very high	93.5	Very high	21 Å²	21	56.3 Å²	56.3	10%	0.098	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	132.6	177.1	-59.8	-170.5	-37.9	0	0	109	K102 C126 V127 V129 Y136 D149	K102-Q134 PolarHBondContact O-OE1 3.22Å; C126-Q134 CarbonylContact C-O 3.54Å; C126-Q134 WeakPolarHBondContact CA-O 3.21Å; V127-Q134 PolarHBondContact N-O 3.08Å; V127-Q134 PolarHBondContact O-N 3.16Å; V129-Q134 HydrophobicContact CG2-CG 4.44Å; Q134-Y136 HydrophobicContact CB-CD2 4.34Å; Q134-Y136 HydrophobicContact CB-CE2 3.45Å; Q134-Y136 VanDerWaalsContact CB-CE2 3.45Å; Q134-Y136 PolarHBondContact OE1-OH 2.9Å; Q134-D149 WeakPolarHBondContact CG-OD1 3.27Å; Q134-D149 PolarHBondContact NE2-OD1 2.95Å; Q134-D149 VanDerWaalsContact NE2-OD1 3.11Å
135	L	93.6	Very high	93.4	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	130.3	-175.1	-66.6	160.9	0	0	0	109.5	C126 L146 Q147 L150 W161 I166 L179	C126-L135 HydrophobicContact CB-CD2 3.66Å; L135-L146 HydrophobicContact CB-CB 4.06Å; L135-L146 HydrophobicContact CB-CD2 4.37Å; L135-L146 PolarHBondContact O-N 3.05Å; L135-Q147 HydrophobicContact CB-CG 4.2Å; L135-Q147 HydrophobicContact CD1-CG 3.56Å; L135-Q147 HydrophobicContact CG-CG 4.49Å; L135-L150 HydrophobicContact CD1-CD1 3.81Å; L135-L150 HydrophobicContact CD1-CG 4.38Å; L135-W161 HydrophobicContact CD2-CH2 3.7Å; L135-W161 HydrophobicContact CD2-CZ2 4Å; L135-I166 HydrophobicContact CD2-CD1 3.61Å; L135-L179 HydrophobicContact CD1-CD2 3.5Å; L135-L179 VanDerWaalsContact CD1-CD2 3.5Å; L135-L179 HydrophobicContact CD2-CD2 4.48Å
136	Y	94.4	Very high	93	Very high	5 Å²	5	62.4 Å²	62.4	2%	0.02	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	152.9	-177.4	-60	-88.7	0	0	0	110.6	V100 K102 A103 R124 M125 V127 Q134 F143 H144	V100-Y136 HydrophobicContact CG1-CD1 4.14Å; V100-Y136 HydrophobicContact CG1-CE1 3.63Å; V100-Y136 HydrophobicContact CG1-CE2 4.15Å; K102-Y136 WeakPolarHBondContact CB-OH 3.28Å; A103-Y136 HydrophobicContact CB-CE2 4.33Å; R124-Y136 CarbonylContact C-O 3.43Å; R124-Y136 VanDerWaalsContact CA-O 3.3Å; R124-Y136 WeakPolarHBondContact CA-O 3.28Å; M125-Y136 HydrophobicContact CE-CD2 4.18Å; M125-Y136 HydrophobicContact CE-CG 4.41Å; M125-Y136 PolarHBondContact N-O 2.85Å; M125-Y136 PolarHBondContact O-N 2.89Å; V127-Y136 HydrophobicContact CB-CE2 4.26Å; V127-Y136 HydrophobicContact CG2-CD2 3.92Å; V127-Y136 HydrophobicContact CG2-CE2 3.93Å; Q134-Y136 HydrophobicContact CB-CD2 4.34Å; Q134-Y136 HydrophobicContact CB-CE2 3.45Å; Q134-Y136 VanDerWaalsContact CB-CE2 3.45Å; Q134-Y136 PolarHBondContact OE1-OH 2.9Å; Y136-F143 HydrophobicContact CD1-CB 4.21Å; Y136-F143 HydrophobicContact CG-CB 4.33Å; Y136-H144 CarbonylContact C-O 3.52Å; Y136-H144 WeakPolarHBondContact CA-O 3.5Å
137	Y	93.5	Very high	92.6	Very high	70 Å²	70	64.7 Å²	64.7	28%	0.275	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	149.2	166.9	70.6	-84.4	0	0	0	109.8	L123 K139 F143 H144 L146	L123-Y137 CarbonylContact O-C 3.6Å; L123-Y137 WeakPolarHBondContact O-CA 3.41Å; Y137-K139 HydrophobicContact CD2-CB 4.04Å; Y137-K139 HydrophobicContact CE2-CB 3.69Å; Y137-K139 HydrophobicContact CE2-CD 4.02Å; Y137-K139 HydrophobicContact CE2-CG 4.47Å; Y137-F143 WeakPolarHBondContact O-CA 3.3Å; Y137-H144 HydrophobicContact CD1-CB 4.06Å; Y137-H144 WeakPolarHBondContact CD1-O 3.43Å; Y137-H144 HydrophobicContact CD2-CB 4.5Å; Y137-H144 HydrophobicContact CE1-CB 3.46Å; Y137-H144 VanDerWaalsContact CE1-CB 3.46Å; Y137-H144 HydrophobicContact CE2-CB 3.96Å; Y137-H144 PolarHBondContact N-O 3.28Å; Y137-H144 PolarHBondContact O-N 2.84Å; Y137-L146 HydrophobicContact CD1-CB 4.1Å; Y137-L146 HydrophobicContact CD1-CD1 3.85Å; Y137-L146 HydrophobicContact CG-CD1 4.38Å
138	W	94.2	Very high	92	Very high	23 Å²	23	66.9 Å²	66.9	9%	0.087	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	124.5	-178.7	-177.5	-106.5	0	0	0	110.8	Y75 I77 V88 I97 T98 L123 R141 F143	Y75-W138 AromaticContact CD1-CD1 3.63Å; Y75-W138 AromaticContact CD1-NE1 3.59Å; Y75-W138 AromaticContact CE1-CD1 3.72Å; Y75-W138 AromaticContact CG-CD1 3.78Å; Y75-W138 AromaticContact CG-NE1 3.77Å; Y75-W138 AromaticContact CZ-CD1 3.99Å; I77-W138 HydrophobicContact CD1-CD2 3.92Å; I77-W138 HydrophobicContact CD1-CE3 4.13Å; I77-W138 HydrophobicContact CD1-CH2 4.05Å; I77-W138 HydrophobicContact CD1-CZ2 3.82Å; I77-W138 HydrophobicContact CD1-CZ3 4.21Å; I77-W138 HydrophobicContact CG2-CH2 4.2Å; I77-W138 HydrophobicContact CG2-CZ2 3.78Å; V88-W138 HydrophobicContact CB-CZ3 4.46Å; V88-W138 HydrophobicContact CG1-CH2 3.74Å; V88-W138 HydrophobicContact CG1-CZ3 3.9Å; V88-W138 HydrophobicContact CG2-CZ3 4.22Å; I97-W138 HydrophobicContact CG2-CH2 4.5Å; T98-W138 HydrophobicContact CG2-CZ3 4.33Å; L123-W138 HydrophobicContact CB-CB 3.85Å; L123-W138 HydrophobicContact CD2-CB 3.88Å; L123-W138 HydrophobicContact CD2-CG 4.14Å; L123-W138 HydrophobicContact CG-CB 4.14Å; L123-W138 PolarHBondContact O-N 3.39Å; W138-R141 WeakPolarHBondContact CH2-O 3.27Å; W138-R141 VanDerWaalsContact CZ2-CA 3.48Å; W138-R141 HydrophobicContact CZ2-CB 4.32Å; W138-F143 HydrophobicContact CB-CD1 4.29Å; W138-F143 HydrophobicContact CB-CE1 3.94Å; W138-F143 HydrophobicContact CE3-CD1 4.06Å; W138-F143 AromaticContact CE3-CD2 3.67Å; W138-F143 HydrophobicContact CE3-CD2 3.67Å; W138-F143 HydrophobicContact CE3-CE1 4.01Å; W138-F143 AromaticContact CE3-CE2 3.61Å; W138-F143 HydrophobicContact CE3-CE2 3.61Å; W138-F143 AromaticContact CE3-CG 3.9Å; W138-F143 HydrophobicContact CE3-CG 3.9Å; W138-F143 AromaticContact CE3-CZ 3.79Å; W138-F143 HydrophobicContact CE3-CZ 3.79Å; W138-F143 AromaticContact CZ3-CD2 3.82Å; W138-F143 HydrophobicContact CZ3-CD2 3.82Å; W138-F143 AromaticContact CZ3-CE2 3.86Å; W138-F143 HydrophobicContact CZ3-CE2 3.86Å; W138-F143 HydrophobicContact CZ3-CG 4.4Å; W138-F143 HydrophobicContact CZ3-CZ 4.46Å
139	K	91.7	Very high	91.7	Very high	110 Å²	110	70 Å²	70	48%	0.478	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	145.5	174.4	-171.3	179.6	173.8	177.1	0	109.9	Y137 R141 E142 H144	Y137-K139 HydrophobicContact CD2-CB 4.04Å; Y137-K139 HydrophobicContact CE2-CB 3.69Å; Y137-K139 HydrophobicContact CE2-CD 4.02Å; Y137-K139 HydrophobicContact CE2-CG 4.47Å; K139-R141 PolarHBondContact O-N 3.18Å; K139-E142 PolarHBondContact N-O 3Å; K139-E142 CarbonylContact O-C 3.55Å; K139-E142 PolarHBondContact O-N 3.28Å; K139-H144 PolarHBondContact O-NE2 2.81Å
140	D	88.5	Confident	91.4	Very high	128 Å²	128	70.2 Å²	70.2	68%	0.684	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	35.6	173.7	-57.2	-36.4	0	0	0	114.5	E142	D140-E142 PolarHBondContact O-N 3.35Å
141	R	90.4	Very high	91.4	Very high	190 Å²	190	65 Å²	65	72%	0.717	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.3	17.1	-176.3	-59.8	-176.2	168.4	-168.7	-4.3	115.7	I97 W138 K139	I97-R141 HydrophobicContact CG2-CB 4.11Å; W138-R141 WeakPolarHBondContact CH2-O 3.27Å; W138-R141 VanDerWaalsContact CZ2-CA 3.48Å; W138-R141 HydrophobicContact CZ2-CB 4.32Å; K139-R141 PolarHBondContact O-N 3.18Å
142	E	93	Very high	91.3	Very high	101 Å²	101	58.4 Å²	58.4	47%	0.472	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	161	174.1	-63.9	-165.2	150.9	0	0	112.6	T98 K139 D140	T98-E142 HydrophobicContact CG2-CG 4.5Å; K139-E142 PolarHBondContact N-O 3Å; K139-E142 CarbonylContact O-C 3.55Å; K139-E142 PolarHBondContact O-N 3.28Å; D140-E142 PolarHBondContact O-N 3.35Å
143	F	93.7	Very high	91.2	Very high	20 Å²	20	55.8 Å²	55.8	9%	0.088	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	113.4	171.9	-85.5	-68.3	0	0	0	109.8	V79 V88 V100 L123 M125 Y136 Y137 W138	V79-F143 HydrophobicContact CG2-CE2 4.18Å; V79-F143 HydrophobicContact CG2-CZ 4.29Å; V88-F143 HydrophobicContact CG2-CD2 3.72Å; V88-F143 HydrophobicContact CG2-CE2 3.58Å; V100-F143 HydrophobicContact CG2-CB 3.94Å; V100-F143 HydrophobicContact CG2-CD2 3.85Å; V100-F143 HydrophobicContact CG2-CG 4.27Å; L123-F143 HydrophobicContact CD2-CE1 4.12Å; L123-F143 HydrophobicContact CD2-CZ 3.86Å; L123-F143 HydrophobicContact CG-CE1 4.39Å; M125-F143 HydrophobicContact CB-CD1 4.37Å; M125-F143 HydrophobicContact CB-CE1 3.81Å; M125-F143 HydrophobicContact CB-CZ 4.22Å; M125-F143 HydrophobicContact CE-CB 4.47Å; M125-F143 HydrophobicContact CE-CD1 3.9Å; M125-F143 HydrophobicContact CE-CD2 3.69Å; M125-F143 HydrophobicContact CE-CE1 3.98Å; M125-F143 HydrophobicContact CE-CE2 3.77Å; M125-F143 HydrophobicContact CE-CG 3.76Å; M125-F143 HydrophobicContact CE-CZ 3.91Å; M125-F143 HydrophobicContact SD-CE1 4.48Å; M125-F143 HydrophobicContact SD-CE2 4.24Å; M125-F143 HydrophobicContact SD-CZ 4.11Å; Y136-F143 HydrophobicContact CD1-CB 4.21Å; Y136-F143 HydrophobicContact CG-CB 4.33Å; Y137-F143 WeakPolarHBondContact O-CA 3.3Å; W138-F143 HydrophobicContact CB-CD1 4.29Å; W138-F143 HydrophobicContact CB-CE1 3.94Å; W138-F143 HydrophobicContact CE3-CD1 4.06Å; W138-F143 AromaticContact CE3-CD2 3.67Å; W138-F143 HydrophobicContact CE3-CD2 3.67Å; W138-F143 HydrophobicContact CE3-CE1 4.01Å; W138-F143 AromaticContact CE3-CE2 3.61Å; W138-F143 HydrophobicContact CE3-CE2 3.61Å; W138-F143 AromaticContact CE3-CG 3.9Å; W138-F143 HydrophobicContact CE3-CG 3.9Å; W138-F143 AromaticContact CE3-CZ 3.79Å; W138-F143 HydrophobicContact CE3-CZ 3.79Å; W138-F143 AromaticContact CZ3-CD2 3.82Å; W138-F143 HydrophobicContact CZ3-CD2 3.82Å; W138-F143 AromaticContact CZ3-CE2 3.86Å; W138-F143 HydrophobicContact CZ3-CE2 3.86Å; W138-F143 HydrophobicContact CZ3-CG 4.4Å; W138-F143 HydrophobicContact CZ3-CZ 4.46Å
144	H	92.4	Very high	91.1	Very high	66 Å²	66	58.7 Å²	58.7	31%	0.306	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	146.5	176.3	-66.4	-89.2	0	0	0	110.4	Y136 Y137 K139 L146	Y136-H144 CarbonylContact C-O 3.52Å; Y136-H144 WeakPolarHBondContact CA-O 3.5Å; Y137-H144 HydrophobicContact CD1-CB 4.06Å; Y137-H144 WeakPolarHBondContact CD1-O 3.43Å; Y137-H144 HydrophobicContact CD2-CB 4.5Å; Y137-H144 HydrophobicContact CE1-CB 3.46Å; Y137-H144 VanDerWaalsContact CE1-CB 3.46Å; Y137-H144 HydrophobicContact CE2-CB 3.96Å; Y137-H144 PolarHBondContact N-O 3.28Å; Y137-H144 PolarHBondContact O-N 2.84Å; K139-H144 PolarHBondContact O-NE2 2.81Å; H144-L146 PolarHBondContact O-N 2.91Å
145	E	91.2	Very high	91.1	Very high	78 Å²	78	60.4 Å²	60.4	36%	0.364	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	125.5	179.2	-169.9	174.1	169.4	0	0	110	K102 Q147	K102-E145 IonicContact NZ-OE2 2.69Å; K102-E145 PolarHBondContact NZ-OE2 2.97Å; E145-Q147 WeakPolarHBondContact CG-O 3Å
146	L	86.6	Confident	91.2	Very high	74 Å²	74	60.5 Å²	60.5	39%	0.387	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	-42.1	-178.8	-175.9	68.7	0	0	0	111.4	L135 Y137 H144	L135-L146 HydrophobicContact CB-CB 4.06Å; L135-L146 HydrophobicContact CB-CD2 4.37Å; L135-L146 PolarHBondContact O-N 3.05Å; Y137-L146 HydrophobicContact CD1-CB 4.1Å; Y137-L146 HydrophobicContact CD1-CD1 3.85Å; Y137-L146 HydrophobicContact CG-CD1 4.38Å; H144-L146 PolarHBondContact O-N 2.91Å
147	Q	85.9	Confident	91.1	Very high	49 Å²	49	64.8 Å²	64.8	23%	0.229	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	168.6	177.5	64.6	178.5	31.7	0	0	109.7	L135 E145	L135-Q147 HydrophobicContact CB-CG 4.2Å; L135-Q147 HydrophobicContact CD1-CG 3.56Å; L135-Q147 HydrophobicContact CG-CG 4.49Å; E145-Q147 WeakPolarHBondContact CG-O 3Å
148	G	84.1	Confident	91.2	Very high	46 Å²	46	62.1 Å²	62.1	47%	0.474	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	160.3	179.7	0	0	0	0	0	114.2	L150	G148-L150 PolarHBondContact O-N 2.88Å
149	D	90.2	Very high	91.2	Very high	64 Å²	64	61.8 Å²	61.8	34%	0.342	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-48.2	126.6	177.7	-70.4	-6.7	0	0	0	112.4	K132 Q134	K132-D149 HydrophobicContact CD-CB 4.16Å; K132-D149 WeakPolarHBondContact CD-OD2 3.25Å; K132-D149 IonicContact NZ-OD2 2.95Å; K132-D149 PolarHBondContact NZ-OD2 3.21Å; Q134-D149 WeakPolarHBondContact CG-OD1 3.27Å; Q134-D149 PolarHBondContact NE2-OD1 2.95Å; Q134-D149 VanDerWaalsContact NE2-OD1 3.11Å
150	L	90.4	Very high	91.4	Very high	22 Å²	22	56.8 Å²	56.8	12%	0.115	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	118.7	170.7	-59.2	179.6	0	0	0	110	K132 L133 L135 G148 I177 L179	K132-L150 CarbonylContact C-O 3.53Å; K132-L150 VanDerWaalsContact CA-O 3.25Å; K132-L150 WeakPolarHBondContact CA-O 3.44Å; L133-L150 HydrophobicContact CB-CB 4.27Å; L133-L150 PolarHBondContact N-O 3.28Å; L133-L150 PolarHBondContact O-N 3.14Å; L135-L150 HydrophobicContact CD1-CD1 3.81Å; L135-L150 HydrophobicContact CD1-CG 4.38Å; G148-L150 PolarHBondContact O-N 2.88Å; L150-I177 HydrophobicContact CD1-CG2 3.79Å; L150-L179 HydrophobicContact CD1-CD2 4.12Å
151	G	90.3	Very high	91.6	Very high	49 Å²	49	51.6 Å²	51.6	51%	0.505	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	136.9	174.1	0	0	0	0	0	111.7	I185	G151-I185 WeakPolarHBondContact O-CD1 3.19Å
152	V	92.4	Very high	91.7	Very high	10 Å²	10	42.5 Å²	42.5	6%	0.061	24%	0.24	C	C	.	.			trans	-125.9	154	179.3	-72.2	0	0	0	0	112.5	R131 L133 D154 P156 F170 I177	R131-V152 WeakPolarHBondContact O-CG2 2.7Å; R131-V152 PolarHBondContact O-N 3.42Å; L133-V152 HydrophobicContact CD1-CG1 3.8Å; L133-V152 HydrophobicContact CG-CG1 3.81Å; V152-D154 WeakPolarHBondContact CG2-O 3.33Å; V152-D154 PolarHBondContact O-N 2.75Å; V152-P156 HydrophobicContact CG2-CG 4.12Å; V152-F170 HydrophobicContact CB-CE1 4.08Å; V152-F170 HydrophobicContact CB-CZ 3.79Å; V152-F170 HydrophobicContact CG1-CZ 4.23Å; V152-F170 HydrophobicContact CG2-CE1 4.17Å; V152-F170 HydrophobicContact CG2-CZ 4.35Å; V152-I177 HydrophobicContact CG1-CD1 3.48Å; V152-I177 VanDerWaalsContact CG1-CD1 3.48Å
153	P	90.2	Very high	91.4	Very high	44 Å²	44	41.9 Å²	41.9	29%	0.286	24%	0.236	S	C	.	.	S	Bend	trans	-68.2	-26.8	-171.4	24.3	-34.4	0	0	0	114.3	R131 F170 Y175	R131-P153 VanDerWaalsContact CZ-O 3.23Å; R131-P153 PolarHBondContact NE-O 2.76Å; R131-P153 VanDerWaalsContact NE-O 3.11Å; R131-P153 PolarHBondContact NH2-O 3.35Å; P153-F170 HydrophobicContact CG-CD2 4.23Å; P153-F170 HydrophobicContact CG-CE2 3.76Å; P153-F170 HydrophobicContact CG-CZ 3.99Å; P153-Y175 HydrophobicContact CG-CD1 4.45Å; P153-Y175 HydrophobicContact CG-CD2 4Å; P153-Y175 HydrophobicContact CG-CE1 4.09Å; P153-Y175 HydrophobicContact CG-CE2 3.56Å; P153-Y175 HydrophobicContact CG-CG 4.4Å
154	D	93.1	Very high	91.1	Very high	61 Å²	61	44.7 Å²	44.7	33%	0.326	25%	0.253	S	S	.	.	S	Bend	trans	-146.6	-174.2	175.5	-162.8	4.2	0	0	0	110.2	V152 P156 F170	V152-D154 WeakPolarHBondContact CG2-O 3.33Å; V152-D154 PolarHBondContact O-N 2.75Å; D154-P156 WeakPolarHBondContact O-CD 3.34Å; D154-F170 VanDerWaalsContact C-CD1 3.5Å; D154-F170 HydrophobicContact CB-CB 4.12Å; D154-F170 HydrophobicContact CB-CD1 3.67Å; D154-F170 HydrophobicContact CB-CE1 4.41Å; D154-F170 HydrophobicContact CB-CG 4.03Å; D154-F170 WeakPolarHBondContact O-CD1 3.27Å; D154-F170 WeakPolarHBondContact O-CE1 3.33Å
155	V	93.2	Very high	91.1	Very high	57 Å²	57	41.7 Å²	41.7	35%	0.345	24%	0.239	S	C	.	.			trans	-76.7	118.2	175.2	-177.8	0	0	0	0	109.5	K130 R131 K157	K130-V155 WeakPolarHBondContact O-CA 3.21Å; R131-V155 HydrophobicContact CG-CG2 4.16Å; V155-K157 PolarHBondContact O-N 3.42Å
156	P	95.1	Very high	91.2	Very high	4 Å²	4	38 Å²	38	3%	0.026	22%	0.222	C	C	.	.			trans	-57.2	135.4	176.9	-26.3	36.2	0	0	0	112.2	A128 K130 L133 V152 D154 V168 F170	A128-P156 HydrophobicContact CB-CB 3.75Å; A128-P156 HydrophobicContact CB-CG 3.69Å; K130-P156 WeakPolarHBondContact O-CD 3.15Å; L133-P156 HydrophobicContact CD2-CG 3.75Å; V152-P156 HydrophobicContact CG2-CG 4.12Å; D154-P156 WeakPolarHBondContact O-CD 3.34Å; P156-V168 HydrophobicContact CB-CG1 3.71Å; P156-V168 HydrophobicContact CG-CG1 3.98Å; P156-F170 HydrophobicContact CB-CE1 4.36Å; P156-F170 HydrophobicContact CG-CE1 3.86Å
157	K	94.1	Very high	91.7	Very high	95 Å²	95	34.5 Å²	34.5	41%	0.413	20%	0.203	S	C	.	.	S	Bend	trans	-112.7	-28.2	176.2	-75	-166.8	173.1	-163.5	0	113.5	V155 G169 L195 P197	V155-K157 PolarHBondContact O-N 3.42Å; K157-G169 PolarHBondContact N-O 2.99Å; K157-L195 PolarHBondContact NZ-O 2.88Å; K157-P197 HydrophobicContact CB-CG 3.52Å; K157-P197 HydrophobicContact CD-CG 4.44Å
158	S	94.5	Very high	92.1	Very high	14 Å²	14	32.1 Å²	32.1	10%	0.098	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	152.1	170	56	0	0	0	0	109.7	L108 G169 P197	L108-S158 VanDerWaalsContact CD2-CA 3.5Å; S158-G169 PolarHBondContact N-O 3.22Å; S158-G169 PolarHBondContact O-N 3.11Å; S158-P197 WeakPolarHBondContact CB-O 3.48Å; S158-P197 WeakPolarHBondContact OG-CB 3.41Å; S158-P197 WeakPolarHBondContact OG-CG 3.47Å; S158-P197 PolarHBondContact OG-O 3.17Å
159	M	95.4	Very high	92.7	Very high	15 Å²	15	30 Å²	30	7%	0.074	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	146.9	177.2	68.9	-160.4	-136.7	0	0	111.7	L108 A110 C126 A128 L133 I166 C167 V168	L108-M159 HydrophobicContact CD2-CB 4.08Å; L108-M159 HydrophobicContact CD2-CG 3.52Å; L108-M159 HydrophobicContact CD2-SD 3.64Å; L108-M159 HydrophobicContact CG-CG 4.02Å; L108-M159 HydrophobicContact CG-SD 3.93Å; A110-M159 HydrophobicContact CB-CE 3.62Å; A110-M159 HydrophobicContact CB-CG 3.81Å; A110-M159 VanDerWaalsContact N-CE 3.33Å; C126-M159 VanDerWaalsContact C-CE 3.42Å; C126-M159 HydrophobicContact CB-CE 3.57Å; C126-M159 WeakPolarHBondContact O-CE 3.22Å; C126-M159 VanDerWaalsContact SG-CE 3.54Å; A128-M159 HydrophobicContact CB-SD 4.28Å; L133-M159 HydrophobicContact CD2-SD 4.43Å; M159-I166 HydrophobicContact CB-CG2 4.4Å; M159-C167 WeakPolarHBondContact CA-O 3.14Å; M159-V168 HydrophobicContact CB-CG2 4.29Å
160	A	94.8	Very high	92.9	Very high	6 Å²	6	26.9 Å²	26.9	5%	0.05	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	153.2	171.6	0	0	0	0	0	110.5	C167 V199 P201 V207	A160-C167 PolarHBondContact N-O 3.02Å; A160-C167 PolarHBondContact O-N 3.17Å; A160-V199 HydrophobicContact CB-CB 4.39Å; A160-V199 HydrophobicContact CB-CG1 3.58Å; A160-P201 HydrophobicContact CB-CB 4.46Å; A160-V207 HydrophobicContact CB-CG1 4.25Å
161	W	93.3	Very high	92.9	Very high	18 Å²	18	30.1 Å²	30.1	7%	0.068	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	141.4	173.4	-70	94	0	0	0	110.9	A110 D112 R124 C126 L135 I166 L179 V207	A110-W161 PolarHBondContact O-NE1 3.1Å; D112-W161 HydrophobicContact CB-CB 3.93Å; D112-W161 HydrophobicContact CB-CD2 3.77Å; D112-W161 HydrophobicContact CB-CE3 4.4Å; D112-W161 HydrophobicContact CB-CG 3.51Å; R124-W161 HydrophobicContact CB-CH2 4.29Å; R124-W161 HydrophobicContact CB-CZ2 4.34Å; C126-W161 HydrophobicContact CB-CH2 4.46Å; C126-W161 HydrophobicContact CB-CZ2 3.57Å; L135-W161 HydrophobicContact CD2-CH2 3.7Å; L135-W161 HydrophobicContact CD2-CZ2 4Å; W161-I166 HydrophobicContact CD2-CD1 4.35Å; W161-I166 HydrophobicContact CD2-CG1 4.06Å; W161-I166 HydrophobicContact CE3-CD1 4.15Å; W161-I166 HydrophobicContact CE3-CG1 3.74Å; W161-I166 HydrophobicContact CH2-CD1 3.77Å; W161-I166 HydrophobicContact CH2-CG1 4.27Å; W161-I166 HydrophobicContact CZ2-CD1 3.95Å; W161-I166 HydrophobicContact CZ3-CD1 3.89Å; W161-I166 HydrophobicContact CZ3-CG1 3.89Å; W161-L179 HydrophobicContact CE3-CD1 4.37Å; W161-L179 HydrophobicContact CH2-CD1 3.83Å; W161-L179 HydrophobicContact CZ3-CD1 3.33Å; W161-V207 VanDerWaalsContact O-CG1 3.24Å; W161-V207 WeakPolarHBondContact O-CG1 3.33Å
162	C	91.3	Very high	92.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	76	178.7	-167.4	0	0	0	0	106.8	N164 S165 G205 V207 N219	C162-N164 PolarHBondContact O-N 3.32Å; C162-S165 CarbonylContact C-O 3.57Å; C162-S165 WeakPolarHBondContact CA-O 3.26Å; C162-S165 PolarHBondContact N-O 2.81Å; C162-S165 WeakPolarHBondContact O-CA 3.49Å; C162-S165 WeakPolarHBondContact O-CB 3.24Å; C162-S165 PolarHBondContact O-N 3.36Å; C162-G205 PolarHBondContact SG-O 3.29Å; C162-V207 HydrophobicContact CB-CG1 3.6Å; C162-V207 HydrophobicContact CB-CG2 4.2Å; C162-N219 PolarHBondContact SG-O 3.16Å
163	E	87.5	Confident	92.9	Very high	87 Å²	87	38 Å²	38	41%	0.407	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	-106.3	-168.5	-55.5	-166.4	162	0	0	113.5	S165	E163-S165 VanDerWaalsContact C-N 3.34Å
164	N	88.3	Confident	93.1	Very high	80 Å²	80	36 Å²	36	43%	0.428	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	12.4	179.3	-70.5	-21.6	0	0	0	113.2	C162 L179	C162-N164 PolarHBondContact O-N 3.32Å; N164-L179 VanDerWaalsContact O-CB 3.27Å; N164-L179 WeakPolarHBondContact O-CB 3.46Å; N164-L179 WeakPolarHBondContact O-CG 3.42Å; N164-L179 PolarHBondContact O-N 2.96Å
165	S	92.1	Very high	93.1	Very high	3 Å²	3	34.5 Å²	34.5	2%	0.021	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	155.7	176	-67.3	0	0	0	0	110.5	C162 E163 I177 E220	C162-S165 CarbonylContact C-O 3.57Å; C162-S165 WeakPolarHBondContact CA-O 3.26Å; C162-S165 PolarHBondContact N-O 2.81Å; C162-S165 WeakPolarHBondContact O-CA 3.49Å; C162-S165 WeakPolarHBondContact O-CB 3.24Å; C162-S165 PolarHBondContact O-N 3.36Å; E163-S165 VanDerWaalsContact C-N 3.34Å; S165-I177 CarbonylContact C-O 3.54Å; S165-I177 WeakPolarHBondContact CA-O 3.43Å; S165-E220 PolarHBondContact OG-O 2.87Å
166	I	93.5	Very high	93.2	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	120.4	174.7	-54.8	176.5	0	0	0	107.6	C126 L135 M159 W161 V168 I177 L179	C126-I166 HydrophobicContact CB-CD1 3.77Å; L135-I166 HydrophobicContact CD2-CD1 3.61Å; M159-I166 HydrophobicContact CB-CG2 4.4Å; W161-I166 HydrophobicContact CD2-CD1 4.35Å; W161-I166 HydrophobicContact CD2-CG1 4.06Å; W161-I166 HydrophobicContact CE3-CD1 4.15Å; W161-I166 HydrophobicContact CE3-CG1 3.74Å; W161-I166 HydrophobicContact CH2-CD1 3.77Å; W161-I166 HydrophobicContact CH2-CG1 4.27Å; W161-I166 HydrophobicContact CZ2-CD1 3.95Å; W161-I166 HydrophobicContact CZ3-CD1 3.89Å; W161-I166 HydrophobicContact CZ3-CG1 3.89Å; I166-V168 HydrophobicContact CG2-CG2 3.8Å; I166-I177 PolarHBondContact N-O 2.89Å; I166-I177 PolarHBondContact O-N 3.03Å; I166-L179 HydrophobicContact CD1-CD1 4.4Å; I166-L179 HydrophobicContact CD1-CD2 4.32Å
167	C	95.6	Very high	93.1	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	124.9	172.6	-175.4	0	0	0	0	108.7	M159 A160 L176 V199 V207 V209	M159-C167 WeakPolarHBondContact CA-O 3.14Å; A160-C167 PolarHBondContact N-O 3.02Å; A160-C167 PolarHBondContact O-N 3.17Å; C167-L176 HydrophobicContact CB-CD1 3.92Å; C167-V199 HydrophobicContact CB-CG1 3.93Å; C167-V207 HydrophobicContact CB-CG2 3.85Å; C167-V209 VanDerWaalsContact SG-CG2 3.57Å
168	V	95.8	Very high	92.9	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	126.9	-173.9	-173.6	0	0	0	0	109.5	L133 P156 M159 I166 F170 Y174 Y175 I177	L133-V168 HydrophobicContact CD1-CG2 4Å; P156-V168 HydrophobicContact CB-CG1 3.71Å; P156-V168 HydrophobicContact CG-CG1 3.98Å; M159-V168 HydrophobicContact CB-CG2 4.29Å; I166-V168 HydrophobicContact CG2-CG2 3.8Å; V168-F170 HydrophobicContact CB-CE2 4.29Å; V168-F170 HydrophobicContact CB-CZ 4.2Å; V168-F170 HydrophobicContact CG1-CE1 3.88Å; V168-F170 HydrophobicContact CG1-CE2 3.97Å; V168-F170 HydrophobicContact CG1-CZ 3.53Å; V168-Y174 WeakPolarHBondContact O-CA 3.5Å; V168-Y175 PolarHBondContact N-O 3.16Å; V168-Y175 PolarHBondContact O-N 3.35Å; V168-I177 HydrophobicContact CG2-CD1 3.86Å
169	G	95	Very high	92.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	127.2	172.8	0	0	0	0	0	111.9	K157 S158 P197	K157-G169 PolarHBondContact N-O 2.99Å; S158-G169 PolarHBondContact N-O 3.22Å; S158-G169 PolarHBondContact O-N 3.11Å; G169-P197 WeakPolarHBondContact O-CG 3.29Å
170	F	94.1	Very high	91.4	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	16%	0.161	C	C	.	.			trans	-102.7	-172	170.3	-57.6	-74.1	0	0	0	110.7	V152 P153 D154 P156 V168 R172 D173 Y175 T191 P197	V152-F170 HydrophobicContact CB-CE1 4.08Å; V152-F170 HydrophobicContact CB-CZ 3.79Å; V152-F170 HydrophobicContact CG1-CZ 4.23Å; V152-F170 HydrophobicContact CG2-CE1 4.17Å; V152-F170 HydrophobicContact CG2-CZ 4.35Å; P153-F170 HydrophobicContact CG-CD2 4.23Å; P153-F170 HydrophobicContact CG-CE2 3.76Å; P153-F170 HydrophobicContact CG-CZ 3.99Å; D154-F170 VanDerWaalsContact C-CD1 3.5Å; D154-F170 HydrophobicContact CB-CB 4.12Å; D154-F170 HydrophobicContact CB-CD1 3.67Å; D154-F170 HydrophobicContact CB-CE1 4.41Å; D154-F170 HydrophobicContact CB-CG 4.03Å; D154-F170 WeakPolarHBondContact O-CD1 3.27Å; D154-F170 WeakPolarHBondContact O-CE1 3.33Å; P156-F170 HydrophobicContact CB-CE1 4.36Å; P156-F170 HydrophobicContact CG-CE1 3.86Å; V168-F170 HydrophobicContact CB-CE2 4.29Å; V168-F170 HydrophobicContact CB-CZ 4.2Å; V168-F170 HydrophobicContact CG1-CE1 3.88Å; V168-F170 HydrophobicContact CG1-CE2 3.97Å; V168-F170 HydrophobicContact CG1-CZ 3.53Å; F170-R172 VanDerWaalsContact C-N 3.29Å; F170-R172 PolarHBondContact O-N 2.91Å; F170-D173 WeakPolarHBondContact CB-O 3.2Å; F170-D173 WeakPolarHBondContact CD2-O 3.29Å; F170-D173 PolarHBondContact N-O 3.05Å; F170-Y175 AromaticContact CD2-CD2 3.4Å; F170-Y175 HydrophobicContact CD2-CD2 3.4Å; F170-Y175 VanDerWaalsContact CD2-CD2 3.4Å; F170-Y175 AromaticContact CD2-CE2 3.74Å; F170-Y175 HydrophobicContact CD2-CE2 3.74Å; F170-Y175 HydrophobicContact CD2-CG 4.48Å; F170-Y175 AromaticContact CE2-CD2 3.28Å; F170-Y175 HydrophobicContact CE2-CD2 3.28Å; F170-Y175 AromaticContact CE2-CE2 3.9Å; F170-Y175 HydrophobicContact CE2-CE2 3.9Å; F170-Y175 AromaticContact CE2-CG 3.98Å; F170-Y175 HydrophobicContact CE2-CG 3.98Å; F170-T191 WeakPolarHBondContact O-CG2 3.48Å; F170-P197 WeakPolarHBondContact O-CD 3.48Å; F170-P197 WeakPolarHBondContact O-CG 3.48Å
171	K	91.3	Very high	90	Very high	90 Å²	90	38.6 Å²	38.6	39%	0.391	19%	0.19	S	C	.	.	S	Bend	trans	-68.4	-26.9	-179.1	-176.3	174.7	178.3	-178.9	0	113.5	T191 L195	K171-T191 PolarHBondContact O-OG1 3.01Å; K171-T191 VanDerWaalsContact O-OG1 3.08Å; K171-L195 HydrophobicContact CG-CB 4.09Å; K171-L195 HydrophobicContact CG-CD2 3.94Å; K171-L195 WeakPolarHBondContact O-CD2 3.42Å
172	R	89.4	Confident	88.7	Confident	191 Å²	191	48.9 Å²	48.9	72%	0.721	23%	0.229	S	C	*	.	S	Bend	trans	-122.3	-24.6	-172	-67.6	-175.6	174.3	-179.4	-1	113.7	F170 P190 T191	F170-R172 VanDerWaalsContact C-N 3.29Å; F170-R172 PolarHBondContact O-N 2.91Å; R172-P190 CarbonylContact O-C 3.58Å; R172-P190 WeakPolarHBondContact O-CA 3.3Å; R172-P190 WeakPolarHBondContact O-CB 3.32Å; R172-T191 WeakPolarHBondContact CA-OG1 3.41Å; R172-T191 PolarHBondContact O-N 2.82Å; R172-T191 PolarHBondContact O-OG1 2.87Å
173	D	92.6	Very high	87.8	Confident	32 Å²	32	49.3 Å²	49.3	17%	0.171	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	153.4	-164.2	43.6	-6.1	0	0	0	112	F170 Y175	F170-D173 WeakPolarHBondContact CB-O 3.2Å; F170-D173 WeakPolarHBondContact CD2-O 3.29Å; F170-D173 PolarHBondContact N-O 3.05Å; D173-Y175 HydrophobicContact CB-CE2 3.9Å; D173-Y175 WeakPolarHBondContact OD2-CE2 3.06Å; D173-Y175 PolarHBondContact OD2-OH 2.95Å
174	Y	94.9	Very high	87.6	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.008	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	143.9	171.6	-70.2	-78	0	0	0	110.7	V168 L188 F189 T191 P197 L198 V199 V209 G210	V168-Y174 WeakPolarHBondContact O-CA 3.5Å; Y174-L188 WeakPolarHBondContact O-CB 3.45Å; Y174-L188 PolarHBondContact O-N 2.95Å; Y174-F189 AromaticContact CD2-CD2 3.91Å; Y174-F189 HydrophobicContact CD2-CD2 3.91Å; Y174-F189 AromaticContact CD2-CE2 3.66Å; Y174-F189 HydrophobicContact CD2-CE2 3.66Å; Y174-F189 HydrophobicContact CD2-CZ 4.38Å; Y174-F189 HydrophobicContact CE2-CD2 4.45Å; Y174-F189 AromaticContact CE2-CE2 3.95Å; Y174-F189 HydrophobicContact CE2-CE2 3.95Å; Y174-F189 PolarHBondContact N-O 2.77Å; Y174-T191 HydrophobicContact CD2-CG2 3.91Å; Y174-T191 HydrophobicContact CE1-CG2 4.38Å; Y174-T191 HydrophobicContact CE2-CG2 3.58Å; Y174-T191 HydrophobicContact CG-CG2 4.45Å; Y174-P197 HydrophobicContact CD1-CB 4.45Å; Y174-P197 HydrophobicContact CE1-CB 3.46Å; Y174-P197 VanDerWaalsContact CE1-CB 3.46Å; Y174-P197 VanDerWaalsContact OH-CA 3.22Å; Y174-P197 WeakPolarHBondContact OH-CA 3.31Å; Y174-P197 WeakPolarHBondContact OH-CB 3.29Å; Y174-L198 PolarHBondContact OH-N 2.83Å; Y174-L198 PolarHBondContact OH-O 3.41Å; Y174-V199 HydrophobicContact CD1-CG2 4.04Å; Y174-V199 HydrophobicContact CE1-CG2 3.65Å; Y174-V209 HydrophobicContact CD1-CG1 3.58Å; Y174-V209 HydrophobicContact CD2-CG1 3.58Å; Y174-V209 HydrophobicContact CE1-CG1 3.52Å; Y174-V209 HydrophobicContact CE2-CG1 3.48Å; Y174-V209 VanDerWaalsContact CE2-CG1 3.48Å; Y174-V209 HydrophobicContact CG-CG1 3.63Å; Y174-V209 VanDerWaalsContact CZ-CG1 3.46Å; Y174-G210 WeakPolarHBondContact CE2-O 3.39Å; Y174-G210 PolarHBondContact OH-O 3.04Å
175	Y	94.4	Very high	87.7	Confident	30 Å²	30	47.2 Å²	47.2	12%	0.118	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	150.6	172	-65.9	-107.9	0	0	0	110.6	P153 V168 F170 D173 I185 K186 E187	P153-Y175 HydrophobicContact CG-CD1 4.45Å; P153-Y175 HydrophobicContact CG-CD2 4Å; P153-Y175 HydrophobicContact CG-CE1 4.09Å; P153-Y175 HydrophobicContact CG-CE2 3.56Å; P153-Y175 HydrophobicContact CG-CG 4.4Å; V168-Y175 PolarHBondContact N-O 3.16Å; V168-Y175 PolarHBondContact O-N 3.35Å; F170-Y175 AromaticContact CD2-CD2 3.4Å; F170-Y175 HydrophobicContact CD2-CD2 3.4Å; F170-Y175 VanDerWaalsContact CD2-CD2 3.4Å; F170-Y175 AromaticContact CD2-CE2 3.74Å; F170-Y175 HydrophobicContact CD2-CE2 3.74Å; F170-Y175 HydrophobicContact CD2-CG 4.48Å; F170-Y175 AromaticContact CE2-CD2 3.28Å; F170-Y175 HydrophobicContact CE2-CD2 3.28Å; F170-Y175 AromaticContact CE2-CE2 3.9Å; F170-Y175 HydrophobicContact CE2-CE2 3.9Å; F170-Y175 AromaticContact CE2-CG 3.98Å; F170-Y175 HydrophobicContact CE2-CG 3.98Å; D173-Y175 HydrophobicContact CB-CE2 3.9Å; D173-Y175 WeakPolarHBondContact OD2-CE2 3.06Å; D173-Y175 PolarHBondContact OD2-OH 2.95Å; Y175-I185 HydrophobicContact CD1-CG2 3.45Å; Y175-I185 VanDerWaalsContact CD1-CG2 3.45Å; Y175-I185 HydrophobicContact CE1-CG2 4.28Å; Y175-I185 HydrophobicContact CG-CG2 4.07Å; Y175-K186 CarbonylContact C-O 3.49Å; Y175-K186 VanDerWaalsContact CA-O 3.25Å; Y175-K186 WeakPolarHBondContact CA-O 3.05Å; Y175-E187 VanDerWaalsContact CD1-CA 3.45Å; Y175-E187 HydrophobicContact CD1-CB 3.86Å; Y175-E187 HydrophobicContact CD1-CG 4.28Å; Y175-E187 HydrophobicContact CE1-CB 3.56Å; Y175-E187 HydrophobicContact CE1-CG 3.75Å; Y175-E187 HydrophobicContact CE2-CG 4.48Å
176	L	94	Very high	87.7	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	127.1	167.3	-166.1	78.3	0	0	0	108.9	C167 K186 L188 E220 E221	C167-L176 HydrophobicContact CB-CD1 3.92Å; L176-K186 HydrophobicContact CB-CB 4.45Å; L176-K186 PolarHBondContact N-O 2.74Å; L176-K186 PolarHBondContact O-N 2.83Å; L176-L188 HydrophobicContact CB-CD1 4.19Å; L176-L188 HydrophobicContact CB-CD2 4.29Å; L176-L188 HydrophobicContact CB-CG 4.35Å; L176-E220 WeakPolarHBondContact CD2-O 3.44Å; L176-E221 VanDerWaalsContact CD2-C 3.48Å
177	I	93	Very high	87.6	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	115.3	-178.8	-58.2	169.7	0	0	0	107.9	L133 L150 V152 S165 I166 V168 S184 I185	L133-I177 HydrophobicContact CD1-CD1 3.37Å; L150-I177 HydrophobicContact CD1-CG2 3.79Å; V152-I177 HydrophobicContact CG1-CD1 3.48Å; V152-I177 VanDerWaalsContact CG1-CD1 3.48Å; S165-I177 CarbonylContact C-O 3.54Å; S165-I177 WeakPolarHBondContact CA-O 3.43Å; I166-I177 PolarHBondContact N-O 2.89Å; I166-I177 PolarHBondContact O-N 3.03Å; V168-I177 HydrophobicContact CG2-CD1 3.86Å; I177-S184 WeakPolarHBondContact CA-O 3.5Å; I177-I185 HydrophobicContact CG1-CG1 4.43Å; I177-I185 HydrophobicContact CG1-CG2 4.19Å
178	R	89.6	Confident	87.4	Confident	85 Å²	85	58.2 Å²	58.2	32%	0.321	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	144	-179.4	-55.3	-167	174.5	167.3	1.4	111.1	D180 G183 S184 E221	R178-D180 VanDerWaalsContact C-N 3.28Å; R178-D180 PolarHBondContact O-N 2.87Å; R178-G183 VanDerWaalsContact O-CA 3.27Å; R178-G183 WeakPolarHBondContact O-CA 3.3Å; R178-S184 WeakPolarHBondContact CB-OG 3.36Å; R178-S184 PolarHBondContact N-O 3.39Å; R178-E221 VanDerWaalsContact NH2-CA 3.26Å; R178-E221 VanDerWaalsContact NH2-CB 3.32Å; R178-E221 PolarHBondContact NH2-O 3.46Å
179	L	84.2	Confident	87.2	Confident	34 Å²	34	59.9 Å²	59.9	18%	0.178	29%	0.286	C	S	.	.			trans	-94.3	42.7	178.2	-55.9	-179.8	0	0	0	112.3	L135 L150 W161 N164 I166 G181	L135-L179 HydrophobicContact CD1-CD2 3.5Å; L135-L179 VanDerWaalsContact CD1-CD2 3.5Å; L135-L179 HydrophobicContact CD2-CD2 4.48Å; L150-L179 HydrophobicContact CD1-CD2 4.12Å; W161-L179 HydrophobicContact CE3-CD1 4.37Å; W161-L179 HydrophobicContact CH2-CD1 3.83Å; W161-L179 HydrophobicContact CZ3-CD1 3.33Å; N164-L179 VanDerWaalsContact O-CB 3.27Å; N164-L179 WeakPolarHBondContact O-CB 3.46Å; N164-L179 WeakPolarHBondContact O-CG 3.42Å; N164-L179 PolarHBondContact O-N 2.96Å; I166-L179 HydrophobicContact CD1-CD1 4.4Å; I166-L179 HydrophobicContact CD1-CD2 4.32Å; L179-G181 PolarHBondContact O-N 2.89Å; L179-G181 VanDerWaalsContact O-N 3.16Å
180	D	74.6	Confident	86.9	Confident	92 Å²	92	63.6 Å²	63.6	49%	0.492	31%	0.31	S	S	.	.	S	Bend	trans	-80.9	20.2	-179.8	66.8	-14.9	0	0	0	113.9	R178 R182 G183 S184	R178-D180 VanDerWaalsContact C-N 3.28Å; R178-D180 PolarHBondContact O-N 2.87Å; D180-R182 PolarHBondContact O-N 2.9Å; D180-R182 PolarHBondContact OD1-N 3.16Å; D180-G183 PolarHBondContact OD1-N 3.4Å; D180-G183 VanDerWaalsContact OD1-N 3.1Å; D180-S184 PolarHBondContact OD1-N 2.8Å
181	G	66.1	Low	86.5	Confident	65 Å²	65	63.8 Å²	63.8	67%	0.67	31%	0.311	S	S	*	.	S	Bend	trans	77.8	-20	-175.6	0	0	0	0	0	115.2	L179	L179-G181 PolarHBondContact O-N 2.89Å; L179-G181 VanDerWaalsContact O-N 3.16Å
182	R	65.9	Low	86.1	Confident	234 Å²	234	61 Å²	61	88%	0.883	31%	0.308	S	S	*	.	S	Bend	trans	-98.9	-15.2	171.7	-74.2	-169.4	-121.5	-130.1	-0.4	113.6	D180	D180-R182 PolarHBondContact O-N 2.9Å; D180-R182 PolarHBondContact OD1-N 3.16Å
183	G	71.1	Confident	85.6	Confident	9 Å²	9	61 Å²	61	9%	0.093	31%	0.314	C	S	.	.			trans	71.9	39.8	179.9	0	0	0	0	0	111.7	R178 D180 I185	R178-G183 VanDerWaalsContact O-CA 3.27Å; R178-G183 WeakPolarHBondContact O-CA 3.3Å; D180-G183 PolarHBondContact OD1-N 3.4Å; D180-G183 VanDerWaalsContact OD1-N 3.1Å; G183-I185 VanDerWaalsContact O-CG1 3.31Å; G183-I185 WeakPolarHBondContact O-CG1 3.18Å; G183-I185 PolarHBondContact O-N 2.82Å
184	S	85.1	Confident	84.6	Confident	43 Å²	43	62.3 Å²	62.3	30%	0.301	32%	0.318	S	S	.	.			trans	-56	128.2	-176.7	76.2	0	0	0	0	110.6	I177 R178 D180	I177-S184 WeakPolarHBondContact CA-O 3.5Å; R178-S184 WeakPolarHBondContact CB-OG 3.36Å; R178-S184 PolarHBondContact N-O 3.39Å; D180-S184 PolarHBondContact OD1-N 2.8Å
185	I	89.4	Confident	83.7	Confident	80 Å²	80	66.2 Å²	66.2	41%	0.41	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	123.9	-177.6	-47.9	-178	0	0	0	107.9	G151 Y175 I177 G183	G151-I185 WeakPolarHBondContact O-CD1 3.19Å; Y175-I185 HydrophobicContact CD1-CG2 3.45Å; Y175-I185 VanDerWaalsContact CD1-CG2 3.45Å; Y175-I185 HydrophobicContact CE1-CG2 4.28Å; Y175-I185 HydrophobicContact CG-CG2 4.07Å; I177-I185 HydrophobicContact CG1-CG1 4.43Å; I177-I185 HydrophobicContact CG1-CG2 4.19Å; G183-I185 VanDerWaalsContact O-CG1 3.31Å; G183-I185 WeakPolarHBondContact O-CG1 3.18Å; G183-I185 PolarHBondContact O-N 2.82Å
186	K	91.6	Very high	83.4	Confident	75 Å²	75	71.3 Å²	71.3	33%	0.326	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	119.2	174.5	-176.3	-171.7	-177.7	-167.2	0	109.3	Y175 L176 L188 E221 G222	Y175-K186 CarbonylContact C-O 3.49Å; Y175-K186 VanDerWaalsContact CA-O 3.25Å; Y175-K186 WeakPolarHBondContact CA-O 3.05Å; L176-K186 HydrophobicContact CB-CB 4.45Å; L176-K186 PolarHBondContact N-O 2.74Å; L176-K186 PolarHBondContact O-N 2.83Å; K186-L188 HydrophobicContact CD-CD2 4.4Å; K186-E221 WeakPolarHBondContact CD-O 3.41Å; K186-E221 PolarHBondContact NZ-O 3.13Å; K186-G222 PolarHBondContact NZ-O 2.7Å
187	E	93	Very high	83.3	Confident	124 Å²	124	71.9 Å²	71.9	58%	0.579	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68	135.9	168.9	-168.2	-179.7	168.3	0	0	109.8	Y175	Y175-E187 VanDerWaalsContact CD1-CA 3.45Å; Y175-E187 HydrophobicContact CD1-CB 3.86Å; Y175-E187 HydrophobicContact CD1-CG 4.28Å; Y175-E187 HydrophobicContact CE1-CB 3.56Å; Y175-E187 HydrophobicContact CE1-CG 3.75Å; Y175-E187 HydrophobicContact CE2-CG 4.48Å
188	L	91.1	Very high	83.3	Confident	35 Å²	35	73.1 Å²	73.1	18%	0.183	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	-95.4	179.8	-61.4	171.3	0	0	0	109.9	Y174 L176 K186 L218	Y174-L188 WeakPolarHBondContact O-CB 3.45Å; Y174-L188 PolarHBondContact O-N 2.95Å; L176-L188 HydrophobicContact CB-CD1 4.19Å; L176-L188 HydrophobicContact CB-CD2 4.29Å; L176-L188 HydrophobicContact CB-CG 4.35Å; K186-L188 HydrophobicContact CD-CD2 4.4Å; L188-L218 HydrophobicContact CD1-CD1 3.49Å; L188-L218 VanDerWaalsContact CD1-CD1 3.49Å; L188-L218 HydrophobicContact CD2-CD1 4.26Å; L188-L218 HydrophobicContact CG-CD1 4.43Å
189	F	90.1	Very high	83.5	Confident	35 Å²	35	69.8 Å²	69.8	15%	0.154	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	163.5	-177.6	51.5	-96.4	0	0	0	111.4	Y174 V209 Q211 V216 L218	Y174-F189 AromaticContact CD2-CD2 3.91Å; Y174-F189 HydrophobicContact CD2-CD2 3.91Å; Y174-F189 AromaticContact CD2-CE2 3.66Å; Y174-F189 HydrophobicContact CD2-CE2 3.66Å; Y174-F189 HydrophobicContact CD2-CZ 4.38Å; Y174-F189 HydrophobicContact CE2-CD2 4.45Å; Y174-F189 AromaticContact CE2-CE2 3.95Å; Y174-F189 HydrophobicContact CE2-CE2 3.95Å; Y174-F189 PolarHBondContact N-O 2.77Å; F189-V209 HydrophobicContact CE2-CG1 3.85Å; F189-V209 HydrophobicContact CZ-CB 3.92Å; F189-V209 HydrophobicContact CZ-CG1 3.55Å; F189-Q211 HydrophobicContact CD2-CB 4.45Å; F189-Q211 HydrophobicContact CE2-CB 4.07Å; F189-V216 HydrophobicContact CE1-CB 4.33Å; F189-V216 HydrophobicContact CE1-CG1 4.34Å; F189-V216 HydrophobicContact CZ-CB 4.01Å; F189-V216 HydrophobicContact CZ-CG2 4.14Å; F189-L218 HydrophobicContact CE1-CD1 4.24Å; F189-L218 HydrophobicContact CE1-CD2 4.43Å
190	P	90	Very high	84	Confident	79 Å²	79	68.4 Å²	68.4	51%	0.513	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	150.9	179.2	-22.4	34.6	0	0	0	114	R172 G192 Q211	R172-P190 CarbonylContact O-C 3.58Å; R172-P190 WeakPolarHBondContact O-CA 3.3Å; R172-P190 WeakPolarHBondContact O-CB 3.32Å; P190-G192 PolarHBondContact O-N 2.98Å; P190-Q211 PolarHBondContact O-NE2 3.12Å
191	T	84.5	Confident	84.8	Confident	4 Å²	4	67.7 Å²	67.7	3%	0.025	36%	0.357	C	S	.	.			trans	-71.6	-12.8	-178.7	53.1	0	0	0	0	115.2	F170 K171 R172 Y174 P197	F170-T191 WeakPolarHBondContact O-CG2 3.48Å; K171-T191 PolarHBondContact O-OG1 3.01Å; K171-T191 VanDerWaalsContact O-OG1 3.08Å; R172-T191 WeakPolarHBondContact CA-OG1 3.41Å; R172-T191 PolarHBondContact O-N 2.82Å; R172-T191 PolarHBondContact O-OG1 2.87Å; Y174-T191 HydrophobicContact CD2-CG2 3.91Å; Y174-T191 HydrophobicContact CE1-CG2 4.38Å; Y174-T191 HydrophobicContact CE2-CG2 3.58Å; Y174-T191 HydrophobicContact CG-CG2 4.45Å; T191-P197 HydrophobicContact CG2-CB 3.81Å
192	G	83.1	Confident	85.9	Confident	31 Å²	31	65.6 Å²	65.6	32%	0.32	33%	0.33	S	S	.	.			trans	97.5	-158.1	-179.2	0	0	0	0	0	113.6	P190 Q194 D212	P190-G192 PolarHBondContact O-N 2.98Å; G192-Q194 VanDerWaalsContact C-N 3.32Å; G192-D212 WeakPolarHBondContact CA-OD2 3.48Å
193	K	79.3	Confident	86.7	Confident	192 Å²	192	56.2 Å²	56.2	84%	0.835	30%	0.303	S	S	*	.	S	Bend	trans	-69.6	-31.6	175.4	-63.9	175.5	-175.3	169.2	0	111.6	D212	K193-D212 WeakPolarHBondContact CA-OD1 3.45Å; K193-D212 WeakPolarHBondContact CB-OD1 3.44Å; K193-D212 VanDerWaalsContact N-CG 3.33Å; K193-D212 PolarHBondContact N-OD1 3.16Å; K193-D212 PolarHBondContact N-OD2 3.24Å; K193-D212 VanDerWaalsContact N-OD2 3.11Å
194	Q	72.6	Confident	87.1	Confident	58 Å²	58	62.1 Å²	62.1	27%	0.271	33%	0.332	S	S	.	.			trans	-79.5	129.2	176.8	-166.8	156.4	-31	0	0	111	G192 E196 D212	G192-Q194 VanDerWaalsContact C-N 3.32Å; Q194-E196 VanDerWaalsContact C-N 3.27Å; Q194-E196 HydrophobicContact CG-CB 4.38Å; Q194-E196 PolarHBondContact O-N 3.38Å; Q194-D212 PolarHBondContact N-OD1 2.89Å; Q194-D212 VanDerWaalsContact N-OD1 3.11Å
195	L	76.2	Confident	87.1	Confident	85 Å²	85	61 Å²	61	45%	0.445	33%	0.328	S	S	.	.	S	Bend	trans	-91.8	15.6	-176.3	-61.8	171.5	0	0	0	112.9	K157 K171	K157-L195 PolarHBondContact NZ-O 2.88Å; K171-L195 HydrophobicContact CG-CB 4.09Å; K171-L195 HydrophobicContact CG-CD2 3.94Å; K171-L195 WeakPolarHBondContact O-CD2 3.42Å
196	E	86.1	Confident	87.2	Confident	136 Å²	136	60.5 Å²	60.5	64%	0.636	32%	0.323	S	S	*	.	S	Bend	trans	-121.3	100.8	176.6	-69.2	-169.3	166.5	0	0	108.5	Q194	Q194-E196 VanDerWaalsContact C-N 3.27Å; Q194-E196 HydrophobicContact CG-CB 4.38Å; Q194-E196 PolarHBondContact O-N 3.38Å
197	P	92	Very high	87.3	Confident	12 Å²	12	56.9 Å²	56.9	8%	0.078	31%	0.307	C	S	.	.			trans	-72.2	148.9	-179	29.8	-36.6	0	0	0	111.8	K157 S158 G169 F170 Y174 T191	K157-P197 HydrophobicContact CB-CG 3.52Å; K157-P197 HydrophobicContact CD-CG 4.44Å; S158-P197 WeakPolarHBondContact CB-O 3.48Å; S158-P197 WeakPolarHBondContact OG-CB 3.41Å; S158-P197 WeakPolarHBondContact OG-CG 3.47Å; S158-P197 PolarHBondContact OG-O 3.17Å; G169-P197 WeakPolarHBondContact O-CG 3.29Å; F170-P197 WeakPolarHBondContact O-CD 3.48Å; F170-P197 WeakPolarHBondContact O-CG 3.48Å; Y174-P197 HydrophobicContact CD1-CB 4.45Å; Y174-P197 HydrophobicContact CE1-CB 3.46Å; Y174-P197 VanDerWaalsContact CE1-CB 3.46Å; Y174-P197 VanDerWaalsContact OH-CA 3.22Å; Y174-P197 WeakPolarHBondContact OH-CA 3.31Å; Y174-P197 WeakPolarHBondContact OH-CB 3.29Å; T191-P197 HydrophobicContact CG2-CB 3.81Å
198	L	93.8	Very high	87.3	Confident	28 Å²	28	51 Å²	51	15%	0.147	28%	0.279	C	S	.	.			trans	-124.5	122.8	177.2	179.9	58.6	0	0	0	110.5	Y174 G210 P236 M239	Y174-L198 PolarHBondContact OH-N 2.83Å; Y174-L198 PolarHBondContact OH-O 3.41Å; L198-G210 PolarHBondContact O-N 2.79Å; L198-P236 HydrophobicContact CD2-CB 3.78Å; L198-P236 WeakPolarHBondContact CD2-O 3.36Å; L198-M239 HydrophobicContact CD2-CE 3.52Å; L198-M239 HydrophobicContact CD2-CG 3.98Å; L198-M239 HydrophobicContact CD2-SD 4.37Å; L198-M239 HydrophobicContact CG-CE 3.71Å
199	V	94.7	Very high	87.4	Confident	14 Å²	14	49.3 Å²	49.3	9%	0.085	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	127.5	174.4	-172.7	0	0	0	0	107.8	A160 C167 Y174 V207 A208 V209	A160-V199 HydrophobicContact CB-CB 4.39Å; A160-V199 HydrophobicContact CB-CG1 3.58Å; C167-V199 HydrophobicContact CB-CG1 3.93Å; Y174-V199 HydrophobicContact CD1-CG2 4.04Å; Y174-V199 HydrophobicContact CE1-CG2 3.65Å; V199-V207 HydrophobicContact CG1-CB 4.38Å; V199-A208 CarbonylContact C-O 3.49Å; V199-A208 WeakPolarHBondContact CA-O 3.31Å; V199-V209 HydrophobicContact CG1-CG2 4.44Å
200	A	93.5	Very high	87.5	Confident	5 Å²	5	48 Å²	48	4%	0.041	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	137	177	0	0	0	0	0	110.5	V207 A208 M239	A200-V207 CarbonylContact O-C 3.59Å; A200-V207 WeakPolarHBondContact O-CA 3.15Å; A200-A208 HydrophobicContact CB-CB 4.47Å; A200-A208 PolarHBondContact N-O 3.02Å; A200-A208 PolarHBondContact O-N 2.64Å; A200-M239 HydrophobicContact CB-CB 3.91Å
201	P	91.8	Very high	87.6	Confident	77 Å²	77	47 Å²	47	50%	0.5	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	144.8	173.8	29.9	-33.5	0	0	0	110.7	A160	A160-P201 HydrophobicContact CB-CB 4.46Å
202	L	90.1	Very high	87.8	Confident	22 Å²	22	48.4 Å²	48.4	12%	0.115	26%	0.263	C	S	.	.			trans	-116.9	172.1	172.1	-58.8	178.6	0	0	0	109.9	K206 A208 V217 H241 I246 L259	L202-K206 WeakPolarHBondContact CA-O 3.35Å; L202-K206 HydrophobicContact CB-CB 4.1Å; L202-K206 WeakPolarHBondContact CB-O 3.09Å; L202-K206 HydrophobicContact CD1-CB 4.27Å; L202-K206 PolarHBondContact N-O 3Å; L202-A208 HydrophobicContact CD1-CB 3.99Å; L202-A208 HydrophobicContact CD2-CB 3.87Å; L202-A208 HydrophobicContact CG-CB 3.96Å; L202-V217 HydrophobicContact CD1-CB 4.22Å; L202-V217 HydrophobicContact CD1-CG1 3.48Å; L202-V217 VanDerWaalsContact CD1-CG1 3.48Å; L202-V217 HydrophobicContact CD1-CG2 3.77Å; L202-H241 HydrophobicContact CD2-CB 3.57Å; L202-I246 HydrophobicContact CD2-CD1 4.17Å; L202-L259 HydrophobicContact CD1-CD1 4.05Å
203	A	81.4	Confident	88.2	Confident	36 Å²	36	50.2 Å²	50.2	30%	0.298	27%	0.265	S	S	.	.	S	Bend	trans	-66.3	164.7	169.4	0	0	0	0	0	111.1	G205 H241 P243	A203-G205 VanDerWaalsContact C-N 3.3Å; A203-G205 PolarHBondContact O-N 3.06Å; A203-H241 PolarHBondContact N-ND1 3.2Å; A203-H241 VanDerWaalsContact N-ND1 3.19Å; A203-P243 HydrophobicContact CB-CG 4.04Å
204	D	80.6	Confident	88.8	Confident	133 Å²	133	43.8 Å²	43.8	71%	0.711	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.2	36	177.1	-46.2	-33.8	0	0	0	114.1	K206	D204-K206 VanDerWaalsContact C-N 3.29Å; D204-K206 PolarHBondContact O-N 3.21Å
205	G	83.9	Confident	89.8	Confident	21 Å²	21	41 Å²	41	22%	0.216	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.3	22.5	172.4	0	0	0	0	0	114.8	C162 A203	C162-G205 PolarHBondContact SG-O 3.29Å; A203-G205 VanDerWaalsContact C-N 3.3Å; A203-G205 PolarHBondContact O-N 3.06Å
206	K	91.6	Very high	90.6	Very high	68 Å²	68	38 Å²	38	30%	0.296	21%	0.212	S	C	.	.			trans	-106.4	164.9	-179.4	-66.3	168.3	-164.2	160.9	0	111.4	L202 D204 V217 L218 T225	L202-K206 WeakPolarHBondContact CA-O 3.35Å; L202-K206 HydrophobicContact CB-CB 4.1Å; L202-K206 WeakPolarHBondContact CB-O 3.09Å; L202-K206 HydrophobicContact CD1-CB 4.27Å; L202-K206 PolarHBondContact N-O 3Å; D204-K206 VanDerWaalsContact C-N 3.29Å; D204-K206 PolarHBondContact O-N 3.21Å; K206-V217 HydrophobicContact CB-CG1 3.96Å; K206-V217 HydrophobicContact CD-CG1 4.05Å; K206-V217 HydrophobicContact CG-CG1 4.4Å; K206-L218 VanDerWaalsContact CA-O 3.3Å; K206-L218 WeakPolarHBondContact CA-O 3.37Å; K206-L218 WeakPolarHBondContact CB-O 3.49Å; K206-T225 HydrophobicContact CD-CG2 4.17Å; K206-T225 HydrophobicContact CG-CG2 4.47Å
207	V	93.4	Very high	90.9	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	140.4	173.9	-67	0	0	0	0	111.3	A160 W161 C162 C167 V199 A200 V209 V217 L218	A160-V207 HydrophobicContact CB-CG1 4.25Å; W161-V207 VanDerWaalsContact O-CG1 3.24Å; W161-V207 WeakPolarHBondContact O-CG1 3.33Å; C162-V207 HydrophobicContact CB-CG1 3.6Å; C162-V207 HydrophobicContact CB-CG2 4.2Å; C167-V207 HydrophobicContact CB-CG2 3.85Å; V199-V207 HydrophobicContact CG1-CB 4.38Å; A200-V207 CarbonylContact O-C 3.59Å; A200-V207 WeakPolarHBondContact O-CA 3.15Å; V207-V209 HydrophobicContact CG2-CG2 4.23Å; V207-V217 WeakPolarHBondContact O-CA 3.49Å; V207-L218 HydrophobicContact CG2-CB 3.96Å; V207-L218 PolarHBondContact N-O 3.43Å; V207-L218 PolarHBondContact O-N 2.83Å
208	A	94	Very high	90.9	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	126.2	169.5	0	0	0	0	0	109.3	V199 A200 L202 T215 M239 I246	V199-A208 CarbonylContact C-O 3.49Å; V199-A208 WeakPolarHBondContact CA-O 3.31Å; A200-A208 HydrophobicContact CB-CB 4.47Å; A200-A208 PolarHBondContact N-O 3.02Å; A200-A208 PolarHBondContact O-N 2.64Å; L202-A208 HydrophobicContact CD1-CB 3.99Å; L202-A208 HydrophobicContact CD2-CB 3.87Å; L202-A208 HydrophobicContact CG-CB 3.96Å; A208-T215 HydrophobicContact CB-CG2 3.72Å; A208-M239 HydrophobicContact CB-CE 4.22Å; A208-I246 HydrophobicContact CB-CD1 4.23Å
209	V	93.9	Very high	90.8	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	121.4	-179	-176.5	0	0	0	0	109.3	C167 Y174 F189 V199 V207 T215 V216 L218	C167-V209 VanDerWaalsContact SG-CG2 3.57Å; Y174-V209 HydrophobicContact CD1-CG1 3.58Å; Y174-V209 HydrophobicContact CD2-CG1 3.58Å; Y174-V209 HydrophobicContact CE1-CG1 3.52Å; Y174-V209 HydrophobicContact CE2-CG1 3.48Å; Y174-V209 VanDerWaalsContact CE2-CG1 3.48Å; Y174-V209 HydrophobicContact CG-CG1 3.63Å; Y174-V209 VanDerWaalsContact CZ-CG1 3.46Å; F189-V209 HydrophobicContact CE2-CG1 3.85Å; F189-V209 HydrophobicContact CZ-CB 3.92Å; F189-V209 HydrophobicContact CZ-CG1 3.55Å; V199-V209 HydrophobicContact CG1-CG2 4.44Å; V207-V209 HydrophobicContact CG2-CG2 4.23Å; V209-T215 CarbonylContact O-C 3.57Å; V209-T215 WeakPolarHBondContact O-CA 3.45Å; V209-V216 PolarHBondContact N-O 3.11Å; V209-V216 PolarHBondContact O-N 3.08Å; V209-L218 HydrophobicContact CB-CD1 4.39Å; V209-L218 HydrophobicContact CG2-CD1 3.65Å; V209-L218 HydrophobicContact CG2-CG 4.22Å
210	G	92	Very high	90.5	Very high	7 Å²	7	34.1 Å²	34.1	7%	0.072	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	137.9	-179	0	0	0	0	0	113	Y174 L198 L214	Y174-G210 WeakPolarHBondContact CE2-O 3.39Å; Y174-G210 PolarHBondContact OH-O 3.04Å; L198-G210 PolarHBondContact O-N 2.79Å; G210-L214 CarbonylContact C-O 3.5Å; G210-L214 WeakPolarHBondContact CA-O 3.18Å
211	Q	90.6	Very high	90.2	Very high	57 Å²	57	37.2 Å²	37.2	27%	0.266	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	99.8	171.1	-175.8	-179.4	15.4	0	0	108.1	F189 P190 D213 L214	F189-Q211 HydrophobicContact CD2-CB 4.45Å; F189-Q211 HydrophobicContact CE2-CB 4.07Å; P190-Q211 PolarHBondContact O-NE2 3.12Å; Q211-D213 PolarHBondContact O-N 2.88Å; Q211-L214 PolarHBondContact N-O 3.41Å; Q211-L214 WeakPolarHBondContact O-CA 3.47Å; Q211-L214 WeakPolarHBondContact O-CB 3.4Å; Q211-L214 PolarHBondContact O-N 3.4Å
212	D	89.9	Confident	89.9	Confident	34 Å²	34	33.9 Å²	33.9	18%	0.182	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.7	-124.3	-168.1	-61.6	-40.6	0	0	0	111.5	G192 K193 Q194 L214 I235	G192-D212 WeakPolarHBondContact CA-OD2 3.48Å; K193-D212 WeakPolarHBondContact CA-OD1 3.45Å; K193-D212 WeakPolarHBondContact CB-OD1 3.44Å; K193-D212 VanDerWaalsContact N-CG 3.33Å; K193-D212 PolarHBondContact N-OD1 3.16Å; K193-D212 PolarHBondContact N-OD2 3.24Å; K193-D212 VanDerWaalsContact N-OD2 3.11Å; Q194-D212 PolarHBondContact N-OD1 2.89Å; Q194-D212 VanDerWaalsContact N-OD1 3.11Å; D212-L214 PolarHBondContact O-N 2.87Å; D212-I235 VanDerWaalsContact O-CG2 3.3Å; D212-I235 WeakPolarHBondContact O-CG2 3.3Å
213	D	91.1	Very high	89.8	Confident	69 Å²	69	36.5 Å²	36.5	37%	0.369	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	3.2	177	60	-20.3	0	0	0	113.4	Q211 W232	Q211-D213 PolarHBondContact O-N 2.88Å; D213-W232 WeakPolarHBondContact O-CB 3.35Å; D213-W232 VanDerWaalsContact O-CD1 3.22Å; D213-W232 PolarHBondContact O-N 2.94Å
214	L	92.2	Very high	90	Very high	58 Å²	58	38 Å²	38	30%	0.304	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	152.4	179.1	-59.1	176.7	0	0	0	111.9	G210 Q211 D212 A229 L230 N231	G210-L214 CarbonylContact C-O 3.5Å; G210-L214 WeakPolarHBondContact CA-O 3.18Å; Q211-L214 PolarHBondContact N-O 3.41Å; Q211-L214 WeakPolarHBondContact O-CA 3.47Å; Q211-L214 WeakPolarHBondContact O-CB 3.4Å; Q211-L214 PolarHBondContact O-N 3.4Å; D212-L214 PolarHBondContact O-N 2.87Å; L214-A229 HydrophobicContact CB-CB 4.08Å; L214-A229 HydrophobicContact CD2-CB 4.38Å; L214-L230 CarbonylContact C-O 3.55Å; L214-L230 VanDerWaalsContact CA-O 3.28Å; L214-L230 WeakPolarHBondContact CA-O 3.06Å; L214-N231 HydrophobicContact CD2-CB 3.72Å
215	T	93.1	Very high	90.1	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	127.8	168.4	-67	0	0	0	0	110.6	A208 V209 A229 L230 W232 M239	A208-T215 HydrophobicContact CB-CG2 3.72Å; V209-T215 CarbonylContact O-C 3.57Å; V209-T215 WeakPolarHBondContact O-CA 3.45Å; T215-A229 CarbonylContact O-C 3.56Å; T215-A229 WeakPolarHBondContact O-CA 3.21Å; T215-A229 WeakPolarHBondContact O-CB 3.32Å; T215-L230 PolarHBondContact N-O 2.83Å; T215-L230 PolarHBondContact O-N 2.94Å; T215-W232 PolarHBondContact OG1-NE1 3.37Å; T215-M239 HydrophobicContact CG2-CE 3.92Å; T215-M239 HydrophobicContact CG2-SD 4.07Å
216	V	92.1	Very high	89.7	Confident	21 Å²	21	35.4 Å²	35.4	13%	0.127	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	136.1	179.2	-178.4	0	0	0	0	108.7	F189 V209 L218 C224 A229	F189-V216 HydrophobicContact CE1-CB 4.33Å; F189-V216 HydrophobicContact CE1-CG1 4.34Å; F189-V216 HydrophobicContact CZ-CB 4.01Å; F189-V216 HydrophobicContact CZ-CG2 4.14Å; V209-V216 PolarHBondContact N-O 3.11Å; V209-V216 PolarHBondContact O-N 3.08Å; V216-L218 HydrophobicContact CG1-CD2 3.85Å; V216-L218 HydrophobicContact CG1-CG 4.43Å; V216-C224 HydrophobicContact CG1-CB 4.14Å; V216-C224 WeakPolarHBondContact CG1-SG 3.33Å; V216-A229 HydrophobicContact CG2-CB 3.94Å
217	V	92.9	Very high	88.7	Confident	3 Å²	3	42.3 Å²	42.3	2%	0.018	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	125.6	174.5	-177.6	0	0	0	0	110	L202 K206 V207 C224 T225 Q226 L259	L202-V217 HydrophobicContact CD1-CB 4.22Å; L202-V217 HydrophobicContact CD1-CG1 3.48Å; L202-V217 VanDerWaalsContact CD1-CG1 3.48Å; L202-V217 HydrophobicContact CD1-CG2 3.77Å; K206-V217 HydrophobicContact CB-CG1 3.96Å; K206-V217 HydrophobicContact CD-CG1 4.05Å; K206-V217 HydrophobicContact CG-CG1 4.4Å; V207-V217 WeakPolarHBondContact O-CA 3.49Å; V217-C224 VanDerWaalsContact O-CA 3.31Å; V217-C224 WeakPolarHBondContact O-CA 3.32Å; V217-T225 VanDerWaalsContact CG1-OG1 3.31Å; V217-T225 WeakPolarHBondContact CG1-OG1 3.14Å; V217-T225 PolarHBondContact O-N 3.19Å; V217-Q226 HydrophobicContact CB-CG 4.29Å; V217-Q226 HydrophobicContact CG2-CG 4.42Å; V217-L259 HydrophobicContact CG2-CD1 4.49Å; V217-L259 HydrophobicContact CG2-CD2 3.95Å
218	L	92.3	Very high	87.9	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	146.9	-179.1	-56	177.5	0	0	0	110.9	L188 F189 K206 V207 V209 V216 V223	L188-L218 HydrophobicContact CD1-CD1 3.49Å; L188-L218 VanDerWaalsContact CD1-CD1 3.49Å; L188-L218 HydrophobicContact CD2-CD1 4.26Å; L188-L218 HydrophobicContact CG-CD1 4.43Å; F189-L218 HydrophobicContact CE1-CD1 4.24Å; F189-L218 HydrophobicContact CE1-CD2 4.43Å; K206-L218 VanDerWaalsContact CA-O 3.3Å; K206-L218 WeakPolarHBondContact CA-O 3.37Å; K206-L218 WeakPolarHBondContact CB-O 3.49Å; V207-L218 HydrophobicContact CG2-CB 3.96Å; V207-L218 PolarHBondContact N-O 3.43Å; V207-L218 PolarHBondContact O-N 2.83Å; V209-L218 HydrophobicContact CB-CD1 4.39Å; V209-L218 HydrophobicContact CG2-CD1 3.65Å; V209-L218 HydrophobicContact CG2-CG 4.22Å; V216-L218 HydrophobicContact CG1-CD2 3.85Å; V216-L218 HydrophobicContact CG1-CG 4.43Å; L218-V223 WeakPolarHBondContact CA-O 3.39Å
219	N	91.2	Very high	87.5	Confident	37 Å²	37	47.1 Å²	47.1	20%	0.198	26%	0.257	C	S	.	.			trans	-93.5	-175.4	169.4	66.7	-1.9	0	0	0	112.2	C162 E221 G222 V223 T225	C162-N219 PolarHBondContact SG-O 3.16Å; N219-E221 PolarHBondContact ND2-OE2 2.84Å; N219-E221 PolarHBondContact O-N 2.82Å; N219-E221 VanDerWaalsContact O-N 3.16Å; N219-E221 PolarHBondContact OD1-N 3.47Å; N219-E221 PolarHBondContact OD1-OE2 3.35Å; N219-G222 PolarHBondContact O-N 2.88Å; N219-G222 PolarHBondContact OD1-N 3.28Å; N219-V223 PolarHBondContact N-O 2.82Å; N219-V223 WeakPolarHBondContact OD1-CA 3.41Å; N219-V223 WeakPolarHBondContact OD1-CB 3.3Å; N219-V223 PolarHBondContact OD1-N 2.94Å; N219-V223 PolarHBondContact OD1-O 2.89Å; N219-T225 HydrophobicContact CB-CG2 3.71Å
220	E	88.6	Confident	87.3	Confident	67 Å²	67	47.2 Å²	47.2	31%	0.313	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-21.8	-179.3	66.2	166.6	170	0	0	114	S165 L176	S165-E220 PolarHBondContact OG-O 2.87Å; L176-E220 WeakPolarHBondContact CD2-O 3.44Å
221	E	87.7	Confident	87.3	Confident	70 Å²	70	50.7 Å²	50.7	33%	0.327	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-5.7	175.6	-57.6	89	166.9	0	0	114.2	L176 R178 K186 N219 V223	L176-E221 VanDerWaalsContact CD2-C 3.48Å; R178-E221 VanDerWaalsContact NH2-CA 3.26Å; R178-E221 VanDerWaalsContact NH2-CB 3.32Å; R178-E221 PolarHBondContact NH2-O 3.46Å; K186-E221 WeakPolarHBondContact CD-O 3.41Å; K186-E221 PolarHBondContact NZ-O 3.13Å; N219-E221 PolarHBondContact ND2-OE2 2.84Å; N219-E221 PolarHBondContact O-N 2.82Å; N219-E221 VanDerWaalsContact O-N 3.16Å; N219-E221 PolarHBondContact OD1-N 3.47Å; N219-E221 PolarHBondContact OD1-OE2 3.35Å; E221-V223 HydrophobicContact CB-CG2 4.17Å
222	G	84.6	Confident	87.5	Confident	7 Å²	7	48.2 Å²	48.2	7%	0.072	26%	0.262	C	S	.	.	S	Bend	trans	72.1	35.2	-175.7	0	0	0	0	0	112.1	K186 N219	K186-G222 PolarHBondContact NZ-O 2.7Å; N219-G222 PolarHBondContact O-N 2.88Å; N219-G222 PolarHBondContact OD1-N 3.28Å
223	V	88.4	Confident	87.6	Confident	77 Å²	77	50 Å²	50	47%	0.467	28%	0.275	S	S	.	.			trans	-102.8	136.8	172.6	-179.6	0	0	0	0	108.1	L218 N219 E221 T225	L218-V223 WeakPolarHBondContact CA-O 3.39Å; N219-V223 PolarHBondContact N-O 2.82Å; N219-V223 WeakPolarHBondContact OD1-CA 3.41Å; N219-V223 WeakPolarHBondContact OD1-CB 3.3Å; N219-V223 PolarHBondContact OD1-N 2.94Å; N219-V223 PolarHBondContact OD1-O 2.89Å; E221-V223 HydrophobicContact CB-CG2 4.17Å; V223-T225 PolarHBondContact O-N 2.81Å
224	C	86.8	Confident	87.7	Confident	69 Å²	69	49.6 Å²	49.6	47%	0.466	27%	0.273	S	S	.	.	B	Isolated β-bridge	trans	-65.4	116.2	176.8	-56.6	0	0	0	0	109.9	V216 V217 Q226	V216-C224 HydrophobicContact CG1-CB 4.14Å; V216-C224 WeakPolarHBondContact CG1-SG 3.33Å; V217-C224 VanDerWaalsContact O-CA 3.31Å; V217-C224 WeakPolarHBondContact O-CA 3.32Å; C224-Q226 VanDerWaalsContact C-N 3.27Å; C224-Q226 PolarHBondContact O-N 2.82Å
225	T	81.6	Confident	87.7	Confident	60 Å²	60	49 Å²	49	37%	0.368	27%	0.269	S	S	.	.	S	Bend	trans	-76.7	-19.4	179.2	60.6	0	0	0	0	112.3	K206 V217 N219 V223	K206-T225 HydrophobicContact CD-CG2 4.17Å; K206-T225 HydrophobicContact CG-CG2 4.47Å; V217-T225 VanDerWaalsContact CG1-OG1 3.31Å; V217-T225 WeakPolarHBondContact CG1-OG1 3.14Å; V217-T225 PolarHBondContact O-N 3.19Å; N219-T225 HydrophobicContact CB-CG2 3.71Å; V223-T225 PolarHBondContact O-N 2.81Å
226	Q	75.8	Confident	87.7	Confident	38 Å²	38	49.3 Å²	49.3	18%	0.178	27%	0.271	C	S	.	.	S	Bend	trans	-106	143	-178.9	-65.8	-176.2	-5.2	0	0	111.7	V217 C224 C228	V217-Q226 HydrophobicContact CB-CG 4.29Å; V217-Q226 HydrophobicContact CG2-CG 4.42Å; C224-Q226 VanDerWaalsContact C-N 3.27Å; C224-Q226 PolarHBondContact O-N 2.82Å; Q226-C228 VanDerWaalsContact C-N 3.29Å; Q226-C228 PolarHBondContact O-N 3.21Å
227	K	71.1	Confident	87.8	Confident	214 Å²	214	51.7 Å²	51.7	93%	0.93	28%	0.282	S	S	*	.	S	Bend	trans	-64.7	-28.6	179.3	-69.5	-178.1	179.4	175	0	113.7
228	C	75.3	Confident	87.8	Confident	68 Å²	68	52.4 Å²	52.4	46%	0.459	29%	0.289	S	S	.	.	S	Bend	trans	-145.2	152.8	170.4	-17.8	0	0	0	0	110.4	Q226 R262	Q226-C228 VanDerWaalsContact C-N 3.29Å; Q226-C228 PolarHBondContact O-N 3.21Å; C228-R262 VanDerWaalsContact CA-NH1 3.32Å; C228-R262 PolarHBondContact O-NH1 2.65Å; C228-R262 PolarHBondContact SG-NH1 2.84Å; C228-R262 PolarHBondContact SG-NH2 2.87Å
229	A	85.6	Confident	87.9	Confident	32 Å²	32	52.9 Å²	52.9	26%	0.264	29%	0.291	S	S	.	.			trans	-60.1	152.2	174.9	0	0	0	0	0	112.5	L214 T215 V216	L214-A229 HydrophobicContact CB-CB 4.08Å; L214-A229 HydrophobicContact CD2-CB 4.38Å; T215-A229 CarbonylContact O-C 3.56Å; T215-A229 WeakPolarHBondContact O-CA 3.21Å; T215-A229 WeakPolarHBondContact O-CB 3.32Å; V216-A229 HydrophobicContact CG2-CB 3.94Å
230	L	90.6	Very high	88.1	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.01	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	129.7	169.2	-170.7	70.4	0	0	0	108.7	L214 T215 W232 I246 R257 L259 R262	L214-L230 CarbonylContact C-O 3.55Å; L214-L230 VanDerWaalsContact CA-O 3.28Å; L214-L230 WeakPolarHBondContact CA-O 3.06Å; T215-L230 PolarHBondContact N-O 2.83Å; T215-L230 PolarHBondContact O-N 2.94Å; L230-W232 HydrophobicContact CD2-CD2 4.43Å; L230-W232 HydrophobicContact CD2-CH2 3.64Å; L230-W232 HydrophobicContact CD2-CZ2 3.26Å; L230-W232 HydrophobicContact CD2-CZ3 4.35Å; L230-W232 HydrophobicContact CG-CZ2 4.29Å; L230-I246 HydrophobicContact CD2-CG2 3.73Å; L230-R257 HydrophobicContact CD1-CB 4.33Å; L230-R257 HydrophobicContact CD2-CB 4.23Å; L230-L259 HydrophobicContact CD2-CD2 4.37Å; L230-R262 HydrophobicContact CD1-CG 4.45Å
231	N	92.6	Very high	88.2	Confident	81 Å²	81	51.5 Å²	51.5	43%	0.433	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	106	-174.9	-178.8	16.7	0	0	0	111.9	L214 R257	L214-N231 HydrophobicContact CD2-CB 3.72Å; N231-R257 PolarHBondContact O-NH1 2.74Å; N231-R257 PolarHBondContact O-NH2 3.08Å
232	W	93.7	Very high	88.4	Confident	4 Å²	4	49 Å²	49	2%	0.015	27%	0.272	C	S	.	.			trans	-76.9	162.3	179.4	-55.6	103.6	0	0	0	112.3	D213 T215 L230 D234 P236 M239 I246 A248 E255 R257	D213-W232 WeakPolarHBondContact O-CB 3.35Å; D213-W232 VanDerWaalsContact O-CD1 3.22Å; D213-W232 PolarHBondContact O-N 2.94Å; T215-W232 PolarHBondContact OG1-NE1 3.37Å; L230-W232 HydrophobicContact CD2-CD2 4.43Å; L230-W232 HydrophobicContact CD2-CH2 3.64Å; L230-W232 HydrophobicContact CD2-CZ2 3.26Å; L230-W232 HydrophobicContact CD2-CZ3 4.35Å; L230-W232 HydrophobicContact CG-CZ2 4.29Å; W232-D234 VanDerWaalsContact C-N 3.34Å; W232-D234 WeakPolarHBondContact CB-O 3.49Å; W232-P236 HydrophobicContact CB-CG 4.16Å; W232-P236 HydrophobicContact CD2-CG 4Å; W232-P236 HydrophobicContact CG-CG 3.57Å; W232-M239 HydrophobicContact CZ2-SD 3.83Å; W232-I246 HydrophobicContact CH2-CG1 4.22Å; W232-I246 HydrophobicContact CH2-CG2 3.86Å; W232-I246 HydrophobicContact CZ2-CD1 4.25Å; W232-I246 HydrophobicContact CZ2-CG1 4.3Å; W232-I246 HydrophobicContact CZ2-CG2 4.3Å; W232-A248 HydrophobicContact CD2-CB 4.08Å; W232-A248 HydrophobicContact CE3-CB 3.77Å; W232-A248 HydrophobicContact CH2-CB 3.4Å; W232-A248 HydrophobicContact CZ2-CB 3.73Å; W232-A248 HydrophobicContact CZ3-CB 3.42Å; W232-A248 VanDerWaalsContact CZ3-CB 3.42Å; W232-E255 HydrophobicContact CE3-CB 4.21Å; W232-E255 HydrophobicContact CE3-CG 3.98Å; W232-E255 HydrophobicContact CZ3-CB 4.24Å; W232-E255 HydrophobicContact CZ3-CG 4.07Å; W232-R257 HydrophobicContact CE3-CG 4.17Å; W232-R257 HydrophobicContact CH2-CB 4.23Å; W232-R257 HydrophobicContact CH2-CG 4.3Å; W232-R257 HydrophobicContact CZ3-CB 4.04Å; W232-R257 HydrophobicContact CZ3-CG 3.62Å
233	T	93.3	Very high	88.6	Confident	73 Å²	73	52 Å²	52	45%	0.448	29%	0.29	S	S	.	.	S	Bend	trans	-76.7	-23.3	176.7	56.4	0	0	0	0	113.4	L250 Y253 E255	T233-L250 WeakPolarHBondContact OG1-CD1 3.46Å; T233-Y253 WeakPolarHBondContact CB-OH 3.25Å; T233-Y253 PolarHBondContact OG1-OH 3.35Å; T233-E255 WeakPolarHBondContact CB-OE2 3.5Å; T233-E255 WeakPolarHBondContact CG2-OE2 3.4Å; T233-E255 PolarHBondContact OG1-OE2 3.04Å
234	D	92.4	Very high	88.7	Confident	60 Å²	60	49.1 Å²	49.1	32%	0.321	27%	0.273	S	S	.	.	S	Bend	trans	-149.7	172.4	176.4	-158.6	-11.3	0	0	0	108.2	W232 P236 L250	W232-D234 VanDerWaalsContact C-N 3.34Å; W232-D234 WeakPolarHBondContact CB-O 3.49Å; D234-P236 VanDerWaalsContact O-CD 3.31Å; D234-P236 WeakPolarHBondContact O-CD 3.21Å; D234-L250 HydrophobicContact CB-CB 4.44Å; D234-L250 HydrophobicContact CB-CD1 4.11Å; D234-L250 VanDerWaalsContact O-CD2 3.32Å; D234-L250 WeakPolarHBondContact O-CD2 3.45Å
235	I	91.9	Very high	89	Confident	45 Å²	45	46.2 Å²	46.2	23%	0.231	25%	0.252	C	S	.	.			trans	-74.5	121.1	-175.2	-54.8	172.7	0	0	0	110.8	D212	D212-I235 VanDerWaalsContact O-CG2 3.3Å; D212-I235 WeakPolarHBondContact O-CG2 3.3Å
236	P	94.3	Very high	89.6	Confident	7 Å²	7	43.4 Å²	43.4	5%	0.045	24%	0.235	C	C	.	.			trans	-64.4	135.2	177.4	-21.7	33.8	0	0	0	113.4	L198 W232 D234 M239 A248 L250	L198-P236 HydrophobicContact CD2-CB 3.78Å; L198-P236 WeakPolarHBondContact CD2-O 3.36Å; W232-P236 HydrophobicContact CB-CG 4.16Å; W232-P236 HydrophobicContact CD2-CG 4Å; W232-P236 HydrophobicContact CG-CG 3.57Å; D234-P236 VanDerWaalsContact O-CD 3.31Å; D234-P236 WeakPolarHBondContact O-CD 3.21Å; P236-M239 HydrophobicContact CB-CG 4.15Å; P236-M239 HydrophobicContact CB-SD 4.44Å; P236-A248 HydrophobicContact CB-CB 4.1Å; P236-A248 HydrophobicContact CG-CB 4.26Å; P236-L250 HydrophobicContact CB-CD2 4.12Å; P236-L250 HydrophobicContact CG-CD2 3.93Å
237	I	93	Very high	90.6	Very high	70 Å²	70	41.6 Å²	41.6	36%	0.359	23%	0.226	S	C	.	.	S	Bend	trans	-90.7	-39.7	175.6	-57.2	173.2	0	0	0	110.4	V249 P251	I237-V249 PolarHBondContact N-O 2.87Å; I237-P251 HydrophobicContact CD1-CB 4.32Å; I237-P251 HydrophobicContact CD1-CG 4.08Å; I237-P251 HydrophobicContact CG1-CG 4.45Å
238	A	93.5	Very high	91.8	Very high	18 Å²	18	31.4 Å²	31.4	15%	0.149	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	154	177.9	0	0	0	0	0	109.6	A248 V249 I276	A238-A248 WeakPolarHBondContact O-CA 3.49Å; A238-V249 HydrophobicContact CB-CB 4.32Å; A238-V249 HydrophobicContact CB-CG2 4.44Å; A238-V249 PolarHBondContact O-N 3.16Å; A238-I276 HydrophobicContact CB-CG2 3.72Å
239	M	94.7	Very high	92.8	Very high	11 Å²	11	28.1 Å²	28.1	5%	0.054	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	143.8	179.4	-75.7	-173.7	-67.4	0	0	110.6	L198 A200 A208 T215 W232 P236 I246 I247 A248	L198-M239 HydrophobicContact CD2-CE 3.52Å; L198-M239 HydrophobicContact CD2-CG 3.98Å; L198-M239 HydrophobicContact CD2-SD 4.37Å; L198-M239 HydrophobicContact CG-CE 3.71Å; A200-M239 HydrophobicContact CB-CB 3.91Å; A208-M239 HydrophobicContact CB-CE 4.22Å; T215-M239 HydrophobicContact CG2-CE 3.92Å; T215-M239 HydrophobicContact CG2-SD 4.07Å; W232-M239 HydrophobicContact CZ2-SD 3.83Å; P236-M239 HydrophobicContact CB-CG 4.15Å; P236-M239 HydrophobicContact CB-SD 4.44Å; M239-I246 HydrophobicContact SD-CD1 4.07Å; M239-I247 WeakPolarHBondContact CA-O 3.44Å; M239-A248 HydrophobicContact CG-CB 3.94Å
240	E	93.7	Very high	93.2	Very high	50 Å²	50	26.6 Å²	26.6	23%	0.234	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	141.8	173	-170.5	65	-157.9	0	0	109.3	I247 I276 S278	E240-I247 PolarHBondContact N-O 3.09Å; E240-I247 PolarHBondContact O-N 3.06Å; E240-I276 HydrophobicContact CB-CD1 3.5Å; E240-I276 VanDerWaalsContact CB-CD1 3.5Å; E240-I276 HydrophobicContact CB-CG1 3.77Å; E240-I276 HydrophobicContact CB-CG2 4.1Å; E240-I276 HydrophobicContact CG-CG1 4.46Å; E240-S278 WeakPolarHBondContact OE1-CB 3.47Å
241	H	92.7	Very high	93.2	Very high	26 Å²	26	29.1 Å²	29.1	12%	0.12	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	123.6	179.3	-174.8	-124.2	0	0	0	111.2	L202 A203 Y245	L202-H241 HydrophobicContact CD2-CB 3.57Å; A203-H241 PolarHBondContact N-ND1 3.2Å; A203-H241 VanDerWaalsContact N-ND1 3.19Å; H241-Y245 PolarHBondContact CD2-O 3.48Å
242	Q	91.2	Very high	93.1	Very high	18 Å²	18	34.6 Å²	34.6	8%	0.084	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	91.6	174.2	-70.5	-63.5	-55.3	0	0	108.1	Y5 Y245 I247 S278 N282 V284	Y5-Q242 WeakPolarHBondContact OH-CB 3.2Å; Q242-Y245 CarbonylContact C-O 3.57Å; Q242-Y245 VanDerWaalsContact C-O 3.26Å; Q242-Y245 PolarHBondContact N-O 2.91Å; Q242-Y245 CarbonylContact O-C 3.53Å; Q242-Y245 WeakPolarHBondContact O-CA 3.31Å; Q242-Y245 WeakPolarHBondContact O-CB 3.5Å; Q242-Y245 PolarHBondContact O-N 2.94Å; Q242-I247 HydrophobicContact CB-CD1 4.47Å; Q242-I247 HydrophobicContact CG-CD1 4.27Å; Q242-S278 PolarHBondContact NE2-OG 3.19Å; Q242-S278 VanDerWaalsContact NE2-OG 3.08Å; Q242-N282 VanDerWaalsContact OE1-N 3.08Å; Q242-V284 HydrophobicContact CG-CG2 3.43Å; Q242-V284 VanDerWaalsContact CG-CG2 3.43Å
243	P	88.8	Confident	93.1	Very high	69 Å²	69	36.9 Å²	36.9	45%	0.448	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.3	130.6	-172.3	-27.6	31.4	0	0	0	113.1	A203 M322	A203-P243 HydrophobicContact CB-CG 4.04Å; P243-M322 HydrophobicContact CB-CE 4.27Å
244	P	90.6	Very high	93.3	Very high	17 Å²	17	33.4 Å²	33.4	11%	0.11	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	cis	-90.1	8	6.1	37.1	-33.2	0	0	0	114.3	L315 L319 M322	P244-L315 HydrophobicContact CG-CD1 4.15Å; P244-L319 HydrophobicContact CG-CD2 3.73Å; P244-M322 HydrophobicContact CB-CE 3.97Å; P244-M322 HydrophobicContact CB-SD 4.25Å; P244-M322 VanDerWaalsContact CD-SD 3.59Å; P244-M322 HydrophobicContact CG-CE 4.46Å; P244-M322 HydrophobicContact CG-SD 4.09Å
245	Y	93.6	Very high	93.4	Very high	8 Å²	8	30.6 Å²	30.6	3%	0.031	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	141.9	-171.9	-56.8	-56.7	0	0	0	113	H2 A4 Y5 H241 Q242 I256 R257 T258 V265 Q303 L319	H2-Y245 AromaticContact NE2-CZ 3.94Å; H2-Y245 PolarHBondContact NE2-OH 2.99Å; A4-Y245 HydrophobicContact CB-CD2 4.33Å; A4-Y245 HydrophobicContact CB-CE1 4.27Å; A4-Y245 HydrophobicContact CB-CE2 3.87Å; Y5-Y245 AromaticContact CE2-CD2 3.86Å; Y5-Y245 HydrophobicContact CE2-CD2 3.86Å; Y5-Y245 HydrophobicContact CE2-CG 4.34Å; H241-Y245 PolarHBondContact CD2-O 3.48Å; Q242-Y245 CarbonylContact C-O 3.57Å; Q242-Y245 VanDerWaalsContact C-O 3.26Å; Q242-Y245 PolarHBondContact N-O 2.91Å; Q242-Y245 CarbonylContact O-C 3.53Å; Q242-Y245 WeakPolarHBondContact O-CA 3.31Å; Q242-Y245 WeakPolarHBondContact O-CB 3.5Å; Q242-Y245 PolarHBondContact O-N 2.94Å; Y245-I256 HydrophobicContact CD1-CG2 4.18Å; Y245-I256 HydrophobicContact CG-CG2 4.17Å; Y245-R257 CarbonylContact C-O 3.54Å; Y245-R257 WeakPolarHBondContact CA-O 3.27Å; Y245-T258 HydrophobicContact CD1-CG2 3.58Å; Y245-T258 HydrophobicContact CE1-CG2 3.63Å; Y245-V265 HydrophobicContact CD1-CG2 4.05Å; Y245-V265 HydrophobicContact CE1-CG1 4.14Å; Y245-V265 HydrophobicContact CE1-CG2 3.84Å; Y245-Q303 PolarHBondContact OH-OE1 3.48Å; Y245-L319 HydrophobicContact CE2-CD2 4.41Å
246	I	93.9	Very high	93.6	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	127.1	163.7	-174.5	166.8	0	0	0	108.1	L202 A208 L230 W232 M239 R257 L259	L202-I246 HydrophobicContact CD2-CD1 4.17Å; A208-I246 HydrophobicContact CB-CD1 4.23Å; L230-I246 HydrophobicContact CD2-CG2 3.73Å; W232-I246 HydrophobicContact CH2-CG1 4.22Å; W232-I246 HydrophobicContact CH2-CG2 3.86Å; W232-I246 HydrophobicContact CZ2-CD1 4.25Å; W232-I246 HydrophobicContact CZ2-CG1 4.3Å; W232-I246 HydrophobicContact CZ2-CG2 4.3Å; M239-I246 HydrophobicContact SD-CD1 4.07Å; I246-R257 HydrophobicContact CG2-CB 4.03Å; I246-R257 WeakPolarHBondContact CG2-O 3.3Å; I246-R257 PolarHBondContact N-O 2.76Å; I246-R257 PolarHBondContact O-N 3.08Å; I246-L259 HydrophobicContact CD1-CD2 4.33Å; I246-L259 HydrophobicContact CG2-CD2 4.09Å; I246-L259 HydrophobicContact CG2-CG 4.29Å
247	I	95.9	Very high	93.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	114.6	-174.1	-55.7	171.9	0	0	0	107.3	Y5 M239 E240 Q242 V254 I256 I276 V284 L295	Y5-I247 HydrophobicContact CE2-CD1 3.98Å; M239-I247 WeakPolarHBondContact CA-O 3.44Å; E240-I247 PolarHBondContact N-O 3.09Å; E240-I247 PolarHBondContact O-N 3.06Å; Q242-I247 HydrophobicContact CB-CD1 4.47Å; Q242-I247 HydrophobicContact CG-CD1 4.27Å; I247-V254 HydrophobicContact CG2-CG1 3.39Å; I247-I256 HydrophobicContact CG1-CG1 4.46Å; I247-I256 HydrophobicContact CG1-CG2 4.36Å; I247-I256 HydrophobicContact CG2-CG1 4.4Å; I247-I276 HydrophobicContact CB-CD1 3.98Å; I247-I276 HydrophobicContact CG2-CD1 3.57Å; I247-V284 HydrophobicContact CD1-CG1 4.2Å; I247-V284 HydrophobicContact CD1-CG2 4.07Å; I247-L295 HydrophobicContact CD1-CD1 4.31Å; I247-L295 HydrophobicContact CG2-CD1 3.99Å
248	A	96	Very high	93.6	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	131.5	177.4	0	0	0	0	0	111	W232 P236 A238 M239 L250 V254 E255	W232-A248 HydrophobicContact CD2-CB 4.08Å; W232-A248 HydrophobicContact CE3-CB 3.77Å; W232-A248 HydrophobicContact CH2-CB 3.4Å; W232-A248 HydrophobicContact CZ2-CB 3.73Å; W232-A248 HydrophobicContact CZ3-CB 3.42Å; W232-A248 VanDerWaalsContact CZ3-CB 3.42Å; P236-A248 HydrophobicContact CB-CB 4.1Å; P236-A248 HydrophobicContact CG-CB 4.26Å; A238-A248 WeakPolarHBondContact O-CA 3.49Å; M239-A248 HydrophobicContact CG-CB 3.94Å; A248-L250 HydrophobicContact CB-CD2 4.36Å; A248-V254 WeakPolarHBondContact O-CA 3.38Å; A248-E255 PolarHBondContact N-O 3.5Å; A248-E255 PolarHBondContact O-N 2.95Å
249	V	96.3	Very high	93.3	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	112.2	169.4	178.9	0	0	0	0	108.4	I237 A238 V254 P273 I276 V286	I237-V249 PolarHBondContact N-O 2.87Å; A238-V249 HydrophobicContact CB-CB 4.32Å; A238-V249 HydrophobicContact CB-CG2 4.44Å; A238-V249 PolarHBondContact O-N 3.16Å; V249-V254 HydrophobicContact CG2-CG2 4.31Å; V249-P273 VanDerWaalsContact CG1-C 3.45Å; V249-P273 HydrophobicContact CG1-CB 3.71Å; V249-P273 HydrophobicContact CG1-CG 3.91Å; V249-P273 WeakPolarHBondContact CG1-O 3.49Å; V249-I276 HydrophobicContact CG2-CB 3.84Å; V249-I276 HydrophobicContact CG2-CD1 4.27Å; V249-I276 HydrophobicContact CG2-CG2 4.25Å; V249-V286 HydrophobicContact CG2-CG1 4.24Å
250	L	94.6	Very high	92.8	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.156	C	C	.	.			trans	-96.3	165.5	173.4	-54.7	-173.9	0	0	0	110.1	T233 D234 P236 A248 R252 Y253 E255	T233-L250 WeakPolarHBondContact OG1-CD1 3.46Å; D234-L250 HydrophobicContact CB-CB 4.44Å; D234-L250 HydrophobicContact CB-CD1 4.11Å; D234-L250 VanDerWaalsContact O-CD2 3.32Å; D234-L250 WeakPolarHBondContact O-CD2 3.45Å; P236-L250 HydrophobicContact CB-CD2 4.12Å; P236-L250 HydrophobicContact CG-CD2 3.93Å; A248-L250 HydrophobicContact CB-CD2 4.36Å; L250-R252 PolarHBondContact O-N 3.24Å; L250-Y253 CarbonylContact C-O 3.44Å; L250-Y253 WeakPolarHBondContact CA-O 3.37Å; L250-Y253 VanDerWaalsContact CB-O 3.29Å; L250-Y253 WeakPolarHBondContact CB-O 3.5Å; L250-Y253 HydrophobicContact CD1-CD2 4.29Å; L250-Y253 HydrophobicContact CD1-CE2 3.69Å; L250-Y253 PolarHBondContact N-O 2.89Å; L250-Y253 VanDerWaalsContact O-O 3.13Å; L250-E255 HydrophobicContact CD1-CB 3.78Å; L250-E255 WeakPolarHBondContact CD1-OE2 3.49Å; L250-E255 HydrophobicContact CG-CB 4.19Å
251	P	90.4	Very high	92.4	Very high	54 Å²	54	31.9 Å²	31.9	35%	0.351	15%	0.152	S	C	.	.	S	Bend	trans	-56.7	-26	-177	-27.2	34.9	0	0	0	115.3	I237	I237-P251 HydrophobicContact CD1-CB 4.32Å; I237-P251 HydrophobicContact CD1-CG 4.08Å; I237-P251 HydrophobicContact CG1-CG 4.45Å
252	R	90.1	Very high	92.2	Very high	196 Å²	196	36.4 Å²	36.4	74%	0.74	17%	0.168	S	C	*	.	S	Bend	trans	-114.2	-28.4	-175.2	-66	-175.9	-178	-173	1.9	115	L250 L270	L250-R252 PolarHBondContact O-N 3.24Å; R252-L270 VanDerWaalsContact O-O 3.05Å
253	Y	94.4	Very high	92.2	Very high	53 Å²	53	37.4 Å²	37.4	21%	0.208	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	176.4	-174.9	54.3	-92.3	0	0	0	109.9	T233 L250 E255 N267 V268	T233-Y253 WeakPolarHBondContact CB-OH 3.25Å; T233-Y253 PolarHBondContact OG1-OH 3.35Å; L250-Y253 CarbonylContact C-O 3.44Å; L250-Y253 WeakPolarHBondContact CA-O 3.37Å; L250-Y253 VanDerWaalsContact CB-O 3.29Å; L250-Y253 WeakPolarHBondContact CB-O 3.5Å; L250-Y253 HydrophobicContact CD1-CD2 4.29Å; L250-Y253 HydrophobicContact CD1-CE2 3.69Å; L250-Y253 PolarHBondContact N-O 2.89Å; L250-Y253 VanDerWaalsContact O-O 3.13Å; Y253-E255 HydrophobicContact CD2-CB 4.42Å; Y253-E255 HydrophobicContact CE2-CB 4.15Å; Y253-N267 HydrophobicContact CD2-CB 4.22Å; Y253-N267 HydrophobicContact CE2-CB 4.29Å; Y253-V268 WeakPolarHBondContact CB-O 3.38Å
254	V	96.3	Very high	92.4	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	132.5	172.3	174.5	0	0	0	0	108.8	I247 A248 V249 I256 V268 L270 P273 V286 L295	I247-V254 HydrophobicContact CG2-CG1 3.39Å; A248-V254 WeakPolarHBondContact O-CA 3.38Å; V249-V254 HydrophobicContact CG2-CG2 4.31Å; V254-I256 HydrophobicContact CG1-CG1 4.37Å; V254-V268 HydrophobicContact CB-CB 4.28Å; V254-V268 PolarHBondContact N-O 3.44Å; V254-V268 PolarHBondContact O-N 2.85Å; V254-L270 HydrophobicContact CB-CD1 4.49Å; V254-L270 HydrophobicContact CG2-CD1 3.63Å; V254-L270 HydrophobicContact CG2-CG 4.43Å; V254-P273 HydrophobicContact CG2-CB 4.16Å; V254-P273 HydrophobicContact CG2-CG 4.14Å; V254-V286 HydrophobicContact CG2-CG1 3.9Å; V254-V286 HydrophobicContact CG2-CG2 4.26Å; V254-L295 HydrophobicContact CG1-CD1 4.33Å
255	E	96.2	Very high	92.5	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	130.7	178.8	-174.6	165.2	138.8	0	0	110.4	W232 T233 A248 L250 Y253 R257 L264 N267	W232-E255 HydrophobicContact CE3-CB 4.21Å; W232-E255 HydrophobicContact CE3-CG 3.98Å; W232-E255 HydrophobicContact CZ3-CB 4.24Å; W232-E255 HydrophobicContact CZ3-CG 4.07Å; T233-E255 WeakPolarHBondContact CB-OE2 3.5Å; T233-E255 WeakPolarHBondContact CG2-OE2 3.4Å; T233-E255 PolarHBondContact OG1-OE2 3.04Å; A248-E255 PolarHBondContact N-O 3.5Å; A248-E255 PolarHBondContact O-N 2.95Å; L250-E255 HydrophobicContact CD1-CB 3.78Å; L250-E255 WeakPolarHBondContact CD1-OE2 3.49Å; L250-E255 HydrophobicContact CG-CB 4.19Å; Y253-E255 HydrophobicContact CD2-CB 4.42Å; Y253-E255 HydrophobicContact CE2-CB 4.15Å; E255-R257 HydrophobicContact CG-CG 4.28Å; E255-R257 IonicContact OE1-CZ 3.39Å; E255-R257 IonicContact OE1-NE 3.16Å; E255-R257 PolarHBondContact OE1-NE 2.9Å; E255-R257 IonicContact OE1-NH2 3.62Å; E255-R257 PolarHBondContact OE1-NH2 3.33Å; E255-L264 HydrophobicContact CG-CD1 3.6Å; E255-N267 WeakPolarHBondContact CG-OD1 3.08Å
256	I	95.9	Very high	92.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	127.4	-176.1	-50.3	-175.4	0	0	0	108.8	Y5 Y245 I247 V254 V265 Q266 V268	Y5-I256 HydrophobicContact CD2-CD1 3.43Å; Y5-I256 VanDerWaalsContact CD2-CD1 3.43Å; Y5-I256 HydrophobicContact CD2-CG2 4.41Å; Y5-I256 HydrophobicContact CE2-CD1 4.24Å; Y5-I256 HydrophobicContact CE2-CG2 4.4Å; Y5-I256 HydrophobicContact CG-CD1 4.06Å; Y245-I256 HydrophobicContact CD1-CG2 4.18Å; Y245-I256 HydrophobicContact CG-CG2 4.17Å; I247-I256 HydrophobicContact CG1-CG1 4.46Å; I247-I256 HydrophobicContact CG1-CG2 4.36Å; I247-I256 HydrophobicContact CG2-CG1 4.4Å; V254-I256 HydrophobicContact CG1-CG1 4.37Å; I256-V265 HydrophobicContact CB-CB 4.49Å; I256-V265 HydrophobicContact CG2-CB 4.32Å; I256-V265 HydrophobicContact CG2-CG1 4.47Å; I256-V265 WeakPolarHBondContact O-CB 3.5Å; I256-V265 PolarHBondContact O-N 2.89Å; I256-Q266 HydrophobicContact CB-CB 4.44Å; I256-Q266 PolarHBondContact N-O 3.18Å; I256-Q266 PolarHBondContact O-N 3.38Å; I256-V268 HydrophobicContact CD1-CG2 3.98Å
257	R	94.7	Very high	92.6	Very high	32 Å²	32	40 Å²	40	12%	0.121	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	166.7	-178	-66.7	-162.6	169.4	-155.8	11.8	112.2	L230 N231 W232 Y245 I246 E255 L263 L264	L230-R257 HydrophobicContact CD1-CB 4.33Å; L230-R257 HydrophobicContact CD2-CB 4.23Å; N231-R257 PolarHBondContact O-NH1 2.74Å; N231-R257 PolarHBondContact O-NH2 3.08Å; W232-R257 HydrophobicContact CE3-CG 4.17Å; W232-R257 HydrophobicContact CH2-CB 4.23Å; W232-R257 HydrophobicContact CH2-CG 4.3Å; W232-R257 HydrophobicContact CZ3-CB 4.04Å; W232-R257 HydrophobicContact CZ3-CG 3.62Å; Y245-R257 CarbonylContact C-O 3.54Å; Y245-R257 WeakPolarHBondContact CA-O 3.27Å; I246-R257 HydrophobicContact CG2-CB 4.03Å; I246-R257 WeakPolarHBondContact CG2-O 3.3Å; I246-R257 PolarHBondContact N-O 2.76Å; I246-R257 PolarHBondContact O-N 3.08Å; E255-R257 HydrophobicContact CG-CG 4.28Å; E255-R257 IonicContact OE1-CZ 3.39Å; E255-R257 IonicContact OE1-NE 3.16Å; E255-R257 PolarHBondContact OE1-NE 2.9Å; E255-R257 IonicContact OE1-NH2 3.62Å; E255-R257 PolarHBondContact OE1-NH2 3.33Å; R257-L263 VanDerWaalsContact CA-O 3.3Å; R257-L263 WeakPolarHBondContact CA-O 3.49Å; R257-L263 WeakPolarHBondContact CB-O 3.36Å; R257-L264 HydrophobicContact CG-CD1 4.19Å
258	T	92.3	Very high	92.5	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	145	168.8	48	0	0	0	0	110.5	Y245 P261 R262 L263 V265 L315	Y245-T258 HydrophobicContact CD1-CG2 3.58Å; Y245-T258 HydrophobicContact CE1-CG2 3.63Å; T258-P261 CarbonylContact C-O 3.54Å; T258-P261 VanDerWaalsContact CB-O 3.26Å; T258-P261 WeakPolarHBondContact CB-O 3.41Å; T258-P261 PolarHBondContact OG1-O 2.88Å; T258-R262 WeakPolarHBondContact O-CA 3.45Å; T258-L263 PolarHBondContact N-O 3.09Å; T258-L263 PolarHBondContact OG1-N 2.78Å; T258-V265 HydrophobicContact CG2-CG2 3.84Å; T258-L315 HydrophobicContact CG2-CD1 3.74Å; T258-L315 HydrophobicContact CG2-CD2 3.89Å; T258-L315 HydrophobicContact CG2-CG 4.5Å
259	L	87.4	Confident	92.4	Very high	25 Å²	25	48.7 Å²	48.7	13%	0.131	22%	0.223	C	C	.	.	S	Bend	trans	-75.3	-40.5	178.1	-73.3	179.8	0	0	0	111.7	L202 V217 L230 I246 R262	L202-L259 HydrophobicContact CD1-CD1 4.05Å; V217-L259 HydrophobicContact CG2-CD1 4.49Å; V217-L259 HydrophobicContact CG2-CD2 3.95Å; L230-L259 HydrophobicContact CD2-CD2 4.37Å; I246-L259 HydrophobicContact CD1-CD2 4.33Å; I246-L259 HydrophobicContact CG2-CD2 4.09Å; I246-L259 HydrophobicContact CG2-CG 4.29Å; L259-R262 VanDerWaalsContact O-CG 3.24Å; L259-R262 WeakPolarHBondContact O-CG 3.21Å
260	E	83.9	Confident	92.2	Very high	149 Å²	149	49.3 Å²	49.3	70%	0.696	23%	0.227	S	C	*	.	S	Bend	trans	-152.7	117.3	179.2	-167.3	163.9	-148.5	0	0	109.3	Q318	E260-Q318 VanDerWaalsContact O-CD 3.31Å; E260-Q318 PolarHBondContact O-NE2 3.28Å; E260-Q318 PolarHBondContact O-OE1 2.89Å; E260-Q318 VanDerWaalsContact O-OE1 3.04Å
261	P	86.2	Confident	92	Very high	22 Å²	22	55.1 Å²	55.1	14%	0.143	25%	0.254	C	S	.	.	S	Bend	cis	-63.6	155	-7.2	30.5	-36.6	0	0	0	111.4	T258 L263 E314 L315	T258-P261 CarbonylContact C-O 3.54Å; T258-P261 VanDerWaalsContact CB-O 3.26Å; T258-P261 WeakPolarHBondContact CB-O 3.41Å; T258-P261 PolarHBondContact OG1-O 2.88Å; P261-L263 HydrophobicContact CB-CD1 4.42Å; P261-L263 HydrophobicContact CB-CG 4.26Å; P261-L263 HydrophobicContact CG-CD1 3.76Å; P261-L263 HydrophobicContact CG-CG 4.07Å; P261-L263 PolarHBondContact O-N 3.09Å; P261-L263 VanDerWaalsContact O-N 3.08Å; P261-E314 HydrophobicContact CG-CB 4.15Å; P261-L315 HydrophobicContact CG-CB 4.3Å
262	R	88.5	Confident	92	Very high	121 Å²	121	62.5 Å²	62.5	46%	0.457	27%	0.274	S	S	.	.			trans	-79.3	92.1	179.9	-68.8	-177.3	-59.4	-144.2	-0.1	111.1	C228 L230 T258 L259	C228-R262 VanDerWaalsContact CA-NH1 3.32Å; C228-R262 PolarHBondContact O-NH1 2.65Å; C228-R262 PolarHBondContact SG-NH1 2.84Å; C228-R262 PolarHBondContact SG-NH2 2.87Å; L230-R262 HydrophobicContact CD1-CG 4.45Å; T258-R262 WeakPolarHBondContact O-CA 3.45Å; L259-R262 VanDerWaalsContact O-CG 3.24Å; L259-R262 WeakPolarHBondContact O-CG 3.21Å
263	L	90.4	Very high	92.1	Very high	40 Å²	40	53.2 Å²	53.2	21%	0.209	24%	0.24	C	C	.	.			trans	-120.4	142.7	-178.3	-60.2	174.8	0	0	0	110.7	R257 T258 P261 V265 Q312 L315	R257-L263 VanDerWaalsContact CA-O 3.3Å; R257-L263 WeakPolarHBondContact CA-O 3.49Å; R257-L263 WeakPolarHBondContact CB-O 3.36Å; T258-L263 PolarHBondContact N-O 3.09Å; T258-L263 PolarHBondContact OG1-N 2.78Å; P261-L263 HydrophobicContact CB-CD1 4.42Å; P261-L263 HydrophobicContact CB-CG 4.26Å; P261-L263 HydrophobicContact CG-CD1 3.76Å; P261-L263 HydrophobicContact CG-CG 4.07Å; P261-L263 PolarHBondContact O-N 3.09Å; P261-L263 VanDerWaalsContact O-N 3.08Å; L263-V265 PolarHBondContact O-N 3.24Å; L263-Q312 HydrophobicContact CD1-CB 4.49Å; L263-Q312 HydrophobicContact CD1-CG 4.36Å; L263-L315 HydrophobicContact CD1-CB 4.39Å; L263-L315 HydrophobicContact CD1-CD2 4.18Å
264	L	92.6	Very high	92.1	Very high	56 Å²	56	55.7 Å²	55.7	29%	0.293	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	113.3	159.5	176.9	62.4	0	0	0	107.5	M1 E255 R257	M1-L264 HydrophobicContact SD-CD2 4.33Å; E255-L264 HydrophobicContact CG-CD1 3.6Å; R257-L264 HydrophobicContact CG-CD1 4.19Å
265	V	93.2	Very high	92	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.012	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	-59.9	-176.3	173.4	0	0	0	0	109.5	H2 A4 Y245 I256 T258 L263	H2-V265 WeakPolarHBondContact CE1-CG1 3.33Å; H2-V265 VanDerWaalsContact O-O 3.14Å; A4-V265 HydrophobicContact CB-CG1 3.6Å; Y245-V265 HydrophobicContact CD1-CG2 4.05Å; Y245-V265 HydrophobicContact CE1-CG1 4.14Å; Y245-V265 HydrophobicContact CE1-CG2 3.84Å; I256-V265 HydrophobicContact CB-CB 4.49Å; I256-V265 HydrophobicContact CG2-CB 4.32Å; I256-V265 HydrophobicContact CG2-CG1 4.47Å; I256-V265 WeakPolarHBondContact O-CB 3.5Å; I256-V265 PolarHBondContact O-N 2.89Å; T258-V265 HydrophobicContact CG2-CG2 3.84Å; L263-V265 PolarHBondContact O-N 3.24Å
266	Q	94.7	Very high	92	Very high	20 Å²	20	58.8 Å²	58.8	9%	0.093	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	147.1	-170.7	-167.9	-177.2	20.4	0	0	111	D3 Y5 I256 V268	D3-Q266 PolarHBondContact OD1-NE2 2.81Å; Y5-Q266 PolarHBondContact O-NE2 3.13Å; Y5-Q266 PolarHBondContact O-OE1 2.79Å; Y5-Q266 VanDerWaalsContact O-OE1 3.09Å; I256-Q266 HydrophobicContact CB-CB 4.44Å; I256-Q266 PolarHBondContact N-O 3.18Å; I256-Q266 PolarHBondContact O-N 3.38Å; Q266-V268 HydrophobicContact CG-CG2 4.08Å
267	N	94.7	Very high	91.8	Very high	70 Å²	70	59.3 Å²	59.3	37%	0.374	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	126.1	166	-69.6	-25.8	0	0	0	108.6	Y253 E255	Y253-N267 HydrophobicContact CD2-CB 4.22Å; Y253-N267 HydrophobicContact CE2-CB 4.29Å; E255-N267 WeakPolarHBondContact CG-OD1 3.08Å
268	V	94.8	Very high	91.7	Very high	5 Å²	5	59.2 Å²	59.2	3%	0.03	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	106.1	-177.3	-176.1	0	0	0	0	109.1	P7 Y253 V254 I256 Q266 L270 L295	P7-V268 HydrophobicContact CB-CG1 3.65Å; P7-V268 HydrophobicContact CG-CG1 3.57Å; Y253-V268 WeakPolarHBondContact CB-O 3.38Å; V254-V268 HydrophobicContact CB-CB 4.28Å; V254-V268 PolarHBondContact N-O 3.44Å; V254-V268 PolarHBondContact O-N 2.85Å; I256-V268 HydrophobicContact CD1-CG2 3.98Å; Q266-V268 HydrophobicContact CG-CG2 4.08Å; V268-L270 HydrophobicContact CG1-CD2 4.17Å; V268-L270 HydrophobicContact CG1-CG 4.2Å; V268-L270 PolarHBondContact O-N 2.89Å; V268-L295 HydrophobicContact CG1-CD2 4.27Å
269	E	93.3	Very high	91.4	Very high	177 Å²	177	60 Å²	60	83%	0.827	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.7	117.2	-179.7	-64.2	-172	172.3	0	0	111.1
270	L	91.8	Very high	91.3	Very high	14 Å²	14	60.1 Å²	60.1	7%	0.073	29%	0.286	C	S	.	.			trans	-129.8	155.1	177.6	-61.6	-178.5	0	0	0	110	P7 R252 V254 V268 R272 P273 V286 W293	P7-L270 HydrophobicContact CB-CD2 3.88Å; R252-L270 VanDerWaalsContact O-O 3.05Å; V254-L270 HydrophobicContact CB-CD1 4.49Å; V254-L270 HydrophobicContact CG2-CD1 3.63Å; V254-L270 HydrophobicContact CG2-CG 4.43Å; V268-L270 HydrophobicContact CG1-CD2 4.17Å; V268-L270 HydrophobicContact CG1-CG 4.2Å; V268-L270 PolarHBondContact O-N 2.89Å; L270-R272 PolarHBondContact O-N 2.85Å; L270-P273 HydrophobicContact CB-CB 4.18Å; L270-P273 HydrophobicContact CB-CG 4.15Å; L270-P273 HydrophobicContact CD1-CB 4.33Å; L270-P273 WeakPolarHBondContact O-CD 3.33Å; L270-V286 HydrophobicContact CD1-CB 3.96Å; L270-V286 HydrophobicContact CD1-CG1 3.68Å; L270-W293 HydrophobicContact CB-CE3 4.41Å; L270-W293 HydrophobicContact CB-CH2 4.38Å; L270-W293 HydrophobicContact CB-CZ3 4.29Å; L270-W293 HydrophobicContact CD1-CD2 4.33Å; L270-W293 HydrophobicContact CD1-CE3 4.1Å; L270-W293 HydrophobicContact CD2-CB 4.36Å; L270-W293 HydrophobicContact CD2-CD2 3.8Å; L270-W293 HydrophobicContact CD2-CE3 4.31Å; L270-W293 HydrophobicContact CD2-CG 3.79Å; L270-W293 HydrophobicContact CG-CD2 4.49Å
271	Q	89.4	Confident	91.3	Very high	122 Å²	122	58.3 Å²	58.3	57%	0.57	29%	0.287	S	S	*	.	S	Bend	trans	-77.8	94.3	-178.1	-62.1	-176.9	8.3	0	0	111.4	S288 W293	Q271-S288 WeakPolarHBondContact O-CB 3.29Å; Q271-W293 HydrophobicContact CB-CH2 3.91Å; Q271-W293 HydrophobicContact CB-CZ2 4.15Å; Q271-W293 HydrophobicContact CG-CZ2 4.46Å
272	R	90.4	Very high	91.3	Very high	208 Å²	208	61.8 Å²	61.8	79%	0.785	30%	0.304	S	S	*	.	S	Bend	trans	51	60.1	177.5	-61	-180	179.6	164.6	-0.1	112.4	L270 S288	L270-R272 PolarHBondContact O-N 2.85Å; R272-S288 WeakPolarHBondContact O-CB 3.37Å
273	P	93.9	Very high	91.4	Very high	1 Å²	1	57.2 Å²	57.2	1%	0.006	29%	0.288	C	S	.	.			trans	-64.6	146	179.5	32.6	-36.8	0	0	0	110.2	V249 V254 L270 V286	V249-P273 VanDerWaalsContact CG1-C 3.45Å; V249-P273 HydrophobicContact CG1-CB 3.71Å; V249-P273 HydrophobicContact CG1-CG 3.91Å; V249-P273 WeakPolarHBondContact CG1-O 3.49Å; V254-P273 HydrophobicContact CG2-CB 4.16Å; V254-P273 HydrophobicContact CG2-CG 4.14Å; L270-P273 HydrophobicContact CB-CB 4.18Å; L270-P273 HydrophobicContact CB-CG 4.15Å; L270-P273 HydrophobicContact CD1-CB 4.33Å; L270-P273 WeakPolarHBondContact O-CD 3.33Å; P273-V286 HydrophobicContact CB-CG1 3.61Å
274	R	93.7	Very high	91.6	Very high	106 Å²	106	55.3 Å²	55.3	40%	0.4	28%	0.278	S	S	.	.			trans	-138.2	-36.3	-176.7	-64.8	-173	70.9	-162.3	-1.5	113.8	A287 N289	R274-A287 PolarHBondContact N-O 2.81Å; R274-N289 WeakPolarHBondContact CD-OD1 3.49Å; R274-N289 PolarHBondContact NH1-OD1 2.61Å
275	F	94	Very high	91.7	Very high	41 Å²	41	52.7 Å²	52.7	18%	0.18	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	146.1	-174	-50.2	-69.1	0	0	0	109.9	I18 D19 L21 V286 A287	I18-F275 HydrophobicContact CG2-CD2 4.14Å; I18-F275 HydrophobicContact CG2-CE2 4.24Å; I18-F275 WeakPolarHBondContact O-CE2 3.4Å; D19-F275 WeakPolarHBondContact O-CE1 3.25Å; D19-F275 VanDerWaalsContact O-CZ 3.26Å; D19-F275 WeakPolarHBondContact O-CZ 3.19Å; L21-F275 HydrophobicContact CD1-CB 4.06Å; L21-F275 HydrophobicContact CG-CB 4.34Å; F275-V286 CarbonylContact O-C 3.57Å; F275-V286 VanDerWaalsContact O-CA 3.29Å; F275-V286 WeakPolarHBondContact O-CA 3.3Å; F275-V286 WeakPolarHBondContact O-CG1 3.31Å; F275-A287 HydrophobicContact CB-CB 4.44Å; F275-A287 HydrophobicContact CD2-CB 4.37Å; F275-A287 PolarHBondContact N-O 2.95Å; F275-A287 PolarHBondContact O-N 2.82Å
276	I	95.4	Very high	91.9	Very high	24 Å²	24	52.6 Å²	52.6	12%	0.123	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	142.2	171.9	-168.8	163.2	0	0	0	108.7	A238 E240 I247 V249 V284 Y285 V286	A238-I276 HydrophobicContact CB-CG2 3.72Å; E240-I276 HydrophobicContact CB-CD1 3.5Å; E240-I276 VanDerWaalsContact CB-CD1 3.5Å; E240-I276 HydrophobicContact CB-CG1 3.77Å; E240-I276 HydrophobicContact CB-CG2 4.1Å; E240-I276 HydrophobicContact CG-CG1 4.46Å; I247-I276 HydrophobicContact CB-CD1 3.98Å; I247-I276 HydrophobicContact CG2-CD1 3.57Å; V249-I276 HydrophobicContact CG2-CB 3.84Å; V249-I276 HydrophobicContact CG2-CD1 4.27Å; V249-I276 HydrophobicContact CG2-CG2 4.25Å; I276-V284 HydrophobicContact CD1-CG1 3.83Å; I276-V284 HydrophobicContact CG1-CG1 3.76Å; I276-Y285 CarbonylContact C-O 3.54Å; I276-Y285 VanDerWaalsContact CA-O 3.29Å; I276-Y285 WeakPolarHBondContact CA-O 3.22Å; I276-V286 HydrophobicContact CD1-CG2 4.16Å; I276-V286 HydrophobicContact CG1-CG2 4.12Å
277	A	93	Very high	91.9	Very high	11 Å²	11	51.6 Å²	51.6	9%	0.091	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	141.3	174.7	0	0	0	0	0	110	L21 Y285	L21-A277 HydrophobicContact CB-CB 3.95Å; A277-Y285 PolarHBondContact N-O 2.88Å; A277-Y285 PolarHBondContact O-N 3.14Å
278	S	91.3	Very high	91.9	Very high	29 Å²	29	48.6 Å²	48.6	20%	0.203	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	148	171.5	179.8	0	0	0	0	111.5	E240 Q242 G280 I283	E240-S278 WeakPolarHBondContact OE1-CB 3.47Å; Q242-S278 PolarHBondContact NE2-OG 3.19Å; Q242-S278 VanDerWaalsContact NE2-OG 3.08Å; S278-G280 PolarHBondContact OG-N 3.2Å; S278-G280 VanDerWaalsContact OG-N 3.16Å; S278-G280 PolarHBondContact OG-O 2.82Å; S278-I283 VanDerWaalsContact CA-O 3.28Å; S278-I283 WeakPolarHBondContact CA-O 3.46Å; S278-I283 PolarHBondContact OG-O 3.18Å; S278-I283 VanDerWaalsContact OG-O 3.14Å
279	A	87.3	Confident	91.8	Very high	17 Å²	17	50.6 Å²	50.6	14%	0.14	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	11.3	172.5	0	0	0	0	0	112.8	A23 E25 I283 Y285	A23-A279 HydrophobicContact CB-CB 3.5Å; E25-A279 PolarHBondContact N-O 2.97Å; A279-I283 HydrophobicContact CB-CB 3.89Å; A279-I283 HydrophobicContact CB-CD1 4.44Å; A279-I283 HydrophobicContact CB-CG2 3.54Å; A279-I283 PolarHBondContact N-O 3.16Å; A279-Y285 HydrophobicContact CB-CE2 4.25Å
280	G	85.3	Confident	91.8	Very high	28 Å²	28	45.7 Å²	45.7	29%	0.289	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	127.1	-174.8	-169.9	0	0	0	0	0	112.4	S278 N282 I283	S278-G280 PolarHBondContact OG-N 3.2Å; S278-G280 VanDerWaalsContact OG-N 3.16Å; S278-G280 PolarHBondContact OG-O 2.82Å; G280-N282 PolarHBondContact O-N 3.27Å; G280-I283 PolarHBondContact O-N 3.22Å
281	P	84.4	Confident	91.9	Very high	111 Å²	111	46.6 Å²	46.6	72%	0.721	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	132.9	179.2	-21.6	32	0	0	0	110.7	I283	P281-I283 PolarHBondContact O-N 2.68Å
282	N	85.2	Confident	92.2	Very high	94 Å²	94	40.8 Å²	40.8	50%	0.503	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.1	12.3	174.7	-63.7	-37	0	0	0	115.6	Q242 G280 P297	Q242-N282 VanDerWaalsContact OE1-N 3.08Å; G280-N282 PolarHBondContact O-N 3.27Å; N282-P297 HydrophobicContact CB-CG 3.86Å
283	I	91.1	Very high	92.4	Very high	26 Å²	26	32 Å²	32	13%	0.133	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	104.3	175.3	-50.7	179.1	0	0	0	109.2	S278 A279 G280 P281 Y285	S278-I283 VanDerWaalsContact CA-O 3.28Å; S278-I283 WeakPolarHBondContact CA-O 3.46Å; S278-I283 PolarHBondContact OG-O 3.18Å; S278-I283 VanDerWaalsContact OG-O 3.14Å; A279-I283 HydrophobicContact CB-CB 3.89Å; A279-I283 HydrophobicContact CB-CD1 4.44Å; A279-I283 HydrophobicContact CB-CG2 3.54Å; A279-I283 PolarHBondContact N-O 3.16Å; G280-I283 PolarHBondContact O-N 3.22Å; P281-I283 PolarHBondContact O-N 2.68Å; I283-Y285 HydrophobicContact CG2-CD2 4.24Å; I283-Y285 HydrophobicContact CG2-CE2 3.45Å; I283-Y285 VanDerWaalsContact CG2-CE2 3.45Å
284	V	94.3	Very high	92.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	130.5	178.8	-178.2	0	0	0	0	109.8	Q242 I247 I276 R294 L295	Q242-V284 HydrophobicContact CG-CG2 3.43Å; Q242-V284 VanDerWaalsContact CG-CG2 3.43Å; I247-V284 HydrophobicContact CD1-CG1 4.2Å; I247-V284 HydrophobicContact CD1-CG2 4.07Å; I276-V284 HydrophobicContact CD1-CG1 3.83Å; I276-V284 HydrophobicContact CG1-CG1 3.76Å; V284-R294 WeakPolarHBondContact O-CA 3.26Å; V284-L295 HydrophobicContact CB-CB 4.31Å; V284-L295 HydrophobicContact CG1-CD1 4.12Å; V284-L295 PolarHBondContact O-N 2.92Å
285	Y	95.4	Very high	92.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	137.3	173.3	-64.1	-80.1	0	0	0	110.1	I10 A23 L28 I42 I276 A277 A279 I283 V292 W293 R294	I10-Y285 HydrophobicContact CG1-CE1 4.25Å; A23-Y285 HydrophobicContact CB-CD2 3.77Å; A23-Y285 HydrophobicContact CB-CE2 3.81Å; L28-Y285 HydrophobicContact CD1-CD1 4.4Å; L28-Y285 HydrophobicContact CD1-CD2 4.1Å; L28-Y285 HydrophobicContact CD1-CE2 4.5Å; L28-Y285 HydrophobicContact CD1-CG 4.04Å; L28-Y285 HydrophobicContact CD2-CD1 4.49Å; I42-Y285 HydrophobicContact CD1-CD1 4.47Å; I42-Y285 HydrophobicContact CD1-CE1 3.46Å; I42-Y285 VanDerWaalsContact CD1-CE1 3.46Å; I42-Y285 VanDerWaalsContact CD1-OH 3.3Å; I42-Y285 WeakPolarHBondContact CD1-OH 3.26Å; I276-Y285 CarbonylContact C-O 3.54Å; I276-Y285 VanDerWaalsContact CA-O 3.29Å; I276-Y285 WeakPolarHBondContact CA-O 3.22Å; A277-Y285 PolarHBondContact N-O 2.88Å; A277-Y285 PolarHBondContact O-N 3.14Å; A279-Y285 HydrophobicContact CB-CE2 4.25Å; I283-Y285 HydrophobicContact CG2-CD2 4.24Å; I283-Y285 HydrophobicContact CG2-CE2 3.45Å; I283-Y285 VanDerWaalsContact CG2-CE2 3.45Å; Y285-V292 HydrophobicContact CD1-CG1 4.22Å; Y285-W293 CarbonylContact C-O 3.45Å; Y285-W293 VanDerWaalsContact CA-O 3.3Å; Y285-W293 WeakPolarHBondContact CA-O 3.38Å; Y285-R294 HydrophobicContact CD1-CB 3.96Å; Y285-R294 HydrophobicContact CD1-CG 4.3Å; Y285-R294 HydrophobicContact CE1-CB 3.78Å; Y285-R294 HydrophobicContact CE1-CG 3.91Å
286	V	96.2	Very high	92.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	135.2	171.6	-179.3	0	0	0	0	107.9	V249 V254 L270 P273 F275 I276 W293 L295	V249-V286 HydrophobicContact CG2-CG1 4.24Å; V254-V286 HydrophobicContact CG2-CG1 3.9Å; V254-V286 HydrophobicContact CG2-CG2 4.26Å; L270-V286 HydrophobicContact CD1-CB 3.96Å; L270-V286 HydrophobicContact CD1-CG1 3.68Å; P273-V286 HydrophobicContact CB-CG1 3.61Å; F275-V286 CarbonylContact O-C 3.57Å; F275-V286 VanDerWaalsContact O-CA 3.29Å; F275-V286 WeakPolarHBondContact O-CA 3.3Å; F275-V286 WeakPolarHBondContact O-CG1 3.31Å; I276-V286 HydrophobicContact CD1-CG2 4.16Å; I276-V286 HydrophobicContact CG1-CG2 4.12Å; V286-W293 PolarHBondContact N-O 2.82Å; V286-W293 PolarHBondContact O-N 2.87Å; V286-L295 HydrophobicContact CG2-CD1 3.77Å; V286-L295 HydrophobicContact CG2-CG 4.03Å
287	A	95.4	Very high	92.1	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	150.5	176.5	0	0	0	0	0	113	I18 L21 R274 F275 F291 V292	I18-A287 HydrophobicContact CD1-CB 4.19Å; I18-A287 HydrophobicContact CG2-CB 4.45Å; L21-A287 HydrophobicContact CD1-CB 3.42Å; L21-A287 VanDerWaalsContact CD1-CB 3.42Å; L21-A287 HydrophobicContact CD2-CB 4.22Å; L21-A287 HydrophobicContact CG-CB 4.13Å; R274-A287 PolarHBondContact N-O 2.81Å; F275-A287 HydrophobicContact CB-CB 4.44Å; F275-A287 HydrophobicContact CD2-CB 4.37Å; F275-A287 PolarHBondContact N-O 2.95Å; F275-A287 PolarHBondContact O-N 2.82Å; A287-F291 CarbonylContact C-O 3.55Å; A287-F291 WeakPolarHBondContact CA-O 3.36Å; A287-F291 WeakPolarHBondContact CB-O 3.41Å; A287-V292 HydrophobicContact CB-CB 4.44Å; A287-V292 HydrophobicContact CB-CG1 4.48Å; A287-V292 HydrophobicContact CB-CG2 3.87Å
288	S	94.7	Very high	92.1	Very high	6 Å²	6	29.3 Å²	29.3	4%	0.042	17%	0.171	C	C	.	.			trans	-99.2	-162.2	161.2	73	0	0	0	0	109.5	Q271 R272 H290 F291	Q271-S288 WeakPolarHBondContact O-CB 3.29Å; R272-S288 WeakPolarHBondContact O-CB 3.37Å; S288-H290 VanDerWaalsContact C-N 3.27Å; S288-H290 PolarHBondContact O-N 2.88Å; S288-H290 PolarHBondContact OG-N 3.42Å; S288-F291 PolarHBondContact N-O 3.04Å; S288-F291 WeakPolarHBondContact OG-CB 3.27Å; S288-F291 PolarHBondContact OG-N 2.91Å; S288-F291 VanDerWaalsContact OG-N 3.16Å
289	N	92.6	Very high	92	Very high	48 Å²	48	31 Å²	31	26%	0.257	18%	0.182	S	C	.	.	S	Bend	trans	-66.5	-26.3	175.7	-70.1	-19.8	0	0	0	113.5	Q17 I18 R274	Q17-N289 WeakPolarHBondContact CA-O 3.46Å; Q17-N289 HydrophobicContact CG-CB 4.17Å; I18-N289 PolarHBondContact N-O 3.06Å; R274-N289 WeakPolarHBondContact CD-OD1 3.49Å; R274-N289 PolarHBondContact NH1-OD1 2.61Å
290	H	93.3	Very high	92.1	Very high	74 Å²	74	32.5 Å²	32.5	34%	0.343	19%	0.188	S	C	.	.	S	Bend	trans	-138.4	-0.9	-170.8	-62.8	-69	0	0	0	114.3	K13 L14 S288	K13-H290 PolarHBondContact N-O 3.44Å; L14-H290 PolarHBondContact N-O 2.81Å; L14-H290 PolarHBondContact O-ND1 2.75Å; S288-H290 VanDerWaalsContact C-N 3.27Å; S288-H290 PolarHBondContact O-N 2.88Å; S288-H290 PolarHBondContact OG-N 3.42Å
291	F	94.6	Very high	92.3	Very high	33 Å²	33	33.1 Å²	33.1	15%	0.145	19%	0.19	C	C	.	.			trans	-130.5	145.9	-177.8	-64.3	-96.8	0	0	0	109.8	L11 E12 K13 A287 S288 W293	L11-F291 CarbonylContact O-C 3.6Å; L11-F291 VanDerWaalsContact O-CA 3.27Å; L11-F291 WeakPolarHBondContact O-CA 3.27Å; E12-F291 HydrophobicContact CB-CD1 4.11Å; E12-F291 HydrophobicContact CB-CE1 4.04Å; E12-F291 HydrophobicContact CG-CD1 4.25Å; E12-F291 HydrophobicContact CG-CE1 4.42Å; K13-F291 HydrophobicContact CG-CE1 4.08Å; K13-F291 HydrophobicContact CG-CZ 3.9Å; A287-F291 CarbonylContact C-O 3.55Å; A287-F291 WeakPolarHBondContact CA-O 3.36Å; A287-F291 WeakPolarHBondContact CB-O 3.41Å; S288-F291 PolarHBondContact N-O 3.04Å; S288-F291 WeakPolarHBondContact OG-CB 3.27Å; S288-F291 PolarHBondContact OG-N 2.91Å; S288-F291 VanDerWaalsContact OG-N 3.16Å; F291-W293 HydrophobicContact CB-CD2 4.43Å; F291-W293 HydrophobicContact CB-CE3 4.21Å; F291-W293 HydrophobicContact CB-CH2 3.27Å; F291-W293 HydrophobicContact CB-CZ2 3.49Å; F291-W293 VanDerWaalsContact CB-CZ2 3.49Å; F291-W293 HydrophobicContact CB-CZ3 3.65Å; F291-W293 HydrophobicContact CD1-CZ2 4.24Å; F291-W293 HydrophobicContact CD2-CH2 4.42Å; F291-W293 AromaticContact CG-CH2 3.94Å; F291-W293 HydrophobicContact CG-CH2 3.94Å; F291-W293 AromaticContact CG-CZ2 3.92Å; F291-W293 HydrophobicContact CG-CZ2 3.92Å
292	V	95.1	Very high	92.6	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	129.6	170.4	-174.3	0	0	0	0	108.3	I10 L11 I18 L21 L28 Y285 A287	I10-V292 PolarHBondContact N-O 3.18Å; L11-V292 HydrophobicContact CB-CB 3.99Å; L11-V292 HydrophobicContact CB-CG2 4.1Å; L11-V292 HydrophobicContact CD1-CB 4.3Å; L11-V292 HydrophobicContact CD1-CG2 3.88Å; L11-V292 HydrophobicContact CG-CB 4.3Å; L11-V292 HydrophobicContact CG-CG2 4.37Å; L11-V292 PolarHBondContact N-O 2.81Å; L11-V292 PolarHBondContact O-N 2.7Å; I18-V292 HydrophobicContact CD1-CG2 3.52Å; L21-V292 HydrophobicContact CD2-CG2 4.48Å; L28-V292 HydrophobicContact CD2-CG1 3.93Å; Y285-V292 HydrophobicContact CD1-CG1 4.22Å; A287-V292 HydrophobicContact CB-CB 4.44Å; A287-V292 HydrophobicContact CB-CG1 4.48Å; A287-V292 HydrophobicContact CB-CG2 3.87Å
293	W	94.9	Very high	92.9	Very high	22 Å²	22	25.7 Å²	25.7	8%	0.083	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	148	173.4	-59.3	-92.4	0	0	0	109.7	V8 L270 Q271 Y285 V286 F291	V8-W293 CarbonylContact O-C 3.6Å; V8-W293 VanDerWaalsContact O-CA 3.3Å; V8-W293 WeakPolarHBondContact O-CA 3.43Å; L270-W293 HydrophobicContact CB-CE3 4.41Å; L270-W293 HydrophobicContact CB-CH2 4.38Å; L270-W293 HydrophobicContact CB-CZ3 4.29Å; L270-W293 HydrophobicContact CD1-CD2 4.33Å; L270-W293 HydrophobicContact CD1-CE3 4.1Å; L270-W293 HydrophobicContact CD2-CB 4.36Å; L270-W293 HydrophobicContact CD2-CD2 3.8Å; L270-W293 HydrophobicContact CD2-CE3 4.31Å; L270-W293 HydrophobicContact CD2-CG 3.79Å; L270-W293 HydrophobicContact CG-CD2 4.49Å; Q271-W293 HydrophobicContact CB-CH2 3.91Å; Q271-W293 HydrophobicContact CB-CZ2 4.15Å; Q271-W293 HydrophobicContact CG-CZ2 4.46Å; Y285-W293 CarbonylContact C-O 3.45Å; Y285-W293 VanDerWaalsContact CA-O 3.3Å; Y285-W293 WeakPolarHBondContact CA-O 3.38Å; V286-W293 PolarHBondContact N-O 2.82Å; V286-W293 PolarHBondContact O-N 2.87Å; F291-W293 HydrophobicContact CB-CD2 4.43Å; F291-W293 HydrophobicContact CB-CE3 4.21Å; F291-W293 HydrophobicContact CB-CH2 3.27Å; F291-W293 HydrophobicContact CB-CZ2 3.49Å; F291-W293 VanDerWaalsContact CB-CZ2 3.49Å; F291-W293 HydrophobicContact CB-CZ3 3.65Å; F291-W293 HydrophobicContact CD1-CZ2 4.24Å; F291-W293 HydrophobicContact CD2-CH2 4.42Å; F291-W293 AromaticContact CG-CH2 3.94Å; F291-W293 HydrophobicContact CG-CH2 3.94Å; F291-W293 AromaticContact CG-CZ2 3.92Å; F291-W293 HydrophobicContact CG-CZ2 3.92Å
294	R	93.8	Very high	92.9	Very high	27 Å²	27	24.6 Å²	24.6	10%	0.102	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	127.3	165.4	-177	174.8	174.4	165	3.2	107.9	V8 I10 V284 Y285 V296	V8-R294 PolarHBondContact N-O 3.37Å; V8-R294 PolarHBondContact O-N 2.98Å; I10-R294 HydrophobicContact CD1-CB 3.77Å; I10-R294 HydrophobicContact CG1-CB 3.6Å; V284-R294 WeakPolarHBondContact O-CA 3.26Å; Y285-R294 HydrophobicContact CD1-CB 3.96Å; Y285-R294 HydrophobicContact CD1-CG 4.3Å; Y285-R294 HydrophobicContact CE1-CB 3.78Å; Y285-R294 HydrophobicContact CE1-CG 3.91Å; R294-V296 HydrophobicContact CG-CG2 4.23Å; R294-V296 PolarHBondContact O-N 2.95Å
295	L	94.1	Very high	92.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	105.5	170.1	-59.6	-177.7	0	0	0	107.5	Y5 P7 I247 V254 V268 V284 V286	Y5-L295 HydrophobicContact CD1-CB 3.66Å; Y5-L295 HydrophobicContact CE1-CB 4.39Å; Y5-L295 HydrophobicContact CG-CB 4.08Å; P7-L295 HydrophobicContact CB-CD2 4.16Å; I247-L295 HydrophobicContact CD1-CD1 4.31Å; I247-L295 HydrophobicContact CG2-CD1 3.99Å; V254-L295 HydrophobicContact CG1-CD1 4.33Å; V268-L295 HydrophobicContact CG1-CD2 4.27Å; V284-L295 HydrophobicContact CB-CB 4.31Å; V284-L295 HydrophobicContact CG1-CD1 4.12Å; V284-L295 PolarHBondContact O-N 2.92Å; V286-L295 HydrophobicContact CG2-CD1 3.77Å; V286-L295 HydrophobicContact CG2-CG 4.03Å
296	V	91.7	Very high	92.5	Very high	23 Å²	23	33.4 Å²	33.4	14%	0.139	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	121.8	179.8	-178.1	0	0	0	0	108.6	Y5 E6 V8 F51 R294 V298	Y5-V296 CarbonylContact C-O 3.54Å; Y5-V296 VanDerWaalsContact CA-O 3.29Å; Y5-V296 WeakPolarHBondContact CA-O 3.35Å; E6-V296 PolarHBondContact N-O 2.87Å; E6-V296 PolarHBondContact O-N 2.89Å; V8-V296 HydrophobicContact CB-CG2 4.31Å; V8-V296 HydrophobicContact CG2-CB 4.5Å; V8-V296 HydrophobicContact CG2-CG2 3.73Å; F51-V296 HydrophobicContact CE2-CG2 3.56Å; F51-V296 HydrophobicContact CZ-CG2 3.6Å; R294-V296 HydrophobicContact CG-CG2 4.23Å; R294-V296 PolarHBondContact O-N 2.95Å; V296-V298 PolarHBondContact O-N 2.9Å
297	P	91.1	Very high	92.3	Very high	43 Å²	43	33.5 Å²	33.5	28%	0.279	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	133.7	179.7	25.1	-31.4	0	0	0	110.8	A4 Y5 N282	A4-P297 WeakPolarHBondContact O-CA 3.44Å; Y5-P297 HydrophobicContact CD1-CB 4.15Å; Y5-P297 HydrophobicContact CE1-CB 3.94Å; N282-P297 HydrophobicContact CB-CG 3.86Å
298	V	91.9	Very high	92	Very high	35 Å²	35	35.5 Å²	35.5	21%	0.212	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-67.1	149.6	170	178	0	0	0	0	108.5	D3 A4 V296 I300 Q303	D3-V298 HydrophobicContact CB-CG2 4.16Å; D3-V298 WeakPolarHBondContact O-CB 3.26Å; D3-V298 WeakPolarHBondContact O-CG2 3.24Å; A4-V298 PolarHBondContact O-N 2.9Å; V296-V298 PolarHBondContact O-N 2.9Å; V298-I300 PolarHBondContact O-N 3.13Å; V298-Q303 HydrophobicContact CB-CG 4.24Å; V298-Q303 HydrophobicContact CG1-CG 4.24Å; V298-Q303 PolarHBondContact O-NE2 3.3Å
299	S	90.1	Very high	91.7	Very high	63 Å²	63	42.4 Å²	42.4	44%	0.441	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-57.7	136.7	-179	90.9	0	0	0	0	111.7	A301 S302 Q303	S299-A301 PolarHBondContact O-N 3.36Å; S299-S302 PolarHBondContact O-N 3.03Å; S299-S302 VanDerWaalsContact O-N 3.08Å; S299-S302 WeakPolarHBondContact OG-CB 3.48Å; S299-S302 PolarHBondContact OG-N 3.22Å; S299-S302 VanDerWaalsContact OG-N 3.16Å; S299-S302 PolarHBondContact OG-OG 3.15Å; S299-Q303 WeakPolarHBondContact O-CG 3.5Å; S299-Q303 PolarHBondContact O-N 3.28Å
300	I	89.6	Confident	91.4	Very high	50 Å²	50	43.4 Å²	43.4	26%	0.256	23%	0.231	S	C	.	.	H	α-helix	trans	-56.1	-35.5	178.5	-69.5	175.2	0	0	0	111.2	V298 Q303 I304 L319 K323	V298-I300 PolarHBondContact O-N 3.13Å; I300-Q303 PolarHBondContact O-N 3.27Å; I300-I304 HydrophobicContact CG2-CD1 3.68Å; I300-I304 HydrophobicContact CG2-CG1 4.19Å; I300-I304 VanDerWaalsContact O-CG1 3.3Å; I300-I304 WeakPolarHBondContact O-CG1 3.22Å; I300-I304 PolarHBondContact O-N 3.32Å; I300-L319 HydrophobicContact CG2-CB 4.06Å; I300-K323 HydrophobicContact CG2-CB 4.15Å; I300-K323 HydrophobicContact CG2-CD 4.23Å; I300-K323 HydrophobicContact CG2-CG 4.26Å
301	A	88.8	Confident	91.2	Very high	40 Å²	40	45.3 Å²	45.3	33%	0.331	24%	0.238	S	C	.	.	H	α-helix	trans	-61.5	-45.7	177.6	0	0	0	0	0	112.2	S299 I304 Q305	S299-A301 PolarHBondContact O-N 3.36Å; A301-I304 PolarHBondContact O-N 3.29Å; A301-Q305 WeakPolarHBondContact O-CG 3.38Å; A301-Q305 PolarHBondContact O-N 2.87Å; A301-Q305 VanDerWaalsContact O-N 3.09Å
302	S	90.4	Very high	91	Very high	45 Å²	45	47.2 Å²	47.2	32%	0.315	25%	0.248	S	C	.	.	H	α-helix	trans	-64.6	-41.8	175.8	-55.9	0	0	0	0	111.6	S299 Q305 Q306	S299-S302 PolarHBondContact O-N 3.03Å; S299-S302 VanDerWaalsContact O-N 3.08Å; S299-S302 WeakPolarHBondContact OG-CB 3.48Å; S299-S302 PolarHBondContact OG-N 3.22Å; S299-S302 VanDerWaalsContact OG-N 3.16Å; S299-S302 PolarHBondContact OG-OG 3.15Å; S302-Q305 PolarHBondContact O-N 3.36Å; S302-Q306 WeakPolarHBondContact O-CG 3.41Å; S302-Q306 PolarHBondContact O-N 3.15Å
303	Q	92.6	Very high	90.7	Very high	5 Å²	5	47.8 Å²	47.8	2%	0.023	25%	0.25	C	S	.	.	H	α-helix	trans	-61.2	-45.5	176.7	-64.5	-175.6	39.1	0	0	111.5	D3 Y245 V298 S299 I300 Q305 Q306 L307 L319	D3-Q303 WeakPolarHBondContact O-CG 3.41Å; Y245-Q303 PolarHBondContact OH-OE1 3.48Å; V298-Q303 HydrophobicContact CB-CG 4.24Å; V298-Q303 HydrophobicContact CG1-CG 4.24Å; V298-Q303 PolarHBondContact O-NE2 3.3Å; S299-Q303 WeakPolarHBondContact O-CG 3.5Å; S299-Q303 PolarHBondContact O-N 3.28Å; I300-Q303 PolarHBondContact O-N 3.27Å; Q303-Q305 VanDerWaalsContact C-N 3.34Å; Q303-Q305 PolarHBondContact O-N 3Å; Q303-Q306 PolarHBondContact O-N 2.55Å; Q303-L307 WeakPolarHBondContact O-CB 3.47Å; Q303-L307 WeakPolarHBondContact O-CD1 3.12Å; Q303-L307 WeakPolarHBondContact O-CG 3.43Å; Q303-L307 PolarHBondContact O-N 2.8Å; Q303-L319 HydrophobicContact CB-CD1 3.93Å
304	I	91	Very high	90.5	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.015	27%	0.268	C	S	.	.	H	α-helix	trans	-59.9	-44.1	176.5	-70.7	168.6	0	0	0	110.6	I300 A301 Q306 L307 L308 L319 A320 I337	I300-I304 HydrophobicContact CG2-CD1 3.68Å; I300-I304 HydrophobicContact CG2-CG1 4.19Å; I300-I304 VanDerWaalsContact O-CG1 3.3Å; I300-I304 WeakPolarHBondContact O-CG1 3.22Å; I300-I304 PolarHBondContact O-N 3.32Å; A301-I304 PolarHBondContact O-N 3.29Å; I304-Q306 PolarHBondContact O-N 3.17Å; I304-L307 PolarHBondContact O-N 3.29Å; I304-L308 HydrophobicContact CG2-CD1 3.93Å; I304-L308 HydrophobicContact CG2-CG 4.21Å; I304-L308 WeakPolarHBondContact O-CB 3.12Å; I304-L308 VanDerWaalsContact O-CG 3.24Å; I304-L308 WeakPolarHBondContact O-CG 3.47Å; I304-L308 PolarHBondContact O-N 2.96Å; I304-L319 HydrophobicContact CD1-CB 4.41Å; I304-L319 HydrophobicContact CG1-CB 4.09Å; I304-A320 HydrophobicContact CD1-CB 3.98Å; I304-I337 HydrophobicContact CG2-CD1 3.94Å
305	Q	89.6	Confident	90.3	Very high	127 Å²	127	50.2 Å²	50.2	59%	0.593	26%	0.264	S	S	*	.	H	α-helix	trans	-60.2	-46.2	178.2	-74.6	179.5	-20.4	0	0	112.4	A301 S302 Q303 L308 Q309	A301-Q305 WeakPolarHBondContact O-CG 3.38Å; A301-Q305 PolarHBondContact O-N 2.87Å; A301-Q305 VanDerWaalsContact O-N 3.09Å; S302-Q305 PolarHBondContact O-N 3.36Å; Q303-Q305 VanDerWaalsContact C-N 3.34Å; Q303-Q305 PolarHBondContact O-N 3Å; Q305-L308 PolarHBondContact O-N 3.29Å; Q305-Q309 WeakPolarHBondContact O-CG 3.31Å; Q305-Q309 PolarHBondContact O-N 3.36Å
306	Q	90.9	Very high	90.2	Very high	58 Å²	58	50.2 Å²	50.2	27%	0.271	26%	0.264	S	S	.	.	H	α-helix	trans	-62.8	-43.3	176.1	-68.4	179	0.1	0	0	111.3	H2 S302 Q303 I304 L308 Q309 D310	H2-Q306 VanDerWaalsContact CA-OE1 3.29Å; H2-Q306 HydrophobicContact CB-CB 3.78Å; H2-Q306 VanDerWaalsContact CB-OE1 3.24Å; S302-Q306 WeakPolarHBondContact O-CG 3.41Å; S302-Q306 PolarHBondContact O-N 3.15Å; Q303-Q306 PolarHBondContact O-N 2.55Å; I304-Q306 PolarHBondContact O-N 3.17Å; Q306-L308 VanDerWaalsContact C-N 3.34Å; Q306-L308 PolarHBondContact O-N 2.98Å; Q306-Q309 WeakPolarHBondContact O-CB 3.48Å; Q306-Q309 PolarHBondContact O-N 3.3Å; Q306-D310 PolarHBondContact O-N 3.36Å
307	L	91.3	Very high	90.1	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-63.8	-36.5	178.4	-74.1	166.8	0	0	0	113.3	H2 Q303 I304 D310 K311 Q312 L315 A316 L319	H2-L307 HydrophobicContact CB-CG 4.45Å; H2-L307 WeakPolarHBondContact ND1-CD2 3.43Å; Q303-L307 WeakPolarHBondContact O-CB 3.47Å; Q303-L307 WeakPolarHBondContact O-CD1 3.12Å; Q303-L307 WeakPolarHBondContact O-CG 3.43Å; Q303-L307 PolarHBondContact O-N 2.8Å; I304-L307 PolarHBondContact O-N 3.29Å; L307-D310 CarbonylContact O-C 3.51Å; L307-D310 PolarHBondContact O-N 3.38Å; L307-K311 PolarHBondContact O-N 3.39Å; L307-Q312 HydrophobicContact CB-CB 4.47Å; L307-Q312 HydrophobicContact CD2-CB 3.63Å; L307-Q312 HydrophobicContact CD2-CG 4.34Å; L307-Q312 PolarHBondContact O-N 2.88Å; L307-L315 HydrophobicContact CD1-CB 4.29Å; L307-L315 HydrophobicContact CD1-CD2 4.18Å; L307-L315 HydrophobicContact CD1-CG 3.87Å; L307-L315 HydrophobicContact CD2-CB 4.32Å; L307-L315 HydrophobicContact CD2-CD2 3.88Å; L307-L315 HydrophobicContact CD2-CG 4.26Å; L307-A316 HydrophobicContact CB-CB 4Å; L307-A316 HydrophobicContact CD1-CB 4.3Å; L307-L319 HydrophobicContact CD1-CD1 3.44Å; L307-L319 VanDerWaalsContact CD1-CD1 3.44Å
308	L	89.6	Confident	90	Very high	42 Å²	42	50.8 Å²	50.8	22%	0.22	26%	0.262	C	S	.	.	H	α-helix	trans	-67	-38.1	175.4	-70.5	176.8	0	0	0	111.7	I304 Q305 Q306 K311 F313 A316 I337 L340	I304-L308 HydrophobicContact CG2-CD1 3.93Å; I304-L308 HydrophobicContact CG2-CG 4.21Å; I304-L308 WeakPolarHBondContact O-CB 3.12Å; I304-L308 VanDerWaalsContact O-CG 3.24Å; I304-L308 WeakPolarHBondContact O-CG 3.47Å; I304-L308 PolarHBondContact O-N 2.96Å; Q305-L308 PolarHBondContact O-N 3.29Å; Q306-L308 VanDerWaalsContact C-N 3.34Å; Q306-L308 PolarHBondContact O-N 2.98Å; L308-K311 PolarHBondContact O-N 3.29Å; L308-F313 HydrophobicContact CD2-CD1 3.62Å; L308-F313 HydrophobicContact CD2-CE1 3.65Å; L308-A316 HydrophobicContact CD2-CB 4.41Å; L308-I337 HydrophobicContact CD1-CG1 4.47Å; L308-I337 HydrophobicContact CD2-CG1 4.23Å; L308-I337 HydrophobicContact CD2-CG2 4.07Å; L308-L340 HydrophobicContact CD1-CD1 4.39Å; L308-L340 HydrophobicContact CD2-CD1 4.06Å
309	Q	87.8	Confident	89.9	Confident	152 Å²	152	49.3 Å²	49.3	71%	0.71	25%	0.252	S	S	*	.	H	α-helix	trans	-65	-42.2	173.6	-67.6	172.9	8.6	0	0	111.4	Q305 Q306 K311	Q305-Q309 WeakPolarHBondContact O-CG 3.31Å; Q305-Q309 PolarHBondContact O-N 3.36Å; Q306-Q309 WeakPolarHBondContact O-CB 3.48Å; Q306-Q309 PolarHBondContact O-N 3.3Å; Q309-K311 PolarHBondContact O-N 2.98Å
310	D	87.5	Confident	89.9	Confident	69 Å²	69	46.3 Å²	46.3	37%	0.369	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-0	177	-79.4	-2	0	0	0	114	M1 Q306 L307 Q312	M1-D310 PolarHBondContact N-OD2 2.9Å; Q306-D310 PolarHBondContact O-N 3.36Å; L307-D310 CarbonylContact O-C 3.51Å; L307-D310 PolarHBondContact O-N 3.38Å; D310-Q312 HydrophobicContact CB-CG 4.12Å; D310-Q312 PolarHBondContact O-N 2.91Å
311	K	88.7	Confident	89.8	Confident	113 Å²	113	50 Å²	50	49%	0.491	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	28	-178.6	-59.4	170	178.6	177.5	0	113.7	L307 L308 Q309 F313	L307-K311 PolarHBondContact O-N 3.39Å; L308-K311 PolarHBondContact O-N 3.29Å; Q309-K311 PolarHBondContact O-N 2.98Å; K311-F313 HydrophobicContact CB-CE2 3.8Å; K311-F313 HydrophobicContact CB-CZ 4.35Å; K311-F313 HydrophobicContact CG-CE2 4.36Å; K311-F313 VanDerWaalsContact O-CD2 3.25Å; K311-F313 WeakPolarHBondContact O-CD2 3.37Å; K311-F313 WeakPolarHBondContact O-CE2 3.39Å; K311-F313 PolarHBondContact O-N 3.29Å
312	Q	89.6	Confident	89.6	Confident	74 Å²	74	52 Å²	52	35%	0.346	25%	0.249	S	C	.	.			trans	-95.6	68	177.8	-62.5	-57	-38.7	0	0	111.3	L263 L307 D310 E314 A316	L263-Q312 HydrophobicContact CD1-CB 4.49Å; L263-Q312 HydrophobicContact CD1-CG 4.36Å; L307-Q312 HydrophobicContact CB-CB 4.47Å; L307-Q312 HydrophobicContact CD2-CB 3.63Å; L307-Q312 HydrophobicContact CD2-CG 4.34Å; L307-Q312 PolarHBondContact O-N 2.88Å; D310-Q312 HydrophobicContact CB-CG 4.12Å; D310-Q312 PolarHBondContact O-N 2.91Å; Q312-E314 PolarHBondContact O-N 3.48Å; Q312-A316 PolarHBondContact O-N 3.43Å
313	F	90.4	Very high	89.3	Confident	12 Å²	12	52.1 Å²	52.1	5%	0.053	24%	0.244	C	C	.	.	H	α-helix	trans	-70	-31.7	-171.2	-58.3	-82.6	0	0	0	114.6	L308 K311 A316 L317 I337 L340 Y341 N344	L308-F313 HydrophobicContact CD2-CD1 3.62Å; L308-F313 HydrophobicContact CD2-CE1 3.65Å; K311-F313 HydrophobicContact CB-CE2 3.8Å; K311-F313 HydrophobicContact CB-CZ 4.35Å; K311-F313 HydrophobicContact CG-CE2 4.36Å; K311-F313 VanDerWaalsContact O-CD2 3.25Å; K311-F313 WeakPolarHBondContact O-CD2 3.37Å; K311-F313 WeakPolarHBondContact O-CE2 3.39Å; K311-F313 PolarHBondContact O-N 3.29Å; F313-A316 PolarHBondContact O-N 2.9Å; F313-L317 WeakPolarHBondContact O-CB 3.46Å; F313-L317 VanDerWaalsContact O-CG 3.27Å; F313-L317 WeakPolarHBondContact O-CG 3.36Å; F313-L317 PolarHBondContact O-N 3.32Å; F313-I337 HydrophobicContact CD1-CG2 4.29Å; F313-L340 HydrophobicContact CD1-CB 4.09Å; F313-L340 HydrophobicContact CE1-CB 3.52Å; F313-L340 HydrophobicContact CE1-CD1 4.44Å; F313-L340 HydrophobicContact CZ-CB 4.31Å; F313-Y341 HydrophobicContact CB-CD2 3.46Å; F313-Y341 VanDerWaalsContact CB-CD2 3.46Å; F313-Y341 HydrophobicContact CB-CE2 4.31Å; F313-Y341 HydrophobicContact CB-CG 3.86Å; F313-Y341 AromaticContact CD2-CD2 3.81Å; F313-Y341 HydrophobicContact CD2-CD2 3.81Å; F313-Y341 AromaticContact CG-CD2 3.84Å; F313-Y341 HydrophobicContact CG-CD2 3.84Å; F313-Y341 HydrophobicContact CG-CG 4.28Å; F313-N344 HydrophobicContact CD2-CB 4.08Å; F313-N344 HydrophobicContact CE2-CB 3.39Å; F313-N344 HydrophobicContact CZ-CB 3.92Å
314	E	89.3	Confident	88.5	Confident	99 Å²	99	59.6 Å²	59.6	46%	0.463	28%	0.284	S	S	.	.	H	α-helix	trans	-64.2	-45.1	-177.5	-70.5	175.4	-167.7	0	0	111.7	P261 Q312 L317 Q318 Y341	P261-E314 HydrophobicContact CG-CB 4.15Å; Q312-E314 PolarHBondContact O-N 3.48Å; E314-L317 PolarHBondContact O-N 3.43Å; E314-Q318 PolarHBondContact O-N 3.01Å; E314-Q318 VanDerWaalsContact O-N 3.13Å; E314-Y341 HydrophobicContact CG-CE2 4.23Å; E314-Y341 PolarHBondContact OE1-OH 3.25Å
315	L	90.2	Very high	87.9	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-68.1	-39.5	174.2	-177.2	54.6	0	0	0	111.3	P244 T258 P261 L263 L307 L317 Q318 L319	P244-L315 HydrophobicContact CG-CD1 4.15Å; T258-L315 HydrophobicContact CG2-CD1 3.74Å; T258-L315 HydrophobicContact CG2-CD2 3.89Å; T258-L315 HydrophobicContact CG2-CG 4.5Å; P261-L315 HydrophobicContact CG-CB 4.3Å; L263-L315 HydrophobicContact CD1-CB 4.39Å; L263-L315 HydrophobicContact CD1-CD2 4.18Å; L307-L315 HydrophobicContact CD1-CB 4.29Å; L307-L315 HydrophobicContact CD1-CD2 4.18Å; L307-L315 HydrophobicContact CD1-CG 3.87Å; L307-L315 HydrophobicContact CD2-CB 4.32Å; L307-L315 HydrophobicContact CD2-CD2 3.88Å; L307-L315 HydrophobicContact CD2-CG 4.26Å; L315-L317 VanDerWaalsContact C-N 3.26Å; L315-L317 PolarHBondContact O-N 3.41Å; L315-Q318 PolarHBondContact O-N 3.06Å; L315-Q318 VanDerWaalsContact O-N 3.15Å; L315-L319 HydrophobicContact CD1-CG 4.29Å; L315-L319 HydrophobicContact CG-CD1 4.39Å; L315-L319 WeakPolarHBondContact O-CG 3.28Å; L315-L319 PolarHBondContact O-N 3.46Å
316	A	91.4	Very high	87.5	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-58.8	-38.5	175.1	0	0	0	0	0	112	L307 L308 Q312 F313 A320 I337	L307-A316 HydrophobicContact CB-CB 4Å; L307-A316 HydrophobicContact CD1-CB 4.3Å; L308-A316 HydrophobicContact CD2-CB 4.41Å; Q312-A316 PolarHBondContact O-N 3.43Å; F313-A316 PolarHBondContact O-N 2.9Å; A316-A320 VanDerWaalsContact O-CB 3.31Å; A316-A320 WeakPolarHBondContact O-CB 3.3Å; A316-A320 PolarHBondContact O-N 2.92Å; A316-I337 HydrophobicContact CB-CG2 4.19Å
317	L	90.6	Very high	87	Confident	21 Å²	21	61.1 Å²	61.1	11%	0.11	30%	0.303	C	S	.	.	H	α-helix	trans	-68.1	-38.7	175.4	-73	170.7	0	0	0	112.7	F313 E314 L315 K321 I334 I337 Q338	F313-L317 WeakPolarHBondContact O-CB 3.46Å; F313-L317 VanDerWaalsContact O-CG 3.27Å; F313-L317 WeakPolarHBondContact O-CG 3.36Å; F313-L317 PolarHBondContact O-N 3.32Å; E314-L317 PolarHBondContact O-N 3.43Å; L315-L317 VanDerWaalsContact C-N 3.26Å; L315-L317 PolarHBondContact O-N 3.41Å; L317-K321 VanDerWaalsContact O-CG 3.3Å; L317-K321 WeakPolarHBondContact O-CG 3.5Å; L317-K321 PolarHBondContact O-N 3.29Å; L317-K321 VanDerWaalsContact O-N 3.08Å; L317-I334 HydrophobicContact CD2-CG2 4.18Å; L317-I337 HydrophobicContact CD2-CB 3.7Å; L317-I337 HydrophobicContact CD2-CG2 3.48Å; L317-I337 VanDerWaalsContact CD2-CG2 3.48Å; L317-I337 HydrophobicContact CG-CB 4.39Å; L317-I337 HydrophobicContact CG-CG2 3.6Å; L317-Q338 HydrophobicContact CD1-CG 4.14Å; L317-Q338 HydrophobicContact CD2-CG 3.66Å
318	Q	89.2	Confident	86.4	Confident	57 Å²	57	63 Å²	63	27%	0.266	32%	0.323	S	S	.	.	H	α-helix	trans	-64	-46.6	174.8	-73.2	177.9	-17.7	0	0	111.2	E260 E314 L315 A320 K321 M322	E260-Q318 VanDerWaalsContact O-CD 3.31Å; E260-Q318 PolarHBondContact O-NE2 3.28Å; E260-Q318 PolarHBondContact O-OE1 2.89Å; E260-Q318 VanDerWaalsContact O-OE1 3.04Å; E314-Q318 PolarHBondContact O-N 3.01Å; E314-Q318 VanDerWaalsContact O-N 3.13Å; L315-Q318 PolarHBondContact O-N 3.06Å; L315-Q318 VanDerWaalsContact O-N 3.15Å; Q318-A320 PolarHBondContact O-N 3.41Å; Q318-K321 WeakPolarHBondContact O-CB 3.24Å; Q318-K321 PolarHBondContact O-N 3.27Å; Q318-K321 VanDerWaalsContact O-N 3.16Å; Q318-M322 WeakPolarHBondContact O-CG 3.32Å; Q318-M322 PolarHBondContact O-N 3.48Å
319	L	89.1	Confident	85.9	Confident	3 Å²	3	66.3 Å²	66.3	2%	0.016	34%	0.337	C	S	.	.	H	α-helix	trans	-63.4	-40.9	177	-68.6	180	0	0	0	112.2	P244 Y245 I300 Q303 I304 L307 L315 K321 M322 K323	P244-L319 HydrophobicContact CG-CD2 3.73Å; Y245-L319 HydrophobicContact CE2-CD2 4.41Å; I300-L319 HydrophobicContact CG2-CB 4.06Å; Q303-L319 HydrophobicContact CB-CD1 3.93Å; I304-L319 HydrophobicContact CD1-CB 4.41Å; I304-L319 HydrophobicContact CG1-CB 4.09Å; L307-L319 HydrophobicContact CD1-CD1 3.44Å; L307-L319 VanDerWaalsContact CD1-CD1 3.44Å; L315-L319 HydrophobicContact CD1-CG 4.29Å; L315-L319 HydrophobicContact CG-CD1 4.39Å; L315-L319 WeakPolarHBondContact O-CG 3.28Å; L315-L319 PolarHBondContact O-N 3.46Å; L319-K321 VanDerWaalsContact C-N 3.27Å; L319-K321 PolarHBondContact O-N 3.08Å; L319-M322 PolarHBondContact O-N 3Å; L319-M322 VanDerWaalsContact O-N 3.09Å; L319-K323 PolarHBondContact O-N 2.85Å
320	A	89.8	Confident	85.8	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-62.4	-33.5	175	0	0	0	0	0	112.5	I304 A316 Q318 K330 I334 I337	I304-A320 HydrophobicContact CD1-CB 3.98Å; A316-A320 VanDerWaalsContact O-CB 3.31Å; A316-A320 WeakPolarHBondContact O-CB 3.3Å; A316-A320 PolarHBondContact O-N 2.92Å; Q318-A320 PolarHBondContact O-N 3.41Å; A320-K330 WeakPolarHBondContact O-CE 3.22Å; A320-I334 HydrophobicContact CB-CG1 3.97Å; A320-I337 HydrophobicContact CB-CD1 3.83Å
321	K	88.5	Confident	85.7	Confident	127 Å²	127	64 Å²	64	55%	0.552	32%	0.322	S	S	*	.	H	α-helix	trans	-72.2	-28.4	173.4	-73.3	172.7	-178.6	-178.7	0	113.2	L317 Q318 L319 K330 I334	L317-K321 VanDerWaalsContact O-CG 3.3Å; L317-K321 WeakPolarHBondContact O-CG 3.5Å; L317-K321 PolarHBondContact O-N 3.29Å; L317-K321 VanDerWaalsContact O-N 3.08Å; Q318-K321 WeakPolarHBondContact O-CB 3.24Å; Q318-K321 PolarHBondContact O-N 3.27Å; Q318-K321 VanDerWaalsContact O-N 3.16Å; L319-K321 VanDerWaalsContact C-N 3.27Å; L319-K321 PolarHBondContact O-N 3.08Å; K321-K330 WeakPolarHBondContact O-CE 3.34Å; K321-K330 PolarHBondContact O-NZ 2.68Å; K321-I334 HydrophobicContact CG-CD1 3.87Å
322	M	84	Confident	85.4	Confident	84 Å²	84	65 Å²	65	41%	0.414	33%	0.328	S	S	.	.	H	α-helix	trans	-85.2	-14.1	177.8	-68.1	176.5	176.2	0	0	113.1	P243 P244 Q318 L319	P243-M322 HydrophobicContact CB-CE 4.27Å; P244-M322 HydrophobicContact CB-CE 3.97Å; P244-M322 HydrophobicContact CB-SD 4.25Å; P244-M322 VanDerWaalsContact CD-SD 3.59Å; P244-M322 HydrophobicContact CG-CE 4.46Å; P244-M322 HydrophobicContact CG-SD 4.09Å; Q318-M322 WeakPolarHBondContact O-CG 3.32Å; Q318-M322 PolarHBondContact O-N 3.48Å; L319-M322 PolarHBondContact O-N 3Å; L319-M322 VanDerWaalsContact O-N 3.09Å
323	K	84.6	Confident	85.2	Confident	46 Å²	46	63.8 Å²	63.8	20%	0.2	32%	0.322	C	S	.	.	S	Bend	trans	-67	133.4	177.4	-163.2	177.4	174.8	-140.7	0	111.3	I300 L319 D325 K330	I300-K323 HydrophobicContact CG2-CB 4.15Å; I300-K323 HydrophobicContact CG2-CD 4.23Å; I300-K323 HydrophobicContact CG2-CG 4.26Å; L319-K323 PolarHBondContact O-N 2.85Å; K323-D325 VanDerWaalsContact C-N 3.28Å; K323-D325 WeakPolarHBondContact CD-OD2 3.21Å; K323-D325 VanDerWaalsContact CE-CG 3.48Å; K323-D325 WeakPolarHBondContact CE-OD1 3.31Å; K323-D325 WeakPolarHBondContact CE-OD2 3.34Å; K323-D325 VanDerWaalsContact NZ-CG 3.26Å; K323-D325 IonicContact NZ-OD1 3.77Å; K323-D325 PolarHBondContact NZ-OD1 3.11Å; K323-D325 VanDerWaalsContact NZ-OD1 3.08Å; K323-D325 IonicContact NZ-OD2 2.75Å; K323-D325 PolarHBondContact NZ-OD2 2.84Å; K323-D325 PolarHBondContact O-N 2.79Å; K323-D325 VanDerWaalsContact O-N 3.12Å; K323-K330 PolarHBondContact O-NZ 2.61Å
324	D	76.5	Confident	85.1	Confident	162 Å²	162	64.4 Å²	64.4	87%	0.866	33%	0.326	S	S	*	.			trans	-83.6	64.6	176.4	-67.6	-33.5	0	0	0	111.1
325	D	77.9	Confident	85	Confident	48 Å²	48	62.2 Å²	62.2	26%	0.257	32%	0.316	S	S	.	.			trans	-102.4	166.6	174.1	-74.5	-11.8	0	0	0	111.6	K323 K330	K323-D325 VanDerWaalsContact C-N 3.28Å; K323-D325 WeakPolarHBondContact CD-OD2 3.21Å; K323-D325 VanDerWaalsContact CE-CG 3.48Å; K323-D325 WeakPolarHBondContact CE-OD1 3.31Å; K323-D325 WeakPolarHBondContact CE-OD2 3.34Å; K323-D325 VanDerWaalsContact NZ-CG 3.26Å; K323-D325 IonicContact NZ-OD1 3.77Å; K323-D325 PolarHBondContact NZ-OD1 3.11Å; K323-D325 VanDerWaalsContact NZ-OD1 3.08Å; K323-D325 IonicContact NZ-OD2 2.75Å; K323-D325 PolarHBondContact NZ-OD2 2.84Å; K323-D325 PolarHBondContact O-N 2.79Å; K323-D325 VanDerWaalsContact O-N 3.12Å; D325-K330 HydrophobicContact CB-CB 4.26Å
326	S	81.4	Confident	84.8	Confident	63 Å²	63	66.6 Å²	66.6	44%	0.441	34%	0.336	S	S	.	.			trans	-56.3	144	167.6	72.6	0	0	0	0	111	G328 E329 K330	S326-G328 PolarHBondContact O-N 3.4Å; S326-E329 PolarHBondContact O-N 3.49Å; S326-E329 WeakPolarHBondContact OG-CB 3.35Å; S326-E329 VanDerWaalsContact OG-CD 3.23Å; S326-E329 VanDerWaalsContact OG-CG 3.3Å; S326-E329 WeakPolarHBondContact OG-CG 3.21Å; S326-E329 PolarHBondContact OG-OE2 2.81Å; S326-K330 WeakPolarHBondContact O-CB 3.43Å; S326-K330 PolarHBondContact O-N 3.24Å
327	D	79.3	Confident	84.7	Confident	109 Å²	109	66.6 Å²	66.6	58%	0.583	34%	0.336	S	S	*	.	H	α-helix	trans	-59.8	-24	-172.8	-144.3	53.1	0	0	0	112.8	K331	D327-K331 VanDerWaalsContact O-CD 3.31Å; D327-K331 WeakPolarHBondContact O-CD 3.44Å; D327-K331 WeakPolarHBondContact O-CG 3.25Å; D327-K331 PolarHBondContact O-N 2.83Å; D327-K331 WeakPolarHBondContact OD2-CE 3.36Å; D327-K331 IonicContact OD2-NZ 3.89Å; D327-K331 PolarHBondContact OD2-NZ 3.26Å
328	G	78.7	Confident	84.7	Confident	41 Å²	41	68.6 Å²	68.6	42%	0.423	35%	0.345	S	S	.	.	H	α-helix	trans	-76.1	-53.5	175.2	0	0	0	0	0	113.7	S326 K330 K331 Q332	S326-G328 PolarHBondContact O-N 3.4Å; G328-K330 VanDerWaalsContact C-N 3.29Å; G328-K330 PolarHBondContact O-N 2.64Å; G328-K331 PolarHBondContact O-N 3.08Å; G328-Q332 WeakPolarHBondContact O-CG 3.34Å; G328-Q332 PolarHBondContact O-N 2.55Å
329	E	80.3	Confident	84.6	Confident	111 Å²	111	66.3 Å²	66.3	52%	0.519	33%	0.334	S	S	.	.	H	α-helix	trans	-62	-40	179.5	-69.8	167	151.8	0	0	111.1	S326 K331 Q332 Q333	S326-E329 PolarHBondContact O-N 3.49Å; S326-E329 WeakPolarHBondContact OG-CB 3.35Å; S326-E329 VanDerWaalsContact OG-CD 3.23Å; S326-E329 VanDerWaalsContact OG-CG 3.3Å; S326-E329 WeakPolarHBondContact OG-CG 3.21Å; S326-E329 PolarHBondContact OG-OE2 2.81Å; E329-K331 PolarHBondContact O-N 3.21Å; E329-Q332 PolarHBondContact O-N 2.73Å; E329-Q333 WeakPolarHBondContact O-CB 3.46Å; E329-Q333 PolarHBondContact O-N 3.34Å
330	K	84.6	Confident	84.6	Confident	46 Å²	46	67.7 Å²	67.7	20%	0.2	34%	0.341	C	S	.	.	H	α-helix	trans	-58.6	-45.2	175.3	-171.2	170.8	-173.6	159.2	0	112.2	A320 K321 K323 D325 S326 G328 Q333 I334	A320-K330 WeakPolarHBondContact O-CE 3.22Å; K321-K330 WeakPolarHBondContact O-CE 3.34Å; K321-K330 PolarHBondContact O-NZ 2.68Å; K323-K330 PolarHBondContact O-NZ 2.61Å; D325-K330 HydrophobicContact CB-CB 4.26Å; S326-K330 WeakPolarHBondContact O-CB 3.43Å; S326-K330 PolarHBondContact O-N 3.24Å; G328-K330 VanDerWaalsContact C-N 3.29Å; G328-K330 PolarHBondContact O-N 2.64Å; K330-Q333 PolarHBondContact O-N 3.17Å; K330-I334 HydrophobicContact CG-CD1 3.94Å; K330-I334 WeakPolarHBondContact O-CB 3.49Å; K330-I334 WeakPolarHBondContact O-CD1 3.43Å; K330-I334 WeakPolarHBondContact O-CG1 3.26Å; K330-I334 PolarHBondContact O-N 2.49Å
331	K	84.8	Confident	84.6	Confident	128 Å²	128	69.9 Å²	69.9	56%	0.557	35%	0.35	S	S	*	.	H	α-helix	trans	-64.4	-41.8	177	-78	170.2	-169.1	156.6	0	111.8	D327 G328 E329 H335	D327-K331 VanDerWaalsContact O-CD 3.31Å; D327-K331 WeakPolarHBondContact O-CD 3.44Å; D327-K331 WeakPolarHBondContact O-CG 3.25Å; D327-K331 PolarHBondContact O-N 2.83Å; D327-K331 WeakPolarHBondContact OD2-CE 3.36Å; D327-K331 IonicContact OD2-NZ 3.89Å; D327-K331 PolarHBondContact OD2-NZ 3.26Å; G328-K331 PolarHBondContact O-N 3.08Å; E329-K331 PolarHBondContact O-N 3.21Å; K331-H335 VanDerWaalsContact O-CB 3.27Å; K331-H335 WeakPolarHBondContact O-CB 3.33Å; K331-H335 PolarHBondContact O-N 3.44Å
332	Q	83.6	Confident	84.8	Confident	133 Å²	133	63.9 Å²	63.9	62%	0.621	32%	0.324	S	S	*	.	H	α-helix	trans	-63.7	-46.8	177.2	-71.3	176.3	-11.7	0	0	111.6	G328 E329 I334 H335 H336	G328-Q332 WeakPolarHBondContact O-CG 3.34Å; G328-Q332 PolarHBondContact O-N 2.55Å; E329-Q332 PolarHBondContact O-N 2.73Å; Q332-I334 PolarHBondContact O-N 3.48Å; Q332-H335 PolarHBondContact O-N 3.46Å; Q332-H336 WeakPolarHBondContact O-CB 3.35Å; Q332-H336 PolarHBondContact O-N 3.29Å
333	Q	85.3	Confident	85.1	Confident	48 Å²	48	60 Å²	60	22%	0.224	31%	0.305	C	S	.	.	H	α-helix	trans	-63.2	-44.5	178.2	-170	174.8	19	0	0	111.6	E329 K330 H336 I337	E329-Q333 WeakPolarHBondContact O-CB 3.46Å; E329-Q333 PolarHBondContact O-N 3.34Å; K330-Q333 PolarHBondContact O-N 3.17Å; Q333-H336 PolarHBondContact O-N 3.49Å; Q333-I337 HydrophobicContact CG-CD1 4.07Å; Q333-I337 VanDerWaalsContact O-CG1 3.26Å; Q333-I337 WeakPolarHBondContact O-CG1 3.46Å; Q333-I337 PolarHBondContact O-N 3.19Å
334	I	88.4	Confident	85.3	Confident	25 Å²	25	58.2 Å²	58.2	13%	0.128	30%	0.297	C	S	.	.	H	α-helix	trans	-60.3	-47.4	175.5	-71.3	168.6	0	0	0	110.5	L317 A320 K321 K330 Q332 H336 I337 Q338	L317-I334 HydrophobicContact CD2-CG2 4.18Å; A320-I334 HydrophobicContact CB-CG1 3.97Å; K321-I334 HydrophobicContact CG-CD1 3.87Å; K330-I334 HydrophobicContact CG-CD1 3.94Å; K330-I334 WeakPolarHBondContact O-CB 3.49Å; K330-I334 WeakPolarHBondContact O-CD1 3.43Å; K330-I334 WeakPolarHBondContact O-CG1 3.26Å; K330-I334 PolarHBondContact O-N 2.49Å; Q332-I334 PolarHBondContact O-N 3.48Å; I334-H336 VanDerWaalsContact C-N 3.3Å; I334-H336 PolarHBondContact O-N 2.97Å; I334-I337 PolarHBondContact O-N 3.48Å; I334-Q338 HydrophobicContact CG2-CG 4.27Å; I334-Q338 WeakPolarHBondContact O-CB 3.45Å; I334-Q338 VanDerWaalsContact O-CG 3.25Å; I334-Q338 WeakPolarHBondContact O-CG 3.47Å; I334-Q338 PolarHBondContact O-N 3Å
335	H	86.7	Confident	86	Confident	53 Å²	53	50.7 Å²	50.7	25%	0.245	26%	0.257	C	S	.	.	H	α-helix	trans	-60.1	-41.7	178.3	-172.6	-40.3	0	0	0	111.3	K331 Q332 Q338 N339	K331-H335 VanDerWaalsContact O-CB 3.27Å; K331-H335 WeakPolarHBondContact O-CB 3.33Å; K331-H335 PolarHBondContact O-N 3.44Å; Q332-H335 PolarHBondContact O-N 3.46Å; H335-Q338 PolarHBondContact O-N 3.4Å; H335-N339 PolarHBondContact CE1-ND2 3.43Å; H335-N339 PolarHBondContact ND1-ND2 3.23Å; H335-N339 PolarHBondContact O-N 3.28Å
336	H	85.7	Confident	86.6	Confident	94 Å²	94	48.4 Å²	48.4	44%	0.435	25%	0.245	S	C	.	.	H	α-helix	trans	-61.5	-48.9	176.8	-179.3	72.3	0	0	0	111.8	Q332 Q333 I334 Q338 N339 L340	Q332-H336 WeakPolarHBondContact O-CB 3.35Å; Q332-H336 PolarHBondContact O-N 3.29Å; Q333-H336 PolarHBondContact O-N 3.49Å; I334-H336 VanDerWaalsContact C-N 3.3Å; I334-H336 PolarHBondContact O-N 2.97Å; H336-Q338 VanDerWaalsContact C-N 3.3Å; H336-Q338 PolarHBondContact O-N 3.41Å; H336-N339 PolarHBondContact O-N 3.09Å; H336-L340 PolarHBondContact O-N 3.47Å; H336-L340 VanDerWaalsContact O-N 3.1Å
337	I	89.6	Confident	87	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.8	-39.1	177.7	-61.8	167.7	0	0	0	110.8	I304 L308 F313 A316 L317 A320 Q333 I334 L340 Y341	I304-I337 HydrophobicContact CG2-CD1 3.94Å; L308-I337 HydrophobicContact CD1-CG1 4.47Å; L308-I337 HydrophobicContact CD2-CG1 4.23Å; L308-I337 HydrophobicContact CD2-CG2 4.07Å; F313-I337 HydrophobicContact CD1-CG2 4.29Å; A316-I337 HydrophobicContact CB-CG2 4.19Å; L317-I337 HydrophobicContact CD2-CB 3.7Å; L317-I337 HydrophobicContact CD2-CG2 3.48Å; L317-I337 VanDerWaalsContact CD2-CG2 3.48Å; L317-I337 HydrophobicContact CG-CB 4.39Å; L317-I337 HydrophobicContact CG-CG2 3.6Å; A320-I337 HydrophobicContact CB-CD1 3.83Å; Q333-I337 HydrophobicContact CG-CD1 4.07Å; Q333-I337 VanDerWaalsContact O-CG1 3.26Å; Q333-I337 WeakPolarHBondContact O-CG1 3.46Å; Q333-I337 PolarHBondContact O-N 3.19Å; I334-I337 PolarHBondContact O-N 3.48Å; I337-L340 PolarHBondContact O-N 3.1Å; I337-Y341 WeakPolarHBondContact O-CB 3.39Å; I337-Y341 PolarHBondContact O-N 3.32Å
338	Q	90.1	Very high	87.5	Confident	62 Å²	62	46.7 Å²	46.7	29%	0.29	23%	0.23	S	C	.	.	H	α-helix	trans	-66.1	-38.5	177.6	-72.7	175.8	-32.8	0	0	112.7	L317 I334 H335 H336 Y341 A342 L361	L317-Q338 HydrophobicContact CD1-CG 4.14Å; L317-Q338 HydrophobicContact CD2-CG 3.66Å; I334-Q338 HydrophobicContact CG2-CG 4.27Å; I334-Q338 WeakPolarHBondContact O-CB 3.45Å; I334-Q338 VanDerWaalsContact O-CG 3.25Å; I334-Q338 WeakPolarHBondContact O-CG 3.47Å; I334-Q338 PolarHBondContact O-N 3Å; H335-Q338 PolarHBondContact O-N 3.4Å; H336-Q338 VanDerWaalsContact C-N 3.3Å; H336-Q338 PolarHBondContact O-N 3.41Å; Q338-Y341 PolarHBondContact O-N 3.47Å; Q338-A342 WeakPolarHBondContact O-CB 3.41Å; Q338-A342 PolarHBondContact O-N 3.38Å; Q338-L361 HydrophobicContact CB-CD1 3.82Å; Q338-L361 HydrophobicContact CB-CD2 3.74Å; Q338-L361 HydrophobicContact CB-CG 4.29Å; Q338-L361 HydrophobicContact CG-CD2 4.48Å; Q338-L361 VanDerWaalsContact OE1-CD2 3.22Å
339	N	87.8	Confident	88.1	Confident	9 Å²	9	49 Å²	49	5%	0.048	23%	0.229	C	C	.	.	H	α-helix	trans	-61.4	-45.6	172.7	-89.7	-22	0	0	0	111	H335 H336 Y341 A342 F343 L361 T363 P430 L431	H335-N339 PolarHBondContact CE1-ND2 3.43Å; H335-N339 PolarHBondContact ND1-ND2 3.23Å; H335-N339 PolarHBondContact O-N 3.28Å; H336-N339 PolarHBondContact O-N 3.09Å; N339-Y341 VanDerWaalsContact C-N 3.33Å; N339-Y341 PolarHBondContact O-N 3.09Å; N339-A342 PolarHBondContact O-N 2.9Å; N339-F343 WeakPolarHBondContact O-CB 3.48Å; N339-F343 PolarHBondContact O-N 2.88Å; N339-L361 VanDerWaalsContact OD1-CD1 3.26Å; N339-L361 WeakPolarHBondContact OD1-CD1 3.35Å; N339-T363 PolarHBondContact OD1-OG1 3.17Å; N339-P430 PolarHBondContact ND2-O 2.86Å; N339-L431 PolarHBondContact ND2-O 3.41Å
340	L	88.5	Confident	88.6	Confident	32 Å²	32	48.3 Å²	48.3	17%	0.168	22%	0.224	C	C	.	.	H	α-helix	trans	-63.2	-39.2	176.6	-65.6	178.8	0	0	0	112	L308 F313 H336 I337 F343 N344 P387	L308-L340 HydrophobicContact CD1-CD1 4.39Å; L308-L340 HydrophobicContact CD2-CD1 4.06Å; F313-L340 HydrophobicContact CD1-CB 4.09Å; F313-L340 HydrophobicContact CE1-CB 3.52Å; F313-L340 HydrophobicContact CE1-CD1 4.44Å; F313-L340 HydrophobicContact CZ-CB 4.31Å; H336-L340 PolarHBondContact O-N 3.47Å; H336-L340 VanDerWaalsContact O-N 3.1Å; I337-L340 PolarHBondContact O-N 3.1Å; L340-F343 PolarHBondContact O-N 3.4Å; L340-N344 WeakPolarHBondContact O-CB 3.49Å; L340-N344 PolarHBondContact O-N 3.05Å; L340-P387 HydrophobicContact CD2-CB 3.74Å; L340-P387 HydrophobicContact CD2-CG 3.49Å; L340-P387 VanDerWaalsContact CD2-CG 3.49Å
341	Y	91.3	Very high	89	Confident	47 Å²	47	46.2 Å²	46.2	18%	0.184	22%	0.215	C	C	.	.	H	α-helix	trans	-64.1	-47.8	175.8	179.2	-124.4	0	0	0	112.2	F313 E314 I337 Q338 N339 F343 N344 L345 V357	F313-Y341 HydrophobicContact CB-CD2 3.46Å; F313-Y341 VanDerWaalsContact CB-CD2 3.46Å; F313-Y341 HydrophobicContact CB-CE2 4.31Å; F313-Y341 HydrophobicContact CB-CG 3.86Å; F313-Y341 AromaticContact CD2-CD2 3.81Å; F313-Y341 HydrophobicContact CD2-CD2 3.81Å; F313-Y341 AromaticContact CG-CD2 3.84Å; F313-Y341 HydrophobicContact CG-CD2 3.84Å; F313-Y341 HydrophobicContact CG-CG 4.28Å; E314-Y341 HydrophobicContact CG-CE2 4.23Å; E314-Y341 PolarHBondContact OE1-OH 3.25Å; I337-Y341 WeakPolarHBondContact O-CB 3.39Å; I337-Y341 PolarHBondContact O-N 3.32Å; Q338-Y341 PolarHBondContact O-N 3.47Å; N339-Y341 VanDerWaalsContact C-N 3.33Å; N339-Y341 PolarHBondContact O-N 3.09Å; Y341-F343 VanDerWaalsContact C-N 3.29Å; Y341-F343 PolarHBondContact O-N 3.4Å; Y341-N344 PolarHBondContact O-N 3.4Å; Y341-N344 VanDerWaalsContact O-N 3.09Å; Y341-L345 HydrophobicContact CD1-CD1 3.99Å; Y341-L345 HydrophobicContact CD2-CD1 4.46Å; Y341-L345 HydrophobicContact CD2-CG 4.25Å; Y341-L345 HydrophobicContact CE1-CD1 3.58Å; Y341-L345 HydrophobicContact CE1-CG 4.32Å; Y341-L345 HydrophobicContact CE2-CD1 4.15Å; Y341-L345 HydrophobicContact CE2-CD2 4.08Å; Y341-L345 HydrophobicContact CE2-CG 3.99Å; Y341-L345 HydrophobicContact CG-CD1 4.43Å; Y341-L345 WeakPolarHBondContact O-CG 3.39Å; Y341-L345 PolarHBondContact O-N 3.33Å; Y341-V357 HydrophobicContact CD1-CG2 4.39Å; Y341-V357 HydrophobicContact CE1-CG2 4.36Å
342	A	91.3	Very high	89.3	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-58.1	-43.9	177.1	0	0	0	0	0	111.3	Q338 N339 L345 F346 S354 V357 F358	Q338-A342 WeakPolarHBondContact O-CB 3.41Å; Q338-A342 PolarHBondContact O-N 3.38Å; N339-A342 PolarHBondContact O-N 2.9Å; A342-L345 PolarHBondContact O-N 3.35Å; A342-F346 PolarHBondContact O-N 3.38Å; A342-F346 VanDerWaalsContact O-N 3.17Å; A342-S354 WeakPolarHBondContact O-CB 3.38Å; A342-S354 PolarHBondContact O-OG 2.62Å; A342-V357 HydrophobicContact CB-CB 3.85Å; A342-V357 HydrophobicContact CB-CG1 3.7Å; A342-F358 HydrophobicContact CB-CD1 3.64Å; A342-F358 HydrophobicContact CB-CD2 4.14Å; A342-F358 HydrophobicContact CB-CE1 3.42Å; A342-F358 VanDerWaalsContact CB-CE1 3.42Å; A342-F358 HydrophobicContact CB-CE2 3.94Å; A342-F358 HydrophobicContact CB-CG 4Å; A342-F358 HydrophobicContact CB-CZ 3.58Å
343	F	90.6	Very high	89.7	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.009	20%	0.197	C	C	.	.	H	α-helix	trans	-63.4	-41.7	174.3	-178.8	-92.2	0	0	0	112.2	N339 L340 Y341 F346 C347 F358 L371 Y386 P387 N388 L390	N339-F343 WeakPolarHBondContact O-CB 3.48Å; N339-F343 PolarHBondContact O-N 2.88Å; L340-F343 PolarHBondContact O-N 3.4Å; Y341-F343 VanDerWaalsContact C-N 3.29Å; Y341-F343 PolarHBondContact O-N 3.4Å; F343-F346 VanDerWaalsContact O-CB 3.3Å; F343-F346 WeakPolarHBondContact O-CB 3.48Å; F343-F346 PolarHBondContact O-N 2.7Å; F343-C347 WeakPolarHBondContact CE1-SG 3.49Å; F343-C347 PolarHBondContact O-N 3.5Å; F343-C347 VanDerWaalsContact O-N 3.07Å; F343-C347 PolarHBondContact O-SG 2.86Å; F343-F358 HydrophobicContact CB-CZ 4.42Å; F343-L371 HydrophobicContact CD2-CD2 3.8Å; F343-L371 HydrophobicContact CE2-CD2 3.65Å; F343-Y386 HydrophobicContact CD2-CD1 4.28Å; F343-Y386 AromaticContact CE2-CD1 3.83Å; F343-Y386 HydrophobicContact CE2-CD1 3.83Å; F343-Y386 HydrophobicContact CE2-CG 4.09Å; F343-P387 HydrophobicContact CD1-CB 4.31Å; F343-P387 HydrophobicContact CD1-CG 4.21Å; F343-P387 HydrophobicContact CE1-CB 4.39Å; F343-P387 HydrophobicContact CG-CG 4.33Å; F343-N388 HydrophobicContact CE1-CB 3.94Å; F343-N388 HydrophobicContact CZ-CB 4.5Å; F343-N388 WeakPolarHBondContact CZ-O 3.47Å; F343-L390 HydrophobicContact CE2-CD2 3.73Å; F343-L390 HydrophobicContact CZ-CD2 4.05Å
344	N	89.4	Confident	90.1	Very high	9 Å²	9	38.5 Å²	38.5	5%	0.048	19%	0.186	C	C	.	.	H	α-helix	trans	-65.2	-41.1	177.6	-171.3	-95.5	0	0	0	112.7	F313 L340 Y341 F346 C347 Q348	F313-N344 HydrophobicContact CD2-CB 4.08Å; F313-N344 HydrophobicContact CE2-CB 3.39Å; F313-N344 HydrophobicContact CZ-CB 3.92Å; L340-N344 WeakPolarHBondContact O-CB 3.49Å; L340-N344 PolarHBondContact O-N 3.05Å; Y341-N344 PolarHBondContact O-N 3.4Å; Y341-N344 VanDerWaalsContact O-N 3.09Å; N344-F346 PolarHBondContact O-N 3.38Å; N344-C347 WeakPolarHBondContact O-CB 3.22Å; N344-C347 PolarHBondContact O-N 3.49Å; N344-C347 VanDerWaalsContact O-N 3.13Å; N344-Q348 WeakPolarHBondContact O-CG 3.42Å; N344-Q348 PolarHBondContact O-N 2.67Å; N344-Q348 PolarHBondContact OD1-NE2 3.2Å
345	L	91.1	Very high	90.3	Very high	4 Å²	4	37.7 Å²	37.7	2%	0.021	18%	0.182	C	C	.	.	H	α-helix	trans	-58	-38.7	173.5	-73	172.8	0	0	0	111.6	Y341 A342 Q348 K349 K350 D353 V357	Y341-L345 HydrophobicContact CD1-CD1 3.99Å; Y341-L345 HydrophobicContact CD2-CD1 4.46Å; Y341-L345 HydrophobicContact CD2-CG 4.25Å; Y341-L345 HydrophobicContact CE1-CD1 3.58Å; Y341-L345 HydrophobicContact CE1-CG 4.32Å; Y341-L345 HydrophobicContact CE2-CD1 4.15Å; Y341-L345 HydrophobicContact CE2-CD2 4.08Å; Y341-L345 HydrophobicContact CE2-CG 3.99Å; Y341-L345 HydrophobicContact CG-CD1 4.43Å; Y341-L345 WeakPolarHBondContact O-CG 3.39Å; Y341-L345 PolarHBondContact O-N 3.33Å; A342-L345 PolarHBondContact O-N 3.35Å; L345-Q348 CarbonylContact O-C 3.53Å; L345-Q348 PolarHBondContact O-N 3.5Å; L345-K349 PolarHBondContact O-N 3.28Å; L345-K350 HydrophobicContact CD2-CB 4.36Å; L345-K350 HydrophobicContact CD2-CD 3.9Å; L345-K350 PolarHBondContact O-N 3.29Å; L345-D353 HydrophobicContact CD1-CB 4.08Å; L345-V357 HydrophobicContact CD1-CG2 4.22Å
346	F	91.3	Very high	90.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.4	-48.8	173.3	-172	-91	0	0	0	111.5	A342 F343 N344 Q348 K349 F351 S354 M355 L371 Y372 P391 L393	A342-F346 PolarHBondContact O-N 3.38Å; A342-F346 VanDerWaalsContact O-N 3.17Å; F343-F346 VanDerWaalsContact O-CB 3.3Å; F343-F346 WeakPolarHBondContact O-CB 3.48Å; F343-F346 PolarHBondContact O-N 2.7Å; N344-F346 PolarHBondContact O-N 3.38Å; F346-Q348 PolarHBondContact O-N 3.2Å; F346-K349 PolarHBondContact O-N 2.96Å; F346-F351 AromaticContact CD2-CD1 3.69Å; F346-F351 HydrophobicContact CD2-CD1 3.69Å; F346-F351 HydrophobicContact CD2-CE1 4.06Å; F346-F351 HydrophobicContact CE1-CE1 4.43Å; F346-F351 AromaticContact CE2-CD1 3.65Å; F346-F351 HydrophobicContact CE2-CD1 3.65Å; F346-F351 AromaticContact CE2-CE1 3.83Å; F346-F351 HydrophobicContact CE2-CE1 3.83Å; F346-F351 HydrophobicContact CG-CD1 4.39Å; F346-F351 HydrophobicContact CG-CE1 4.46Å; F346-F351 HydrophobicContact CZ-CD1 4.32Å; F346-F351 HydrophobicContact CZ-CE1 4.03Å; F346-S354 WeakPolarHBondContact CB-OG 3.29Å; F346-M355 HydrophobicContact CD2-CE 3.76Å; F346-M355 HydrophobicContact CE2-CE 3.91Å; F346-L371 HydrophobicContact CD1-CB 4.34Å; F346-L371 HydrophobicContact CD1-CD1 4.31Å; F346-L371 HydrophobicContact CD2-CD1 3.9Å; F346-L371 HydrophobicContact CE1-CB 3.79Å; F346-L371 HydrophobicContact CE2-CB 4.05Å; F346-L371 HydrophobicContact CE2-CD1 4.12Å; F346-L371 HydrophobicContact CG-CD1 3.99Å; F346-L371 HydrophobicContact CZ-CB 3.62Å; F346-L371 HydrophobicContact CZ-CD1 4.43Å; F346-Y372 HydrophobicContact CE2-CD2 4.47Å; F346-Y372 HydrophobicContact CE2-CE1 4.4Å; F346-Y372 AromaticContact CE2-CE2 3.7Å; F346-Y372 HydrophobicContact CE2-CE2 3.7Å; F346-Y372 AromaticContact CE2-CZ 3.66Å; F346-Y372 HydrophobicContact CZ-CD2 4.42Å; F346-Y372 HydrophobicContact CZ-CE2 4.08Å; F346-P391 HydrophobicContact CD1-CG 4.14Å; F346-P391 HydrophobicContact CE1-CG 3.93Å; F346-L393 HydrophobicContact CE1-CD1 4.26Å; F346-L393 HydrophobicContact CZ-CD1 3.87Å
347	C	89.4	Confident	90.8	Very high	40 Å²	40	37.1 Å²	37.1	27%	0.27	18%	0.181	S	C	.	.	H	α-helix	trans	-60.2	-31.2	175.8	-65	0	0	0	0	113	F343 N344 K349	F343-C347 WeakPolarHBondContact CE1-SG 3.49Å; F343-C347 PolarHBondContact O-N 3.5Å; F343-C347 VanDerWaalsContact O-N 3.07Å; F343-C347 PolarHBondContact O-SG 2.86Å; N344-C347 WeakPolarHBondContact O-CB 3.22Å; N344-C347 PolarHBondContact O-N 3.49Å; N344-C347 VanDerWaalsContact O-N 3.13Å; C347-K349 PolarHBondContact O-N 2.61Å
348	Q	89.8	Confident	90.8	Very high	96 Å²	96	37.1 Å²	37.1	45%	0.449	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	3.7	174.1	-67.2	-176.4	18.5	0	0	113.8	N344 L345 F346 K350	N344-Q348 WeakPolarHBondContact O-CG 3.42Å; N344-Q348 PolarHBondContact O-N 2.67Å; N344-Q348 PolarHBondContact OD1-NE2 3.2Å; L345-Q348 CarbonylContact O-C 3.53Å; L345-Q348 PolarHBondContact O-N 3.5Å; F346-Q348 PolarHBondContact O-N 3.2Å; Q348-K350 HydrophobicContact CB-CG 4.45Å; Q348-K350 PolarHBondContact O-N 3.36Å
349	K	89.9	Confident	90.7	Very high	90 Å²	90	35.4 Å²	35.4	39%	0.391	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.7	19.3	-177	-47.8	-179.3	-176.2	-172.3	0	114.1	L345 F346 C347 F351 E397	L345-K349 PolarHBondContact O-N 3.28Å; F346-K349 PolarHBondContact O-N 2.96Å; C347-K349 PolarHBondContact O-N 2.61Å; K349-F351 VanDerWaalsContact C-N 3.28Å; K349-F351 HydrophobicContact CB-CE2 4.03Å; K349-F351 HydrophobicContact CB-CZ 3.96Å; K349-F351 HydrophobicContact CG-CZ 4.28Å; K349-F351 PolarHBondContact O-N 3.34Å; K349-E397 WeakPolarHBondContact CE-OE2 3.3Å; K349-E397 IonicContact NZ-OE1 2.68Å; K349-E397 PolarHBondContact NZ-OE1 3.02Å; K349-E397 IonicContact NZ-OE2 3.37Å; K349-E397 PolarHBondContact NZ-OE2 2.9Å
350	K	92.1	Very high	90.8	Very high	96 Å²	96	43.3 Å²	43.3	42%	0.417	21%	0.211	S	C	.	.			trans	-90.2	66.8	170.9	-65.1	179.8	-178.3	168.2	0	109.1	L345 Q348 D352 D353 S354	L345-K350 HydrophobicContact CD2-CB 4.36Å; L345-K350 HydrophobicContact CD2-CD 3.9Å; L345-K350 PolarHBondContact O-N 3.29Å; Q348-K350 HydrophobicContact CB-CG 4.45Å; Q348-K350 PolarHBondContact O-N 3.36Å; K350-D352 PolarHBondContact O-N 2.92Å; K350-D353 HydrophobicContact CB-CB 4.4Å; K350-S354 WeakPolarHBondContact O-CB 3.42Å; K350-S354 PolarHBondContact O-N 3.2Å
351	F	92.9	Very high	90.6	Very high	3 Å²	3	42.8 Å²	42.8	1%	0.013	21%	0.209	C	C	.	.	H	α-helix	trans	-62.3	-43.9	-170.5	-56.1	-63.3	0	0	0	112.6	F346 K349 S354 M355 L393 K400 A401 A404	F346-F351 AromaticContact CD2-CD1 3.69Å; F346-F351 HydrophobicContact CD2-CD1 3.69Å; F346-F351 HydrophobicContact CD2-CE1 4.06Å; F346-F351 HydrophobicContact CE1-CE1 4.43Å; F346-F351 AromaticContact CE2-CD1 3.65Å; F346-F351 HydrophobicContact CE2-CD1 3.65Å; F346-F351 AromaticContact CE2-CE1 3.83Å; F346-F351 HydrophobicContact CE2-CE1 3.83Å; F346-F351 HydrophobicContact CG-CD1 4.39Å; F346-F351 HydrophobicContact CG-CE1 4.46Å; F346-F351 HydrophobicContact CZ-CD1 4.32Å; F346-F351 HydrophobicContact CZ-CE1 4.03Å; K349-F351 VanDerWaalsContact C-N 3.28Å; K349-F351 HydrophobicContact CB-CE2 4.03Å; K349-F351 HydrophobicContact CB-CZ 3.96Å; K349-F351 HydrophobicContact CG-CZ 4.28Å; K349-F351 PolarHBondContact O-N 3.34Å; F351-S354 WeakPolarHBondContact O-CB 3.35Å; F351-S354 PolarHBondContact O-N 2.79Å; F351-M355 WeakPolarHBondContact O-CB 3.45Å; F351-M355 VanDerWaalsContact O-CG 3.22Å; F351-M355 WeakPolarHBondContact O-CG 3.44Å; F351-M355 PolarHBondContact O-N 3.45Å; F351-L393 HydrophobicContact CE1-CD2 4.22Å; F351-L393 HydrophobicContact CZ-CD2 3.77Å; F351-K400 HydrophobicContact CD2-CB 4.48Å; F351-K400 HydrophobicContact CD2-CD 4.43Å; F351-K400 HydrophobicContact CD2-CG 4.28Å; F351-A401 HydrophobicContact CD1-CB 3.86Å; F351-A401 HydrophobicContact CD2-CB 3.84Å; F351-A401 HydrophobicContact CE1-CB 3.76Å; F351-A401 HydrophobicContact CE2-CB 3.73Å; F351-A401 HydrophobicContact CG-CB 3.91Å; F351-A401 HydrophobicContact CZ-CB 3.7Å; F351-A404 HydrophobicContact CB-CB 3.55Å
352	D	91.4	Very high	90.3	Very high	67 Å²	67	41.5 Å²	41.5	36%	0.358	21%	0.209	S	C	.	.	H	α-helix	trans	-61.3	-49.3	-178.5	-53.5	-63.4	0	0	0	111.9	K350 S354 M355 Q356 A404	K350-D352 PolarHBondContact O-N 2.92Å; D352-S354 VanDerWaalsContact C-N 3.34Å; D352-S354 PolarHBondContact O-N 3.31Å; D352-M355 PolarHBondContact O-N 3.11Å; D352-Q356 WeakPolarHBondContact O-CG 3.25Å; D352-Q356 PolarHBondContact O-N 2.74Å; D352-A404 WeakPolarHBondContact OD1-CB 3.45Å
353	D	91.3	Very high	90	Very high	80 Å²	80	41.5 Å²	41.5	43%	0.428	21%	0.209	S	C	.	.	H	α-helix	trans	-61.2	-43.7	177.9	-60.4	-28	0	0	0	111	L345 K350 Q356 V357	L345-D353 HydrophobicContact CD1-CB 4.08Å; K350-D353 HydrophobicContact CB-CB 4.4Å; D353-Q356 PolarHBondContact O-N 2.91Å; D353-V357 WeakPolarHBondContact O-CG2 3.47Å; D353-V357 PolarHBondContact O-N 3.21Å
354	S	93.4	Very high	89.7	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-58.5	-49.5	176.8	177.7	0	0	0	0	112	A342 F346 K350 F351 D352 Q356 V357 F358	A342-S354 WeakPolarHBondContact O-CB 3.38Å; A342-S354 PolarHBondContact O-OG 2.62Å; F346-S354 WeakPolarHBondContact CB-OG 3.29Å; K350-S354 WeakPolarHBondContact O-CB 3.42Å; K350-S354 PolarHBondContact O-N 3.2Å; F351-S354 WeakPolarHBondContact O-CB 3.35Å; F351-S354 PolarHBondContact O-N 2.79Å; D352-S354 VanDerWaalsContact C-N 3.34Å; D352-S354 PolarHBondContact O-N 3.31Å; S354-Q356 VanDerWaalsContact C-N 3.33Å; S354-Q356 PolarHBondContact O-N 2.78Å; S354-V357 PolarHBondContact O-N 3.37Å; S354-V357 VanDerWaalsContact O-N 3.17Å; S354-F358 VanDerWaalsContact O-CD2 3.29Å; S354-F358 WeakPolarHBondContact O-CD2 3.41Å; S354-F358 PolarHBondContact O-N 3.12Å; S354-F358 VanDerWaalsContact OG-CE2 3.24Å; S354-F358 WeakPolarHBondContact OG-CE2 3.43Å
355	M	93.3	Very high	89.7	Confident	8 Å²	8	41 Å²	41	4%	0.039	21%	0.207	C	C	.	.	H	α-helix	trans	-64.4	-36.3	-179.1	-69.4	-57.9	137.8	0	0	112.4	F346 F351 D352 F358 A359 V368 Y372 A404 L405 Y408	F346-M355 HydrophobicContact CD2-CE 3.76Å; F346-M355 HydrophobicContact CE2-CE 3.91Å; F351-M355 WeakPolarHBondContact O-CB 3.45Å; F351-M355 VanDerWaalsContact O-CG 3.22Å; F351-M355 WeakPolarHBondContact O-CG 3.44Å; F351-M355 PolarHBondContact O-N 3.45Å; D352-M355 PolarHBondContact O-N 3.11Å; M355-F358 HydrophobicContact CE-CD2 4.4Å; M355-F358 PolarHBondContact O-N 2.86Å; M355-F358 HydrophobicContact SD-CD2 4.45Å; M355-A359 WeakPolarHBondContact O-CB 3.45Å; M355-A359 PolarHBondContact O-N 2.85Å; M355-V368 HydrophobicContact CE-CG1 3.8Å; M355-V368 HydrophobicContact SD-CG1 3.48Å; M355-V368 WeakPolarHBondContact SD-CG1 3.36Å; M355-Y372 HydrophobicContact CE-CE2 4Å; M355-Y372 VanDerWaalsContact CE-OH 3.29Å; M355-Y372 WeakPolarHBondContact CE-OH 3.44Å; M355-A404 HydrophobicContact CG-CB 3.99Å; M355-L405 HydrophobicContact SD-CD1 4.41Å; M355-Y408 HydrophobicContact SD-CG 4.19Å
356	Q	91.6	Very high	89.5	Confident	108 Å²	108	40.9 Å²	40.9	51%	0.505	21%	0.206	S	C	.	.	H	α-helix	trans	-63.4	-40.3	174.1	-72	177.8	22.8	0	0	112.2	D352 D353 S354 A359 K360	D352-Q356 WeakPolarHBondContact O-CG 3.25Å; D352-Q356 PolarHBondContact O-N 2.74Å; D353-Q356 PolarHBondContact O-N 2.91Å; S354-Q356 VanDerWaalsContact C-N 3.33Å; S354-Q356 PolarHBondContact O-N 2.78Å; Q356-A359 PolarHBondContact O-N 3.3Å; Q356-K360 WeakPolarHBondContact O-CG 3.44Å; Q356-K360 PolarHBondContact O-N 3.1Å; Q356-K360 VanDerWaalsContact O-N 3.12Å
357	V	90.1	Very high	89.4	Confident	27 Å²	27	40.9 Å²	40.9	16%	0.164	21%	0.206	C	C	.	.	H	α-helix	trans	-67.2	-46.4	176.4	-177.3	0	0	0	0	110.3	Y341 A342 L345 D353 S354 A359 K360 L361	Y341-V357 HydrophobicContact CD1-CG2 4.39Å; Y341-V357 HydrophobicContact CE1-CG2 4.36Å; A342-V357 HydrophobicContact CB-CB 3.85Å; A342-V357 HydrophobicContact CB-CG1 3.7Å; L345-V357 HydrophobicContact CD1-CG2 4.22Å; D353-V357 WeakPolarHBondContact O-CG2 3.47Å; D353-V357 PolarHBondContact O-N 3.21Å; S354-V357 PolarHBondContact O-N 3.37Å; S354-V357 VanDerWaalsContact O-N 3.17Å; V357-A359 VanDerWaalsContact C-N 3.28Å; V357-A359 PolarHBondContact O-N 3.45Å; V357-K360 PolarHBondContact O-N 3.5Å; V357-L361 HydrophobicContact CG1-CD1 3.9Å; V357-L361 HydrophobicContact CG1-CG 4.29Å; V357-L361 WeakPolarHBondContact O-CG 3.26Å; V357-L361 PolarHBondContact O-N 3.38Å
358	F	91.1	Very high	89.4	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-59	-37.8	175.1	-72.7	-51.7	0	0	0	112.8	A342 F343 S354 M355 L361 G362 T363 V368 L371 Y408 L431	A342-F358 HydrophobicContact CB-CD1 3.64Å; A342-F358 HydrophobicContact CB-CD2 4.14Å; A342-F358 HydrophobicContact CB-CE1 3.42Å; A342-F358 VanDerWaalsContact CB-CE1 3.42Å; A342-F358 HydrophobicContact CB-CE2 3.94Å; A342-F358 HydrophobicContact CB-CG 4Å; A342-F358 HydrophobicContact CB-CZ 3.58Å; F343-F358 HydrophobicContact CB-CZ 4.42Å; S354-F358 VanDerWaalsContact O-CD2 3.29Å; S354-F358 WeakPolarHBondContact O-CD2 3.41Å; S354-F358 PolarHBondContact O-N 3.12Å; S354-F358 VanDerWaalsContact OG-CE2 3.24Å; S354-F358 WeakPolarHBondContact OG-CE2 3.43Å; M355-F358 HydrophobicContact CE-CD2 4.4Å; M355-F358 PolarHBondContact O-N 2.86Å; M355-F358 HydrophobicContact SD-CD2 4.45Å; F358-L361 PolarHBondContact O-N 2.98Å; F358-G362 PolarHBondContact O-N 2.88Å; F358-T363 HydrophobicContact CD1-CG2 4.01Å; F358-T363 WeakPolarHBondContact CD1-OG1 3.35Å; F358-T363 HydrophobicContact CE1-CG2 4.42Å; F358-T363 PolarHBondContact O-N 3.48Å; F358-V368 HydrophobicContact CB-CG2 4.08Å; F358-V368 HydrophobicContact CD1-CG2 4.35Å; F358-V368 HydrophobicContact CD2-CG1 4.4Å; F358-V368 HydrophobicContact CD2-CG2 4.23Å; F358-V368 HydrophobicContact CG-CG2 3.99Å; F358-L371 HydrophobicContact CE2-CD1 3.87Å; F358-L371 HydrophobicContact CZ-CD1 4.17Å; F358-Y408 HydrophobicContact CB-CE2 4.1Å; F358-L431 HydrophobicContact CE1-CD1 3.66Å; F358-L431 HydrophobicContact CE1-CG 4.47Å; F358-L431 HydrophobicContact CZ-CD1 3.86Å
359	A	88.3	Confident	89.5	Confident	26 Å²	26	34.4 Å²	34.4	22%	0.215	17%	0.172	C	C	.	.	H	α-helix	trans	-60.9	-48.4	175.7	0	0	0	0	0	111.7	M355 Q356 V357 L361 G362 Y408 K412	M355-A359 WeakPolarHBondContact O-CB 3.45Å; M355-A359 PolarHBondContact O-N 2.85Å; Q356-A359 PolarHBondContact O-N 3.3Å; V357-A359 VanDerWaalsContact C-N 3.28Å; V357-A359 PolarHBondContact O-N 3.45Å; A359-L361 VanDerWaalsContact C-N 3.34Å; A359-L361 PolarHBondContact O-N 3.36Å; A359-G362 PolarHBondContact O-N 3.3Å; A359-Y408 HydrophobicContact CB-CD2 3.98Å; A359-Y408 HydrophobicContact CB-CE2 4.07Å; A359-K412 PolarHBondContact O-NZ 2.93Å
360	K	88.2	Confident	89.4	Confident	175 Å²	175	30.1 Å²	30.1	76%	0.761	15%	0.153	S	C	*	.	H	α-helix	trans	-62.7	-37.6	178.2	-72.1	174.2	-175.4	176.7	0	112.6	Q356 V357 G362	Q356-K360 WeakPolarHBondContact O-CG 3.44Å; Q356-K360 PolarHBondContact O-N 3.1Å; Q356-K360 VanDerWaalsContact O-N 3.12Å; V357-K360 PolarHBondContact O-N 3.5Å; K360-G362 VanDerWaalsContact C-N 3.27Å; K360-G362 PolarHBondContact O-N 3.43Å
361	L	85.4	Confident	89.2	Confident	21 Å²	21	25.6 Å²	25.6	11%	0.11	13%	0.134	C	C	.	.	H	α-helix	trans	-74.1	-15.3	179.6	-71	176.4	0	0	0	114	Q338 N339 V357 F358 A359 T363	Q338-L361 HydrophobicContact CB-CD1 3.82Å; Q338-L361 HydrophobicContact CB-CD2 3.74Å; Q338-L361 HydrophobicContact CB-CG 4.29Å; Q338-L361 HydrophobicContact CG-CD2 4.48Å; Q338-L361 VanDerWaalsContact OE1-CD2 3.22Å; N339-L361 VanDerWaalsContact OD1-CD1 3.26Å; N339-L361 WeakPolarHBondContact OD1-CD1 3.35Å; V357-L361 HydrophobicContact CG1-CD1 3.9Å; V357-L361 HydrophobicContact CG1-CG 4.29Å; V357-L361 WeakPolarHBondContact O-CG 3.26Å; V357-L361 PolarHBondContact O-N 3.38Å; F358-L361 PolarHBondContact O-N 2.98Å; A359-L361 VanDerWaalsContact C-N 3.34Å; A359-L361 PolarHBondContact O-N 3.36Å; L361-T363 PolarHBondContact O-N 3Å
362	G	83.8	Confident	89.1	Confident	19 Å²	19	25.4 Å²	25.4	20%	0.196	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.2	22.8	-174.2	0	0	0	0	0	113.1	F358 A359 K360 S429	F358-G362 PolarHBondContact O-N 2.88Å; A359-G362 PolarHBondContact O-N 3.3Å; K360-G362 VanDerWaalsContact C-N 3.27Å; K360-G362 PolarHBondContact O-N 3.43Å; G362-S429 PolarHBondContact O-N 2.74Å; G362-S429 VanDerWaalsContact O-N 3.09Å
363	T	85.8	Confident	88.8	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.127	C	C	.	.	B	Isolated β-bridge	trans	-57.1	140.8	179.7	-48.9	0	0	0	0	110.5	N339 F358 L361 H367 V368 Y408 S429 L431	N339-T363 PolarHBondContact OD1-OG1 3.17Å; F358-T363 HydrophobicContact CD1-CG2 4.01Å; F358-T363 WeakPolarHBondContact CD1-OG1 3.35Å; F358-T363 HydrophobicContact CE1-CG2 4.42Å; F358-T363 PolarHBondContact O-N 3.48Å; L361-T363 PolarHBondContact O-N 3Å; T363-H367 HydrophobicContact CG2-CB 4.32Å; T363-V368 HydrophobicContact CG2-CG2 4.13Å; T363-Y408 PolarHBondContact O-OH 3.22Å; T363-S429 CarbonylContact C-O 3.52Å; T363-S429 WeakPolarHBondContact CA-O 3.29Å; T363-L431 HydrophobicContact CG2-CB 4.18Å
364	D	85.1	Confident	88.4	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.142	C	C	.	.			trans	-60.6	129.2	-179	-168.6	-66.6	0	0	0	111	T366 H367 V368 T428 S429 T437	D364-T366 PolarHBondContact O-N 3.42Å; D364-T366 VanDerWaalsContact O-N 3.13Å; D364-T366 WeakPolarHBondContact OD1-CB 3.18Å; D364-T366 WeakPolarHBondContact OD1-CG2 3.34Å; D364-T366 PolarHBondContact OD1-N 2.88Å; D364-T366 PolarHBondContact OD1-OG1 2.86Å; D364-H367 WeakPolarHBondContact O-CB 3.16Å; D364-H367 PolarHBondContact O-N 2.85Å; D364-H367 VanDerWaalsContact O-N 3.08Å; D364-V368 PolarHBondContact O-N 3.39Å; D364-T428 HydrophobicContact CB-CG2 4.48Å; D364-T428 WeakPolarHBondContact OD2-CB 3.46Å; D364-T428 PolarHBondContact OD2-OG1 2.94Å; D364-S429 PolarHBondContact N-O 3.17Å; D364-T437 HydrophobicContact CB-CG2 4.14Å
365	P	87.8	Confident	88.1	Confident	2 Å²	2	27.1 Å²	27.1	1%	0.013	14%	0.144	C	C	.	.	H	α-helix	trans	-53.8	-31.8	179.3	-27.1	33.9	0	0	0	114.1	H367 V368 I369 Y408 L409 L444 I448	P365-H367 VanDerWaalsContact C-N 3.3Å; P365-H367 PolarHBondContact O-N 3.02Å; P365-V368 PolarHBondContact O-N 3.26Å; P365-I369 HydrophobicContact CB-CD1 4.4Å; P365-I369 WeakPolarHBondContact O-CB 3.22Å; P365-I369 WeakPolarHBondContact O-CD1 3.49Å; P365-I369 WeakPolarHBondContact O-CG1 3.24Å; P365-I369 PolarHBondContact O-N 3.47Å; P365-Y408 HydrophobicContact CB-CE1 4.44Å; P365-L409 HydrophobicContact CB-CD2 4.41Å; P365-L444 HydrophobicContact CB-CD1 4.04Å; P365-L444 HydrophobicContact CG-CD1 3.96Å; P365-L444 HydrophobicContact CG-CD2 4.15Å; P365-L444 HydrophobicContact CG-CG 4.27Å; P365-I448 HydrophobicContact CB-CD1 4.3Å; P365-I448 HydrophobicContact CB-CG1 4.2Å; P365-I448 HydrophobicContact CG-CD1 4.14Å
366	T	88.2	Confident	87.7	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-67.2	-33	-179.9	69.1	0	0	0	0	112.6	D364 G370 L376 Y380 I438 L444 I447	D364-T366 PolarHBondContact O-N 3.42Å; D364-T366 VanDerWaalsContact O-N 3.13Å; D364-T366 WeakPolarHBondContact OD1-CB 3.18Å; D364-T366 WeakPolarHBondContact OD1-CG2 3.34Å; D364-T366 PolarHBondContact OD1-N 2.88Å; D364-T366 PolarHBondContact OD1-OG1 2.86Å; T366-G370 PolarHBondContact O-N 3.47Å; T366-L376 WeakPolarHBondContact O-CD1 3.48Å; T366-Y380 HydrophobicContact CG2-CE1 4.45Å; T366-I438 HydrophobicContact CG2-CD1 3.65Å; T366-I438 HydrophobicContact CG2-CG1 4.12Å; T366-L444 HydrophobicContact CG2-CD1 4.16Å; T366-I447 HydrophobicContact CG2-CD1 4.18Å
367	H	87.9	Confident	87.3	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-68.7	-41	176.2	-72.2	-105.4	0	0	0	110.9	T363 D364 P365 G370 Y386 L431 T435 P436	T363-H367 HydrophobicContact CG2-CB 4.32Å; D364-H367 WeakPolarHBondContact O-CB 3.16Å; D364-H367 PolarHBondContact O-N 2.85Å; D364-H367 VanDerWaalsContact O-N 3.08Å; P365-H367 VanDerWaalsContact C-N 3.3Å; P365-H367 PolarHBondContact O-N 3.02Å; H367-G370 PolarHBondContact O-N 3.09Å; H367-Y386 PolarHBondContact O-OH 3.38Å; H367-L431 HydrophobicContact CB-CB 3.89Å; H367-L431 PolarHBondContact ND1-N 2.82Å; H367-T435 PolarHBondContact CE1-OG1 3.04Å; H367-P436 PolarHBondContact NE2-O 3.47Å; H367-P436 VanDerWaalsContact NE2-O 3.11Å
368	V	90.5	Very high	86.9	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-69.6	-43.9	177.5	-177.3	0	0	0	0	110.9	M355 F358 T363 D364 P365 G370 L371 Y372 L405 Y408	M355-V368 HydrophobicContact CE-CG1 3.8Å; M355-V368 HydrophobicContact SD-CG1 3.48Å; M355-V368 WeakPolarHBondContact SD-CG1 3.36Å; F358-V368 HydrophobicContact CB-CG2 4.08Å; F358-V368 HydrophobicContact CD1-CG2 4.35Å; F358-V368 HydrophobicContact CD2-CG1 4.4Å; F358-V368 HydrophobicContact CD2-CG2 4.23Å; F358-V368 HydrophobicContact CG-CG2 3.99Å; T363-V368 HydrophobicContact CG2-CG2 4.13Å; D364-V368 PolarHBondContact O-N 3.39Å; P365-V368 PolarHBondContact O-N 3.26Å; V368-G370 VanDerWaalsContact C-N 3.28Å; V368-G370 PolarHBondContact O-N 2.86Å; V368-L371 VanDerWaalsContact O-CB 3.31Å; V368-L371 WeakPolarHBondContact O-CB 3.35Å; V368-L371 WeakPolarHBondContact O-CG 3.44Å; V368-L371 PolarHBondContact O-N 3.28Å; V368-Y372 WeakPolarHBondContact O-CD2 3.43Å; V368-L405 HydrophobicContact CG1-CD1 4.04Å; V368-Y408 HydrophobicContact CB-CE1 3.94Å; V368-Y408 HydrophobicContact CG1-CD1 4.06Å; V368-Y408 HydrophobicContact CG1-CE1 3.93Å; V368-Y408 HydrophobicContact CG2-CE1 4.03Å
369	I	90.9	Very high	86.5	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-64.6	-35.5	177.5	-61.8	161.8	0	0	0	110.6	P365 L371 Y372 L375 L376 L405 L409 I447 T451	P365-I369 HydrophobicContact CB-CD1 4.4Å; P365-I369 WeakPolarHBondContact O-CB 3.22Å; P365-I369 WeakPolarHBondContact O-CD1 3.49Å; P365-I369 WeakPolarHBondContact O-CG1 3.24Å; P365-I369 PolarHBondContact O-N 3.47Å; I369-L371 PolarHBondContact O-N 3.22Å; I369-L371 VanDerWaalsContact O-N 3.16Å; I369-Y372 WeakPolarHBondContact O-CB 3.47Å; I369-Y372 PolarHBondContact O-N 3.41Å; I369-L375 HydrophobicContact CG2-CB 3.59Å; I369-L375 HydrophobicContact CG2-CD1 4.17Å; I369-L376 HydrophobicContact CB-CD1 4.3Å; I369-L376 HydrophobicContact CB-CD2 4.46Å; I369-L376 HydrophobicContact CB-CG 4.31Å; I369-L376 HydrophobicContact CG2-CD1 4.23Å; I369-L376 HydrophobicContact CG2-CD2 3.92Å; I369-L376 HydrophobicContact CG2-CG 3.72Å; I369-L405 HydrophobicContact CG1-CD1 4.48Å; I369-L409 HydrophobicContact CD1-CD2 3.96Å; I369-L409 HydrophobicContact CG1-CD1 4.47Å; I369-L409 HydrophobicContact CG1-CD2 4.02Å; I369-I447 HydrophobicContact CD1-CG2 3.87Å; I369-T451 HydrophobicContact CD1-CG2 4.24Å; I369-T451 HydrophobicContact CG1-CG2 4.14Å; I369-T451 HydrophobicContact CG2-CG2 3.77Å
370	G	88.1	Confident	86.2	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-14.7	179.4	0	0	0	0	0	115.1	T366 H367 V368 Y372 R381 Y386	T366-G370 PolarHBondContact O-N 3.47Å; H367-G370 PolarHBondContact O-N 3.09Å; V368-G370 VanDerWaalsContact C-N 3.28Å; V368-G370 PolarHBondContact O-N 2.86Å; G370-Y372 PolarHBondContact O-N 3.35Å; G370-R381 PolarHBondContact O-NE 2.87Å; G370-R381 PolarHBondContact O-NH2 3.28Å; G370-Y386 WeakPolarHBondContact CA-OH 3.44Å; G370-Y386 PolarHBondContact O-OH 3.25Å
371	L	88.4	Confident	86	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.005	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-22.6	169.7	-58.5	176	0	0	0	112.3	F343 F346 F358 V368 I369 Y386 L390	F343-L371 HydrophobicContact CD2-CD2 3.8Å; F343-L371 HydrophobicContact CE2-CD2 3.65Å; F346-L371 HydrophobicContact CD1-CB 4.34Å; F346-L371 HydrophobicContact CD1-CD1 4.31Å; F346-L371 HydrophobicContact CD2-CD1 3.9Å; F346-L371 HydrophobicContact CE1-CB 3.79Å; F346-L371 HydrophobicContact CE2-CB 4.05Å; F346-L371 HydrophobicContact CE2-CD1 4.12Å; F346-L371 HydrophobicContact CG-CD1 3.99Å; F346-L371 HydrophobicContact CZ-CB 3.62Å; F346-L371 HydrophobicContact CZ-CD1 4.43Å; F358-L371 HydrophobicContact CE2-CD1 3.87Å; F358-L371 HydrophobicContact CZ-CD1 4.17Å; V368-L371 VanDerWaalsContact O-CB 3.31Å; V368-L371 WeakPolarHBondContact O-CB 3.35Å; V368-L371 WeakPolarHBondContact O-CG 3.44Å; V368-L371 PolarHBondContact O-N 3.28Å; I369-L371 PolarHBondContact O-N 3.22Å; I369-L371 VanDerWaalsContact O-N 3.16Å; L371-Y386 HydrophobicContact CD2-CD1 3.66Å; L371-Y386 HydrophobicContact CD2-CE1 3.42Å; L371-Y386 VanDerWaalsContact CD2-CE1 3.42Å; L371-Y386 HydrophobicContact CG-CE1 4.26Å; L371-L390 HydrophobicContact CD2-CD2 3.58Å
372	Y	89.7	Confident	85.9	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.198	C	C	.	.	S	Bend	trans	-98.3	142.6	-173.5	-66.7	-103.8	0	0	0	112.5	F346 M355 V368 I369 G370 L375 R381 A401 L405	F346-Y372 HydrophobicContact CE2-CD2 4.47Å; F346-Y372 HydrophobicContact CE2-CE1 4.4Å; F346-Y372 AromaticContact CE2-CE2 3.7Å; F346-Y372 HydrophobicContact CE2-CE2 3.7Å; F346-Y372 AromaticContact CE2-CZ 3.66Å; F346-Y372 HydrophobicContact CZ-CD2 4.42Å; F346-Y372 HydrophobicContact CZ-CE2 4.08Å; M355-Y372 HydrophobicContact CE-CE2 4Å; M355-Y372 VanDerWaalsContact CE-OH 3.29Å; M355-Y372 WeakPolarHBondContact CE-OH 3.44Å; V368-Y372 WeakPolarHBondContact O-CD2 3.43Å; I369-Y372 WeakPolarHBondContact O-CB 3.47Å; I369-Y372 PolarHBondContact O-N 3.41Å; G370-Y372 PolarHBondContact O-N 3.35Å; Y372-L375 VanDerWaalsContact CB-CD1 3.42Å; Y372-L375 HydrophobicContact CD1-CD1 4.22Å; Y372-L375 HydrophobicContact CG-CD1 3.83Å; Y372-R381 PolarHBondContact O-NH1 2.95Å; Y372-R381 PolarHBondContact O-NH2 3.08Å; Y372-R381 VanDerWaalsContact O-NH2 3.11Å; Y372-A401 HydrophobicContact CD1-CB 4.35Å; Y372-A401 VanDerWaalsContact CE1-C 3.47Å; Y372-A401 HydrophobicContact CE1-CB 3.51Å; Y372-A401 VanDerWaalsContact CE1-O 3.28Å; Y372-A401 WeakPolarHBondContact CE1-O 3.39Å; Y372-A401 PolarHBondContact OH-O 2.91Å; Y372-L405 HydrophobicContact CD1-CD2 4.16Å; Y372-L405 HydrophobicContact CD2-CD1 4.48Å; Y372-L405 HydrophobicContact CD2-CD2 3.84Å; Y372-L405 HydrophobicContact CE1-CB 4.12Å; Y372-L405 HydrophobicContact CE1-CD2 4.09Å; Y372-L405 HydrophobicContact CE2-CB 4.21Å; Y372-L405 HydrophobicContact CE2-CD1 3.9Å; Y372-L405 HydrophobicContact CE2-CD2 3.82Å; Y372-L405 HydrophobicContact CE2-CG 4.19Å; Y372-L405 HydrophobicContact CG-CD2 4.03Å
373	P	85.6	Confident	85.9	Confident	37 Å²	37	40.5 Å²	40.5	24%	0.24	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	141.1	172.1	27.8	-32.9	0	0	0	112.1	L375 L398	P373-L375 PolarHBondContact O-N 3.4Å; P373-L398 HydrophobicContact CG-CD1 3.8Å
374	D	83.1	Confident	85.8	Confident	138 Å²	138	41 Å²	41	74%	0.738	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.8	12.4	166.5	-50.1	-33.1	0	0	0	118.3
375	L	86.4	Confident	85.7	Confident	8 Å²	8	46.6 Å²	46.6	4%	0.042	24%	0.239	C	C	.	.	S	Bend	trans	-87.1	-32.9	177.3	-63.7	-172.3	0	0	0	113.7	I369 Y372 P373 L405 T451 K454	I369-L375 HydrophobicContact CG2-CB 3.59Å; I369-L375 HydrophobicContact CG2-CD1 4.17Å; Y372-L375 VanDerWaalsContact CB-CD1 3.42Å; Y372-L375 HydrophobicContact CD1-CD1 4.22Å; Y372-L375 HydrophobicContact CG-CD1 3.83Å; P373-L375 PolarHBondContact O-N 3.4Å; L375-L405 HydrophobicContact CD1-CD2 3.5Å; L375-T451 HydrophobicContact CB-CG2 4.26Å; L375-T451 HydrophobicContact CD1-CG2 3.83Å; L375-T451 HydrophobicContact CD2-CG2 4.48Å; L375-T451 HydrophobicContact CG-CG2 4.42Å; L375-K454 HydrophobicContact CD2-CB 3.97Å; L375-K454 HydrophobicContact CD2-CD 4.21Å; L375-K454 PolarHBondContact O-NZ 2.93Å
376	L	85.2	Confident	85.5	Confident	15 Å²	15	48.4 Å²	48.4	8%	0.079	25%	0.246	C	C	.	.	S	Bend	trans	-108.4	154.7	176.4	-67.2	176.2	0	0	0	111.8	T366 I369 S378 Y380 R381 L384 I447	T366-L376 WeakPolarHBondContact O-CD1 3.48Å; I369-L376 HydrophobicContact CB-CD1 4.3Å; I369-L376 HydrophobicContact CB-CD2 4.46Å; I369-L376 HydrophobicContact CB-CG 4.31Å; I369-L376 HydrophobicContact CG2-CD1 4.23Å; I369-L376 HydrophobicContact CG2-CD2 3.92Å; I369-L376 HydrophobicContact CG2-CG 3.72Å; L376-S378 PolarHBondContact O-N 2.85Å; L376-Y380 HydrophobicContact CD1-CD1 4.19Å; L376-Y380 HydrophobicContact CD1-CE1 4.42Å; L376-R381 HydrophobicContact CB-CB 4.47Å; L376-L384 HydrophobicContact CD1-CD1 4.04Å; L376-I447 HydrophobicContact CD2-CG2 4.01Å
377	P	83.4	Confident	85.2	Confident	91 Å²	91	50.3 Å²	50.3	59%	0.591	26%	0.258	S	S	*	.			trans	-53.6	137.2	170.4	-24.5	34.2	0	0	0	111.7	D379 Y380 R381	P377-D379 PolarHBondContact O-N 3.13Å; P377-Y380 PolarHBondContact O-N 3.11Å; P377-R381 PolarHBondContact O-N 3.1Å
378	S	81.2	Confident	84.8	Confident	74 Å²	74	54 Å²	54	52%	0.517	28%	0.278	S	S	.	.	H	α-helix	trans	-56	-38.4	-174.9	50.9	0	0	0	0	113.1	L376 R381 K382	L376-S378 PolarHBondContact O-N 2.85Å; S378-R381 PolarHBondContact O-N 3.45Å; S378-K382 VanDerWaalsContact O-CG 3.31Å; S378-K382 WeakPolarHBondContact O-CG 3.44Å; S378-K382 PolarHBondContact O-N 3.35Å; S378-K382 VanDerWaalsContact O-N 3.13Å
379	D	82.8	Confident	84.4	Confident	110 Å²	110	59.7 Å²	59.7	59%	0.588	32%	0.315	S	S	*	.	H	α-helix	trans	-72.3	-35	-175.7	-58.5	-25	0	0	0	112	P377 Q383	P377-D379 PolarHBondContact O-N 3.13Å; D379-Q383 WeakPolarHBondContact O-CG 3.22Å; D379-Q383 PolarHBondContact O-NE2 3.38Å; D379-Q383 VanDerWaalsContact O-NE2 3.14Å
380	Y	83.2	Confident	84.1	Confident	48 Å²	48	62.2 Å²	62.2	19%	0.188	33%	0.328	C	S	.	.	H	α-helix	trans	-75.4	-40.6	174.8	-173.1	-100.5	0	0	0	111.1	T366 L376 P377 K382 Q383 L384	T366-Y380 HydrophobicContact CG2-CE1 4.45Å; L376-Y380 HydrophobicContact CD1-CD1 4.19Å; L376-Y380 HydrophobicContact CD1-CE1 4.42Å; P377-Y380 PolarHBondContact O-N 3.11Å; Y380-K382 VanDerWaalsContact C-N 3.27Å; Y380-K382 PolarHBondContact O-N 3.31Å; Y380-Q383 WeakPolarHBondContact O-CB 3.37Å; Y380-Q383 PolarHBondContact O-N 3.49Å; Y380-L384 HydrophobicContact CE1-CD1 4.34Å; Y380-L384 HydrophobicContact CE1-CD2 4.32Å
381	R	83.3	Confident	83.9	Confident	63 Å²	63	63.9 Å²	63.9	24%	0.238	34%	0.339	C	S	.	.	H	α-helix	trans	-60.9	-35.6	178.8	-170.3	176.5	-174.4	-159.9	0.7	112.6	G370 Y372 L376 P377 S378 Q383 L384	G370-R381 PolarHBondContact O-NE 2.87Å; G370-R381 PolarHBondContact O-NH2 3.28Å; Y372-R381 PolarHBondContact O-NH1 2.95Å; Y372-R381 PolarHBondContact O-NH2 3.08Å; Y372-R381 VanDerWaalsContact O-NH2 3.11Å; L376-R381 HydrophobicContact CB-CB 4.47Å; P377-R381 PolarHBondContact O-N 3.1Å; S378-R381 PolarHBondContact O-N 3.45Å; R381-Q383 PolarHBondContact O-N 3.11Å; R381-L384 WeakPolarHBondContact O-CB 3.5Å; R381-L384 PolarHBondContact O-N 3.5Å
382	K	83.8	Confident	83.6	Confident	164 Å²	164	67.3 Å²	67.3	71%	0.713	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-20.4	175.6	-74	172.2	-175.1	174.5	0	113.9	S378 Y380 L384	S378-K382 VanDerWaalsContact O-CG 3.31Å; S378-K382 WeakPolarHBondContact O-CG 3.44Å; S378-K382 PolarHBondContact O-N 3.35Å; S378-K382 VanDerWaalsContact O-N 3.13Å; Y380-K382 VanDerWaalsContact C-N 3.27Å; Y380-K382 PolarHBondContact O-N 3.31Å; K382-L384 VanDerWaalsContact C-N 3.32Å
383	Q	84.6	Confident	83.4	Confident	99 Å²	99	68.1 Å²	68.1	46%	0.463	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-14.5	177.1	-61	167.9	29.1	0	0	112.2	D379 Y380 R381 H385	D379-Q383 WeakPolarHBondContact O-CG 3.22Å; D379-Q383 PolarHBondContact O-NE2 3.38Å; D379-Q383 VanDerWaalsContact O-NE2 3.14Å; Y380-Q383 WeakPolarHBondContact O-CB 3.37Å; Y380-Q383 PolarHBondContact O-N 3.49Å; R381-Q383 PolarHBondContact O-N 3.11Å; Q383-H385 PolarHBondContact O-CE1 3.49Å; Q383-H385 PolarHBondContact O-ND1 3.04Å; Q383-H385 VanDerWaalsContact O-ND1 3.1Å
384	L	83.4	Confident	83.2	Confident	12 Å²	12	70.5 Å²	70.5	6%	0.063	40%	0.396	C	S	.	.			trans	-84.1	128.6	178.7	-58.8	175.6	0	0	0	110	L376 Y380 R381 K382 Y386	L376-L384 HydrophobicContact CD1-CD1 4.04Å; Y380-L384 HydrophobicContact CE1-CD1 4.34Å; Y380-L384 HydrophobicContact CE1-CD2 4.32Å; R381-L384 WeakPolarHBondContact O-CB 3.5Å; R381-L384 PolarHBondContact O-N 3.5Å; K382-L384 VanDerWaalsContact C-N 3.32Å; L384-Y386 HydrophobicContact CB-CE2 3.88Å; L384-Y386 WeakPolarHBondContact CD1-OH 3.09Å
385	H	81.6	Confident	83.3	Confident	117 Å²	117	66.7 Å²	66.7	54%	0.542	39%	0.389	S	S	.	.			trans	-105.1	136.3	179.2	-63.9	76.6	0	0	0	109.7	Q383 M432 T435	Q383-H385 PolarHBondContact O-CE1 3.49Å; Q383-H385 PolarHBondContact O-ND1 3.04Å; Q383-H385 VanDerWaalsContact O-ND1 3.1Å; H385-M432 HydrophobicContact CB-SD 4.14Å; H385-T435 HydrophobicContact CB-CG2 4.01Å
386	Y	84.6	Confident	83.3	Confident	40 Å²	40	69.9 Å²	69.9	16%	0.157	42%	0.417	C	S	.	.			trans	-125.1	150.2	-179.5	-61.2	-75.6	0	0	0	111.3	F343 H367 G370 L371 L384 N388 L390 L431	F343-Y386 HydrophobicContact CD2-CD1 4.28Å; F343-Y386 AromaticContact CE2-CD1 3.83Å; F343-Y386 HydrophobicContact CE2-CD1 3.83Å; F343-Y386 HydrophobicContact CE2-CG 4.09Å; H367-Y386 PolarHBondContact O-OH 3.38Å; G370-Y386 WeakPolarHBondContact CA-OH 3.44Å; G370-Y386 PolarHBondContact O-OH 3.25Å; L371-Y386 HydrophobicContact CD2-CD1 3.66Å; L371-Y386 HydrophobicContact CD2-CE1 3.42Å; L371-Y386 VanDerWaalsContact CD2-CE1 3.42Å; L371-Y386 HydrophobicContact CG-CE1 4.26Å; L384-Y386 HydrophobicContact CB-CE2 3.88Å; L384-Y386 WeakPolarHBondContact CD1-OH 3.09Å; Y386-N388 VanDerWaalsContact C-N 3.32Å; Y386-N388 PolarHBondContact O-N 3.44Å; Y386-L390 HydrophobicContact CD1-CD2 4.38Å; Y386-L390 HydrophobicContact CD2-CD1 4.1Å; Y386-L390 HydrophobicContact CD2-CD2 4.15Å; Y386-L390 HydrophobicContact CD2-CG 4.21Å; Y386-L390 HydrophobicContact CE2-CD1 4.03Å; Y386-L390 HydrophobicContact CG-CD2 4.07Å; Y386-L431 HydrophobicContact CD1-CD2 4.19Å; Y386-L431 HydrophobicContact CE1-CD1 4.49Å
387	P	80.7	Confident	83.3	Confident	40 Å²	40	72.7 Å²	72.7	26%	0.26	43%	0.43	S	S	.	.	S	Bend	trans	-61.5	-33.8	-177	-24.8	33.6	0	0	0	114.8	L340 F343 L431 M432	L340-P387 HydrophobicContact CD2-CB 3.74Å; L340-P387 HydrophobicContact CD2-CG 3.49Å; L340-P387 VanDerWaalsContact CD2-CG 3.49Å; F343-P387 HydrophobicContact CD1-CB 4.31Å; F343-P387 HydrophobicContact CD1-CG 4.21Å; F343-P387 HydrophobicContact CE1-CB 4.39Å; F343-P387 HydrophobicContact CG-CG 4.33Å; P387-L431 HydrophobicContact CG-CD2 4.27Å; P387-M432 HydrophobicContact CG-CG 4.5Å; P387-M432 HydrophobicContact CG-SD 4.33Å
388	N	80.4	Confident	83.6	Confident	78 Å²	78	70 Å²	70	42%	0.417	41%	0.411	S	S	.	.	S	Bend	trans	-138.4	165.6	176.1	-62.4	-66.2	0	0	0	110.3	F343 Y386 L390	F343-N388 HydrophobicContact CE1-CB 3.94Å; F343-N388 HydrophobicContact CZ-CB 4.5Å; F343-N388 WeakPolarHBondContact CZ-O 3.47Å; Y386-N388 VanDerWaalsContact C-N 3.32Å; Y386-N388 PolarHBondContact O-N 3.44Å; N388-L390 PolarHBondContact O-N 3.04Å
389	P	82.6	Confident	84	Confident	119 Å²	119	71 Å²	71	77%	0.773	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-55.1	137.4	173.3	-24.3	33.9	0	0	0	111.9
390	L	84.5	Confident	84.3	Confident	52 Å²	52	71 Å²	71	27%	0.272	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-68.8	141.9	178.9	-63.9	176.6	0	0	0	110.8	F343 L371 Y386 N388	F343-L390 HydrophobicContact CE2-CD2 3.73Å; F343-L390 HydrophobicContact CZ-CD2 4.05Å; L371-L390 HydrophobicContact CD2-CD2 3.58Å; Y386-L390 HydrophobicContact CD1-CD2 4.38Å; Y386-L390 HydrophobicContact CD2-CD1 4.1Å; Y386-L390 HydrophobicContact CD2-CD2 4.15Å; Y386-L390 HydrophobicContact CD2-CG 4.21Å; Y386-L390 HydrophobicContact CE2-CD1 4.03Å; Y386-L390 HydrophobicContact CG-CD2 4.07Å; N388-L390 PolarHBondContact O-N 3.04Å
391	P	84.3	Confident	84.6	Confident	35 Å²	35	68.7 Å²	68.7	23%	0.227	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-66.1	142.9	174.5	29.4	-34.8	0	0	0	110.7	F346 L393	F346-P391 HydrophobicContact CD1-CG 4.14Å; F346-P391 HydrophobicContact CE1-CG 3.93Å; P391-L393 HydrophobicContact CG-CD2 4.36Å; P391-L393 PolarHBondContact O-N 3.33Å
392	G	81.3	Confident	85.1	Confident	73 Å²	73	65.9 Å²	65.9	75%	0.753	38%	0.382	S	S	*	.			trans	-71.8	115.6	168.7	0	0	0	0	0	110
393	L	84.9	Confident	85.5	Confident	17 Å²	17	62 Å²	62	9%	0.089	37%	0.369	C	S	.	.			trans	-104.6	126.2	-179.7	-61.5	176.1	0	0	0	110.1	F346 F351 P391 L398 A401	F346-L393 HydrophobicContact CE1-CD1 4.26Å; F346-L393 HydrophobicContact CZ-CD1 3.87Å; F351-L393 HydrophobicContact CE1-CD2 4.22Å; F351-L393 HydrophobicContact CZ-CD2 3.77Å; P391-L393 HydrophobicContact CG-CD2 4.36Å; P391-L393 PolarHBondContact O-N 3.33Å; L393-L398 HydrophobicContact CB-CB 4.3Å; L393-L398 HydrophobicContact CB-CD1 3.91Å; L393-L398 HydrophobicContact CD1-CD1 4.41Å; L393-A401 HydrophobicContact CD1-CB 4.25Å
394	S	82.9	Confident	85.8	Confident	87 Å²	87	57.4 Å²	57.4	61%	0.608	35%	0.348	S	S	*	.			trans	-146.5	157.4	176.1	66.4	0	0	0	0	112.5	A396 E397	S394-A396 PolarHBondContact O-N 3.31Å; S394-E397 PolarHBondContact O-N 3.3Å
395	G	85.2	Confident	86.3	Confident	58 Å²	58	56.9 Å²	56.9	60%	0.598	35%	0.345	S	S	*	.	H	α-helix	trans	57.1	-132.8	176.1	0	0	0	0	0	113.9	E397 L398 E399	G395-E397 VanDerWaalsContact C-N 3.25Å; G395-E397 PolarHBondContact O-N 3.38Å; G395-L398 WeakPolarHBondContact O-CB 3.46Å; G395-L398 PolarHBondContact O-N 2.73Å; G395-L398 VanDerWaalsContact O-N 3.17Å; G395-E399 PolarHBondContact O-N 2.79Å
396	A	84.9	Confident	86.9	Confident	76 Å²	76	51.9 Å²	51.9	63%	0.628	32%	0.322	S	S	*	.	H	α-helix	trans	-62.6	-28.2	-176.8	0	0	0	0	0	113.8	S394 L398 E399 K400	S394-A396 PolarHBondContact O-N 3.31Å; A396-L398 VanDerWaalsContact C-N 3.34Å; A396-E399 PolarHBondContact O-N 2.87Å; A396-K400 PolarHBondContact O-N 3.47Å
397	E	86.8	Confident	87.2	Confident	73 Å²	73	54.6 Å²	54.6	34%	0.341	34%	0.339	S	S	.	.	H	α-helix	trans	-68.1	-40.1	177.4	-58	-171.6	161.7	0	0	111.1	K349 S394 G395 K400 A401	K349-E397 WeakPolarHBondContact CE-OE2 3.3Å; K349-E397 IonicContact NZ-OE1 2.68Å; K349-E397 PolarHBondContact NZ-OE1 3.02Å; K349-E397 IonicContact NZ-OE2 3.37Å; K349-E397 PolarHBondContact NZ-OE2 2.9Å; S394-E397 PolarHBondContact O-N 3.3Å; G395-E397 VanDerWaalsContact C-N 3.25Å; G395-E397 PolarHBondContact O-N 3.38Å; E397-K400 PolarHBondContact O-N 3.4Å; E397-A401 WeakPolarHBondContact O-CB 3.29Å; E397-A401 PolarHBondContact O-N 2.85Å
398	L	89.1	Confident	87.7	Confident	36 Å²	36	52.9 Å²	52.9	19%	0.188	33%	0.328	C	S	.	.	H	α-helix	trans	-66.5	-39.9	176.6	-178.3	62.6	0	0	0	110.7	P373 L393 G395 A396 A401 H402	P373-L398 HydrophobicContact CG-CD1 3.8Å; L393-L398 HydrophobicContact CB-CB 4.3Å; L393-L398 HydrophobicContact CB-CD1 3.91Å; L393-L398 HydrophobicContact CD1-CD1 4.41Å; G395-L398 WeakPolarHBondContact O-CB 3.46Å; G395-L398 PolarHBondContact O-N 2.73Å; G395-L398 VanDerWaalsContact O-N 3.17Å; A396-L398 VanDerWaalsContact C-N 3.34Å; L398-A401 PolarHBondContact O-N 3.31Å; L398-H402 WeakPolarHBondContact CD1-CE1 3.39Å; L398-H402 WeakPolarHBondContact CG-CE1 3.29Å; L398-H402 PolarHBondContact O-N 2.67Å; L398-H402 PolarHBondContact O-ND1 3.01Å
399	E	89.1	Confident	88.3	Confident	94 Å²	94	49.1 Å²	49.1	44%	0.439	31%	0.308	S	S	.	.	H	α-helix	trans	-60.8	-48.1	174.9	-167.9	-176.1	168.9	0	0	111.8	G395 A396 A401 H402 L403 T459	G395-E399 PolarHBondContact O-N 2.79Å; A396-E399 PolarHBondContact O-N 2.87Å; E399-A401 VanDerWaalsContact C-N 3.31Å; E399-A401 PolarHBondContact O-N 3.25Å; E399-H402 PolarHBondContact O-N 3.31Å; E399-H402 VanDerWaalsContact O-N 3.15Å; E399-L403 PolarHBondContact O-N 3.36Å; E399-T459 HydrophobicContact CG-CG2 4.03Å
400	K	89.4	Confident	88.7	Confident	110 Å²	110	46.4 Å²	46.4	48%	0.478	29%	0.289	S	S	.	.	H	α-helix	trans	-60.4	-41.3	176	-169.2	-177.7	-179.5	-173.2	0	112	F351 A396 E397 H402 L403 A404	F351-K400 HydrophobicContact CD2-CB 4.48Å; F351-K400 HydrophobicContact CD2-CD 4.43Å; F351-K400 HydrophobicContact CD2-CG 4.28Å; A396-K400 PolarHBondContact O-N 3.47Å; E397-K400 PolarHBondContact O-N 3.4Å; K400-H402 VanDerWaalsContact C-N 3.33Å; K400-H402 PolarHBondContact O-N 3.07Å; K400-L403 PolarHBondContact O-N 3.25Å; K400-A404 PolarHBondContact O-N 2.91Å
401	A	90.4	Very high	88.9	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-63	-40.4	176.7	0	0	0	0	0	111.7	F351 Y372 L393 E397 L398 E399 A404 L405	F351-A401 HydrophobicContact CD1-CB 3.86Å; F351-A401 HydrophobicContact CD2-CB 3.84Å; F351-A401 HydrophobicContact CE1-CB 3.76Å; F351-A401 HydrophobicContact CE2-CB 3.73Å; F351-A401 HydrophobicContact CG-CB 3.91Å; F351-A401 HydrophobicContact CZ-CB 3.7Å; Y372-A401 HydrophobicContact CD1-CB 4.35Å; Y372-A401 VanDerWaalsContact CE1-C 3.47Å; Y372-A401 HydrophobicContact CE1-CB 3.51Å; Y372-A401 VanDerWaalsContact CE1-O 3.28Å; Y372-A401 WeakPolarHBondContact CE1-O 3.39Å; Y372-A401 PolarHBondContact OH-O 2.91Å; L393-A401 HydrophobicContact CD1-CB 4.25Å; E397-A401 WeakPolarHBondContact O-CB 3.29Å; E397-A401 PolarHBondContact O-N 2.85Å; L398-A401 PolarHBondContact O-N 3.31Å; E399-A401 VanDerWaalsContact C-N 3.31Å; E399-A401 PolarHBondContact O-N 3.25Å; A401-A404 PolarHBondContact O-N 2.85Å; A401-L405 PolarHBondContact O-N 3.49Å
402	H	92.1	Very high	89.1	Confident	3 Å²	3	50 Å²	50	1%	0.014	30%	0.3	C	S	.	.	H	α-helix	trans	-65.6	-38.3	176.9	-75.3	109.8	0	0	0	112.3	L398 E399 K400 L405 I406 H458 T459	L398-H402 WeakPolarHBondContact CD1-CE1 3.39Å; L398-H402 WeakPolarHBondContact CG-CE1 3.29Å; L398-H402 PolarHBondContact O-N 2.67Å; L398-H402 PolarHBondContact O-ND1 3.01Å; E399-H402 PolarHBondContact O-N 3.31Å; E399-H402 VanDerWaalsContact O-N 3.15Å; K400-H402 VanDerWaalsContact C-N 3.33Å; K400-H402 PolarHBondContact O-N 3.07Å; H402-L405 WeakPolarHBondContact O-CB 3.36Å; H402-L405 PolarHBondContact O-N 3.49Å; H402-I406 VanDerWaalsContact O-CG1 3.26Å; H402-I406 WeakPolarHBondContact O-CG1 3.39Å; H402-I406 PolarHBondContact O-N 3.27Å; H402-H458 AromaticContact CE1-ND1 3.61Å; H402-H458 AromaticContact NE2-ND1 3.75Å; H402-T459 HydrophobicContact CB-CG2 3.56Å
403	L	92	Very high	89.5	Confident	84 Å²	84	48.6 Å²	48.6	44%	0.44	27%	0.273	S	S	.	.	H	α-helix	trans	-60.4	-47.1	175.6	-69.4	173.7	0	0	0	111.6	E399 K400 L405 I406 D407 T459	E399-L403 PolarHBondContact O-N 3.36Å; K400-L403 PolarHBondContact O-N 3.25Å; L403-L405 VanDerWaalsContact C-N 3.29Å; L403-L405 PolarHBondContact O-N 2.74Å; L403-I406 HydrophobicContact CD2-CD1 4.47Å; L403-I406 WeakPolarHBondContact O-CB 3.28Å; L403-I406 PolarHBondContact O-N 3.35Å; L403-D407 PolarHBondContact O-N 3.46Å; L403-T459 HydrophobicContact CD2-CG2 3.97Å; L403-T459 HydrophobicContact CG-CG2 4.08Å
404	A	92.2	Very high	89.6	Confident	2 Å²	2	50.6 Å²	50.6	2%	0.017	29%	0.288	C	S	.	.	H	α-helix	trans	-61.8	-37.6	175.3	0	0	0	0	0	112.3	F351 D352 M355 K400 A401 D407 Y408	F351-A404 HydrophobicContact CB-CB 3.55Å; D352-A404 WeakPolarHBondContact OD1-CB 3.45Å; M355-A404 HydrophobicContact CG-CB 3.99Å; K400-A404 PolarHBondContact O-N 2.91Å; A401-A404 PolarHBondContact O-N 2.85Å; A404-D407 PolarHBondContact O-N 3.17Å; A404-Y408 PolarHBondContact O-N 3.07Å
405	L	93.6	Very high	89.7	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-66.1	-40.3	176	-174.8	60.3	0	0	0	112	M355 V368 I369 Y372 L375 A401 H402 L403 D407 Y408 L409 T451	M355-L405 HydrophobicContact SD-CD1 4.41Å; V368-L405 HydrophobicContact CG1-CD1 4.04Å; I369-L405 HydrophobicContact CG1-CD1 4.48Å; Y372-L405 HydrophobicContact CD1-CD2 4.16Å; Y372-L405 HydrophobicContact CD2-CD1 4.48Å; Y372-L405 HydrophobicContact CD2-CD2 3.84Å; Y372-L405 HydrophobicContact CE1-CB 4.12Å; Y372-L405 HydrophobicContact CE1-CD2 4.09Å; Y372-L405 HydrophobicContact CE2-CB 4.21Å; Y372-L405 HydrophobicContact CE2-CD1 3.9Å; Y372-L405 HydrophobicContact CE2-CD2 3.82Å; Y372-L405 HydrophobicContact CE2-CG 4.19Å; Y372-L405 HydrophobicContact CG-CD2 4.03Å; L375-L405 HydrophobicContact CD1-CD2 3.5Å; A401-L405 PolarHBondContact O-N 3.49Å; H402-L405 WeakPolarHBondContact O-CB 3.36Å; H402-L405 PolarHBondContact O-N 3.49Å; L403-L405 VanDerWaalsContact C-N 3.29Å; L403-L405 PolarHBondContact O-N 2.74Å; L405-D407 VanDerWaalsContact C-N 3.31Å; L405-D407 PolarHBondContact O-N 3.45Å; L405-Y408 HydrophobicContact CD1-CD1 4.26Å; L405-Y408 PolarHBondContact O-N 3.36Å; L405-L409 HydrophobicContact CD1-CD1 4.06Å; L405-L409 HydrophobicContact CD1-CD2 4.34Å; L405-L409 HydrophobicContact CD1-CG 3.89Å; L405-L409 HydrophobicContact CD2-CD1 4.18Å; L405-L409 HydrophobicContact CG-CD1 3.72Å; L405-L409 HydrophobicContact CG-CG 3.99Å; L405-L409 WeakPolarHBondContact O-CB 3.31Å; L405-L409 VanDerWaalsContact O-CG 3.26Å; L405-L409 WeakPolarHBondContact O-CG 3.44Å; L405-L409 PolarHBondContact O-N 2.92Å; L405-T451 HydrophobicContact CD2-CG2 4.26Å
406	I	93.2	Very high	89.6	Confident	13 Å²	13	49.6 Å²	49.6	7%	0.067	26%	0.258	C	S	.	.	H	α-helix	trans	-57.7	-46	177.5	-76.1	161.9	0	0	0	110.3	H402 L403 L409 T410 L452 C455 Y456 T459	H402-I406 VanDerWaalsContact O-CG1 3.26Å; H402-I406 WeakPolarHBondContact O-CG1 3.39Å; H402-I406 PolarHBondContact O-N 3.27Å; L403-I406 HydrophobicContact CD2-CD1 4.47Å; L403-I406 WeakPolarHBondContact O-CB 3.28Å; L403-I406 PolarHBondContact O-N 3.35Å; I406-L409 PolarHBondContact O-N 3.46Å; I406-T410 VanDerWaalsContact O-CB 3.26Å; I406-T410 WeakPolarHBondContact O-CB 3.2Å; I406-T410 PolarHBondContact O-N 3.03Å; I406-T410 PolarHBondContact O-OG1 3.41Å; I406-L452 HydrophobicContact CB-CD2 4.47Å; I406-L452 HydrophobicContact CG1-CD2 4.29Å; I406-L452 HydrophobicContact CG2-CD2 4.41Å; I406-C455 HydrophobicContact CD1-CB 3.8Å; I406-C455 HydrophobicContact CG1-CB 3.61Å; I406-Y456 HydrophobicContact CB-CE1 4.46Å; I406-Y456 HydrophobicContact CD1-CD1 3.72Å; I406-Y456 HydrophobicContact CD1-CE1 3.83Å; I406-Y456 HydrophobicContact CG1-CD1 4.24Å; I406-Y456 HydrophobicContact CG1-CE1 3.99Å; I406-Y456 HydrophobicContact CG2-CE1 3.6Å; I406-T459 HydrophobicContact CD1-CG2 4.29Å; I406-T459 WeakPolarHBondContact CD1-OG1 3.39Å
407	D	90.7	Very high	89.5	Confident	97 Å²	97	47.7 Å²	47.7	52%	0.519	24%	0.242	S	C	.	.	H	α-helix	trans	-62.4	-46.2	179.5	-74.9	-13.9	0	0	0	111.4	L403 A404 L405 T410 Q411	L403-D407 PolarHBondContact O-N 3.46Å; A404-D407 PolarHBondContact O-N 3.17Å; L405-D407 VanDerWaalsContact C-N 3.31Å; L405-D407 PolarHBondContact O-N 3.45Å; D407-T410 PolarHBondContact O-N 3.13Å; D407-Q411 VanDerWaalsContact O-CG 3.29Å; D407-Q411 WeakPolarHBondContact O-CG 3.34Å; D407-Q411 PolarHBondContact O-N 3.49Å; D407-Q411 VanDerWaalsContact O-N 3.11Å
408	Y	92.7	Very high	89.3	Confident	3 Å²	3	52.4 Å²	52.4	1%	0.012	26%	0.262	C	S	.	.	H	α-helix	trans	-58.3	-51.4	175.1	173.5	-99.1	0	0	0	112.5	M355 F358 A359 T363 P365 V368 A404 L405 T410 Q411 K412	M355-Y408 HydrophobicContact SD-CG 4.19Å; F358-Y408 HydrophobicContact CB-CE2 4.1Å; A359-Y408 HydrophobicContact CB-CD2 3.98Å; A359-Y408 HydrophobicContact CB-CE2 4.07Å; T363-Y408 PolarHBondContact O-OH 3.22Å; P365-Y408 HydrophobicContact CB-CE1 4.44Å; V368-Y408 HydrophobicContact CB-CE1 3.94Å; V368-Y408 HydrophobicContact CG1-CD1 4.06Å; V368-Y408 HydrophobicContact CG1-CE1 3.93Å; V368-Y408 HydrophobicContact CG2-CE1 4.03Å; A404-Y408 PolarHBondContact O-N 3.07Å; L405-Y408 HydrophobicContact CD1-CD1 4.26Å; L405-Y408 PolarHBondContact O-N 3.36Å; Y408-T410 PolarHBondContact O-N 3.02Å; Y408-Q411 PolarHBondContact O-N 2.86Å; Y408-K412 HydrophobicContact CD1-CG 4.49Å; Y408-K412 HydrophobicContact CD2-CG 4.48Å; Y408-K412 HydrophobicContact CE1-CG 4.03Å; Y408-K412 HydrophobicContact CE2-CD 4.48Å; Y408-K412 HydrophobicContact CE2-CG 4Å; Y408-K412 WeakPolarHBondContact O-CG 3.34Å; Y408-K412 PolarHBondContact O-N 3.27Å; Y408-K412 WeakPolarHBondContact OH-CE 3.48Å
409	L	92.4	Very high	88.6	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-66.2	-37.7	-177.2	-71.6	-177.8	0	0	0	111.7	P365 I369 L405 I406 K412 R413 I448 T451 L452	P365-L409 HydrophobicContact CB-CD2 4.41Å; I369-L409 HydrophobicContact CD1-CD2 3.96Å; I369-L409 HydrophobicContact CG1-CD1 4.47Å; I369-L409 HydrophobicContact CG1-CD2 4.02Å; L405-L409 HydrophobicContact CD1-CD1 4.06Å; L405-L409 HydrophobicContact CD1-CD2 4.34Å; L405-L409 HydrophobicContact CD1-CG 3.89Å; L405-L409 HydrophobicContact CD2-CD1 4.18Å; L405-L409 HydrophobicContact CG-CD1 3.72Å; L405-L409 HydrophobicContact CG-CG 3.99Å; L405-L409 WeakPolarHBondContact O-CB 3.31Å; L405-L409 VanDerWaalsContact O-CG 3.26Å; L405-L409 WeakPolarHBondContact O-CG 3.44Å; L405-L409 PolarHBondContact O-N 2.92Å; I406-L409 PolarHBondContact O-N 3.46Å; L409-K412 PolarHBondContact O-N 3.16Å; L409-R413 WeakPolarHBondContact O-CB 3.45Å; L409-R413 PolarHBondContact O-N 3.46Å; L409-I448 HydrophobicContact CB-CG2 4.12Å; L409-I448 HydrophobicContact CD2-CG1 4.18Å; L409-I448 HydrophobicContact CD2-CG2 4.28Å; L409-T451 HydrophobicContact CD1-CG2 3.72Å; L409-L452 HydrophobicContact CB-CD1 4.41Å; L409-L452 HydrophobicContact CB-CD2 3.7Å; L409-L452 HydrophobicContact CB-CG 3.99Å; L409-L452 HydrophobicContact CD1-CD2 4.14Å; L409-L452 HydrophobicContact CD1-CG 4.18Å
410	T	90.7	Very high	87.7	Confident	61 Å²	61	52.2 Å²	52.2	37%	0.374	26%	0.261	S	S	.	.	H	α-helix	trans	-64.7	-42.9	177.1	-57.1	0	0	0	0	111.1	I406 D407 Y408 R413 S414	I406-T410 VanDerWaalsContact O-CB 3.26Å; I406-T410 WeakPolarHBondContact O-CB 3.2Å; I406-T410 PolarHBondContact O-N 3.03Å; I406-T410 PolarHBondContact O-OG1 3.41Å; D407-T410 PolarHBondContact O-N 3.13Å; Y408-T410 PolarHBondContact O-N 3.02Å; T410-R413 PolarHBondContact O-N 3.31Å; T410-S414 PolarHBondContact O-N 2.94Å
411	Q	89.8	Confident	86.6	Confident	123 Å²	123	54.6 Å²	54.6	58%	0.575	28%	0.28	S	S	*	.	H	α-helix	trans	-62.6	-47	174.7	-70.3	174.3	24.6	0	0	111.6	D407 Y408 S414 H415	D407-Q411 VanDerWaalsContact O-CG 3.29Å; D407-Q411 WeakPolarHBondContact O-CG 3.34Å; D407-Q411 PolarHBondContact O-N 3.49Å; D407-Q411 VanDerWaalsContact O-N 3.11Å; Y408-Q411 PolarHBondContact O-N 2.86Å; Q411-S414 PolarHBondContact O-N 3.29Å; Q411-H415 PolarHBondContact O-N 3.03Å; Q411-H415 VanDerWaalsContact O-N 3.1Å
412	K	87.8	Confident	85.6	Confident	39 Å²	39	59.5 Å²	59.5	17%	0.17	31%	0.306	C	S	.	.	H	α-helix	trans	-64.8	-41.1	178.3	-71.9	-68.8	178.8	-176.5	0	112.5	A359 Y408 L409 S414 H415 L416	A359-K412 PolarHBondContact O-NZ 2.93Å; Y408-K412 HydrophobicContact CD1-CG 4.49Å; Y408-K412 HydrophobicContact CD2-CG 4.48Å; Y408-K412 HydrophobicContact CE1-CG 4.03Å; Y408-K412 HydrophobicContact CE2-CD 4.48Å; Y408-K412 HydrophobicContact CE2-CG 4Å; Y408-K412 WeakPolarHBondContact O-CG 3.34Å; Y408-K412 PolarHBondContact O-N 3.27Å; Y408-K412 WeakPolarHBondContact OH-CE 3.48Å; L409-K412 PolarHBondContact O-N 3.16Å; K412-S414 PolarHBondContact O-N 3.27Å; K412-H415 PolarHBondContact O-N 3.3Å; K412-L416 WeakPolarHBondContact O-CB 3.4Å; K412-L416 WeakPolarHBondContact O-CG 3.5Å; K412-L416 PolarHBondContact O-N 3.19Å
413	R	89.6	Confident	83.9	Confident	45 Å²	45	66.6 Å²	66.6	17%	0.17	35%	0.35	C	S	.	.	H	α-helix	trans	-58.3	-47.6	174.8	-175	-175.6	178.5	-84.5	-8.4	111.3	L409 T410 H415 L416 A417 L445 I448 D449 L470 N472	L409-R413 WeakPolarHBondContact O-CB 3.45Å; L409-R413 PolarHBondContact O-N 3.46Å; T410-R413 PolarHBondContact O-N 3.31Å; R413-H415 VanDerWaalsContact C-N 3.34Å; R413-H415 PolarHBondContact O-N 3.17Å; R413-L416 PolarHBondContact O-N 3.32Å; R413-A417 VanDerWaalsContact O-CB 3.22Å; R413-A417 WeakPolarHBondContact O-CB 3.45Å; R413-A417 PolarHBondContact O-N 3.13Å; R413-L445 HydrophobicContact CG-CD2 4.09Å; R413-I448 HydrophobicContact CB-CG2 4Å; R413-I448 HydrophobicContact CG-CG2 4.47Å; R413-D449 WeakPolarHBondContact CD-OD1 3.38Å; R413-D449 IonicContact CZ-OD1 2.74Å; R413-D449 IonicContact NE-OD1 2.64Å; R413-D449 PolarHBondContact NE-OD1 3.46Å; R413-D449 IonicContact NE-OD2 3.08Å; R413-L470 VanDerWaalsContact NH2-CD1 3.33Å; R413-N472 PolarHBondContact NH2-O 2.66Å
414	S	87	Confident	82.3	Confident	58 Å²	58	64.2 Å²	64.2	41%	0.406	35%	0.345	S	S	.	.	H	α-helix	trans	-60.5	-42.5	178	-177.2	0	0	0	0	112	T410 Q411 K412 K418	T410-S414 PolarHBondContact O-N 2.94Å; Q411-S414 PolarHBondContact O-N 3.29Å; K412-S414 PolarHBondContact O-N 3.27Å; S414-K418 WeakPolarHBondContact O-CG 3.48Å; S414-K418 PolarHBondContact O-N 2.95Å
415	H	85.3	Confident	80.6	Confident	110 Å²	110	68.4 Å²	68.4	51%	0.509	37%	0.372	S	S	.	.	H	α-helix	trans	-63.6	-48.4	176.5	-164.4	121.1	0	0	0	111.9	Q411 K412 R413 K418 Q419	Q411-H415 PolarHBondContact O-N 3.03Å; Q411-H415 VanDerWaalsContact O-N 3.1Å; K412-H415 PolarHBondContact O-N 3.3Å; R413-H415 VanDerWaalsContact C-N 3.34Å; R413-H415 PolarHBondContact O-N 3.17Å; H415-K418 PolarHBondContact O-N 3.14Å; H415-Q419 PolarHBondContact CD2-NE2 3.37Å; H415-Q419 PolarHBondContact CD2-OE1 3.36Å; H415-Q419 PolarHBondContact NE2-NE2 3.47Å; H415-Q419 PolarHBondContact O-N 3.25Å
416	L	83.4	Confident	79.1	Confident	14 Å²	14	69.1 Å²	69.1	7%	0.073	38%	0.377	C	S	.	.	H	α-helix	trans	-66.2	-37.7	179.8	-72.1	170.2	0	0	0	112.4	K412 R413 K418 Q419 L420 R441 L444 L445 I448	K412-L416 WeakPolarHBondContact O-CB 3.4Å; K412-L416 WeakPolarHBondContact O-CG 3.5Å; K412-L416 PolarHBondContact O-N 3.19Å; R413-L416 PolarHBondContact O-N 3.32Å; L416-K418 VanDerWaalsContact C-N 3.34Å; L416-K418 PolarHBondContact O-N 2.7Å; L416-Q419 CarbonylContact O-C 3.58Å; L416-Q419 PolarHBondContact O-N 3.43Å; L416-Q419 VanDerWaalsContact O-N 3.17Å; L416-L420 PolarHBondContact O-N 3.23Å; L416-R441 HydrophobicContact CD2-CG 4.45Å; L416-L444 HydrophobicContact CD1-CD2 3.64Å; L416-L444 HydrophobicContact CD1-CG 3.95Å; L416-L444 HydrophobicContact CD2-CD2 4.29Å; L416-L445 HydrophobicContact CB-CD2 3.83Å; L416-L445 HydrophobicContact CB-CG 4.22Å; L416-L445 HydrophobicContact CD1-CD2 4.38Å; L416-I448 HydrophobicContact CD1-CD1 3.54Å
417	A	82.3	Confident	77.7	Confident	36 Å²	36	75.1 Å²	75.1	30%	0.298	41%	0.414	S	S	.	.	H	α-helix	trans	-64.8	-36.9	178.5	0	0	0	0	0	112.3	R413 Q419 L420	R413-A417 VanDerWaalsContact O-CB 3.22Å; R413-A417 WeakPolarHBondContact O-CB 3.45Å; R413-A417 PolarHBondContact O-N 3.13Å; A417-Q419 PolarHBondContact O-N 3.49Å; A417-L420 HydrophobicContact CB-CD1 4.27Å; A417-L420 WeakPolarHBondContact O-CD1 3.26Å; A417-L420 PolarHBondContact O-N 2.86Å
418	K	81.7	Confident	76.9	Confident	173 Å²	173	71.9 Å²	71.9	75%	0.752	40%	0.398	S	S	*	.	H	α-helix	trans	-64.8	-27.2	174.4	-73.4	177.1	-179.1	-175.5	0	113.1	S414 H415 L416	S414-K418 WeakPolarHBondContact O-CG 3.48Å; S414-K418 PolarHBondContact O-N 2.95Å; H415-K418 PolarHBondContact O-N 3.14Å; L416-K418 VanDerWaalsContact C-N 3.34Å; L416-K418 PolarHBondContact O-N 2.7Å
419	Q	75.8	Confident	76.1	Confident	66 Å²	66	73.5 Å²	73.5	31%	0.308	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	17.6	-176.1	-66.3	175	-8.3	0	0	112.7	H415 L416 A417 N421 D422 R441	H415-Q419 PolarHBondContact CD2-NE2 3.37Å; H415-Q419 PolarHBondContact CD2-OE1 3.36Å; H415-Q419 PolarHBondContact NE2-NE2 3.47Å; H415-Q419 PolarHBondContact O-N 3.25Å; L416-Q419 CarbonylContact O-C 3.58Å; L416-Q419 PolarHBondContact O-N 3.43Å; L416-Q419 VanDerWaalsContact O-N 3.17Å; A417-Q419 PolarHBondContact O-N 3.49Å; Q419-N421 PolarHBondContact O-N 3.06Å; Q419-D422 PolarHBondContact O-N 3.22Å; Q419-R441 PolarHBondContact O-NH1 3.21Å
420	L	69.4	Low	75.4	Confident	59 Å²	59	75.4 Å²	75.4	31%	0.309	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-28.9	-178	-94.5	161.7	0	0	0	113.6	L416 A417 L445	L416-L420 PolarHBondContact O-N 3.23Å; A417-L420 HydrophobicContact CB-CD1 4.27Å; A417-L420 WeakPolarHBondContact O-CD1 3.26Å; A417-L420 PolarHBondContact O-N 2.86Å; L420-L445 HydrophobicContact CD1-CD1 4.09Å; L420-L445 HydrophobicContact CD2-CD1 3.58Å; L420-L445 HydrophobicContact CG-CD1 3.95Å
421	N	67	Low	74.7	Confident	161 Å²	161	72.8 Å²	72.8	86%	0.861	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-7.3	-177.6	-64.1	-17.8	0	0	0	114	Q419	Q419-N421 PolarHBondContact O-N 3.06Å
422	D	68.4	Low	73.8	Confident	103 Å²	103	70.1 Å²	70.1	55%	0.551	40%	0.395	S	S	*	.			trans	-80.4	123.8	176.6	-101.1	-20.5	0	0	0	109.9	Q419 G424 R441	Q419-D422 PolarHBondContact O-N 3.22Å; D422-G424 PolarHBondContact O-N 3.24Å; D422-R441 PolarHBondContact O-NH1 3.48Å
423	T	57	Low	72.7	Confident	152 Å²	152	76.6 Å²	76.6	93%	0.933	43%	0.425	S	S	*	.			trans	-76.3	-3.3	-179.1	51	0	0	0	0	113.9
424	G	57.7	Low	71.3	Confident	33 Å²	33	78.6 Å²	78.6	34%	0.34	46%	0.46	S	S	.	.	S	Bend	trans	-69.9	147.1	177.2	0	0	0	0	0	113.1	D422 R441	D422-G424 PolarHBondContact O-N 3.24Å; G424-R441 PolarHBondContact O-NE 2.78Å; G424-R441 VanDerWaalsContact O-NE 3.15Å; G424-R441 PolarHBondContact O-NH2 2.81Å
425	P	58.2	Low	70.6	Confident	91 Å²	91	76.6 Å²	76.6	59%	0.591	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-59.1	153.6	172.1	24.3	-31.6	0	0	0	111.3	T427 R441	P425-T427 PolarHBondContact O-N 3.24Å; P425-R441 PolarHBondContact O-NH2 3.27Å
426	S	61	Low	70	Confident	15 Å²	15	74.1 Å²	74.1	11%	0.105	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-67.8	123.2	169.7	50	0	0	0	0	109.9	T428 I438 K439	S426-T428 VanDerWaalsContact C-N 3.27Å; S426-T428 PolarHBondContact O-N 3.36Å; S426-T428 VanDerWaalsContact O-N 3.09Å; S426-I438 PolarHBondContact OG-O 3.27Å; S426-K439 PolarHBondContact OG-O 2.98Å
427	T	64.9	Low	69.7	Low	138 Å²	138	75.7 Å²	75.7	85%	0.847	45%	0.449	S	S	*	.			trans	-83.8	71.5	173.9	55.1	0	0	0	0	109.3	P425	P425-T427 PolarHBondContact O-N 3.24Å
428	T	73.7	Confident	69.6	Low	29 Å²	29	75.4 Å²	75.4	18%	0.178	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-99.3	137.5	172.9	49.3	0	0	0	0	110.2	D364 S426 L444	D364-T428 HydrophobicContact CB-CG2 4.48Å; D364-T428 WeakPolarHBondContact OD2-CB 3.46Å; D364-T428 PolarHBondContact OD2-OG1 2.94Å; S426-T428 VanDerWaalsContact C-N 3.27Å; S426-T428 PolarHBondContact O-N 3.36Å; S426-T428 VanDerWaalsContact O-N 3.09Å; T428-L444 HydrophobicContact CG2-CD2 4.39Å
429	S	74.3	Confident	69.3	Low	38 Å²	38	74.5 Å²	74.5	27%	0.266	44%	0.439	S	S	.	.	B	Isolated β-bridge	trans	-91.6	134.2	178.1	-60.8	0	0	0	0	110.3	G362 T363 D364	G362-S429 PolarHBondContact O-N 2.74Å; G362-S429 VanDerWaalsContact O-N 3.09Å; T363-S429 CarbonylContact C-O 3.52Å; T363-S429 WeakPolarHBondContact CA-O 3.29Å; D364-S429 PolarHBondContact N-O 3.17Å
430	P	77.8	Confident	69.6	Low	40 Å²	40	73.9 Å²	73.9	26%	0.26	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-67.3	155.2	171.5	29.3	-33.7	0	0	0	110.9	N339 M432 T435 T437	N339-P430 PolarHBondContact ND2-O 2.86Å; P430-M432 WeakPolarHBondContact CB-O 3.37Å; P430-T435 WeakPolarHBondContact CB-OG1 3.43Å; P430-T437 HydrophobicContact CB-CG2 3.81Å; P430-T437 HydrophobicContact CG-CG2 4.47Å
431	L	76.7	Confident	70.2	Confident	6 Å²	6	72.8 Å²	72.8	3%	0.031	43%	0.433	C	S	.	.	S	Bend	trans	-73.4	-35.4	175.2	-171.6	148.9	0	0	0	111.6	N339 F358 T363 H367 Y386 P387	N339-L431 PolarHBondContact ND2-O 3.41Å; F358-L431 HydrophobicContact CE1-CD1 3.66Å; F358-L431 HydrophobicContact CE1-CG 4.47Å; F358-L431 HydrophobicContact CZ-CD1 3.86Å; T363-L431 HydrophobicContact CG2-CB 4.18Å; H367-L431 HydrophobicContact CB-CB 3.89Å; H367-L431 PolarHBondContact ND1-N 2.82Å; Y386-L431 HydrophobicContact CD1-CD2 4.19Å; Y386-L431 HydrophobicContact CE1-CD1 4.49Å; P387-L431 HydrophobicContact CG-CD2 4.27Å
432	M	71.3	Confident	70.9	Confident	67 Å²	67	72.1 Å²	72.1	33%	0.33	42%	0.423	S	S	.	.	S	Bend	trans	-126	137.6	171.1	-69.7	-164.1	72.8	0	0	110.6	H385 P387 P430 T435	H385-M432 HydrophobicContact CB-SD 4.14Å; P387-M432 HydrophobicContact CG-CG 4.5Å; P387-M432 HydrophobicContact CG-SD 4.33Å; P430-M432 WeakPolarHBondContact CB-O 3.37Å; M432-T435 HydrophobicContact CB-CG2 4.17Å; M432-T435 PolarHBondContact O-N 3.26Å; M432-T435 PolarHBondContact O-OG1 3.36Å
433	E	63.6	Low	71.7	Confident	174 Å²	174	73.4 Å²	73.4	81%	0.813	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	140.9	176.1	-70.2	-177.8	173.6	0	0	111.6
434	G	61.3	Low	73.1	Confident	88 Å²	88	66.1 Å²	66.1	91%	0.907	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.2	-3.2	-178.8	0	0	0	0	0	115.8
435	T	72.1	Confident	74.6	Confident	16 Å²	16	64.7 Å²	64.7	10%	0.098	36%	0.363	C	S	.	.			trans	-87.5	147.1	176	53.8	0	0	0	0	112.8	H367 H385 P430 M432	H367-T435 PolarHBondContact CE1-OG1 3.04Å; H385-T435 HydrophobicContact CB-CG2 4.01Å; P430-T435 WeakPolarHBondContact CB-OG1 3.43Å; M432-T435 HydrophobicContact CB-CG2 4.17Å; M432-T435 PolarHBondContact O-N 3.26Å; M432-T435 PolarHBondContact O-OG1 3.36Å
436	P	72.7	Confident	76.1	Confident	58 Å²	58	63.7 Å²	63.7	38%	0.377	35%	0.351	S	S	.	.			trans	-69.6	137.2	-177	27.6	-33.9	0	0	0	112	H367	H367-P436 PolarHBondContact NE2-O 3.47Å; H367-P436 VanDerWaalsContact NE2-O 3.11Å
437	T	78	Confident	77.4	Confident	46 Å²	46	64.9 Å²	64.9	28%	0.282	36%	0.356	S	S	.	.			trans	-118.3	153.8	171.2	58.1	0	0	0	0	110.8	D364 P430	D364-T437 HydrophobicContact CB-CG2 4.14Å; P430-T437 HydrophobicContact CB-CG2 3.81Å; P430-T437 HydrophobicContact CG-CG2 4.47Å
438	I	78.8	Confident	78.7	Confident	30 Å²	30	58.3 Å²	58.3	15%	0.154	32%	0.315	C	S	.	.			trans	-93.1	111.8	-179.9	-62.8	-176.8	0	0	0	109.2	T366 S426 K443 I447	T366-I438 HydrophobicContact CG2-CD1 3.65Å; T366-I438 HydrophobicContact CG2-CG1 4.12Å; S426-I438 PolarHBondContact OG-O 3.27Å; I438-K443 HydrophobicContact CG2-CB 3.98Å; I438-I447 HydrophobicContact CD1-CD1 3.21Å
439	K	75.9	Confident	79.5	Confident	155 Å²	155	57 Å²	57	67%	0.674	31%	0.307	S	S	*	.			trans	-78.8	-20.2	-179	-60.2	-175.8	179	-178.3	0	114.2	S426 R441	S426-K439 PolarHBondContact OG-O 2.98Å; K439-R441 PolarHBondContact O-N 3.37Å
440	S	82.1	Confident	80.4	Confident	52 Å²	52	55.8 Å²	55.8	36%	0.364	30%	0.298	S	S	.	.			trans	-85.3	113.8	-177.2	177.1	0	0	0	0	110.9	K442 K443 L444	S440-K442 VanDerWaalsContact C-N 3.31Å; S440-K442 PolarHBondContact O-N 2.86Å; S440-K443 PolarHBondContact O-N 3.4Å; S440-L444 PolarHBondContact O-N 2.93Å
441	R	81.2	Confident	81.1	Confident	36 Å²	36	54 Å²	54	14%	0.136	29%	0.287	C	S	.	.	H	α-helix	trans	-57.6	-40.9	178.1	-65.7	178.3	-175.5	-174.7	-1.3	112.8	L416 Q419 D422 G424 P425 K439 L444 L445	L416-R441 HydrophobicContact CD2-CG 4.45Å; Q419-R441 PolarHBondContact O-NH1 3.21Å; D422-R441 PolarHBondContact O-NH1 3.48Å; G424-R441 PolarHBondContact O-NE 2.78Å; G424-R441 VanDerWaalsContact O-NE 3.15Å; G424-R441 PolarHBondContact O-NH2 2.81Å; P425-R441 PolarHBondContact O-NH2 3.27Å; K439-R441 PolarHBondContact O-N 3.37Å; R441-L444 PolarHBondContact O-N 3.49Å; R441-L445 WeakPolarHBondContact O-CG 3.17Å; R441-L445 PolarHBondContact O-N 3.48Å
442	K	83.2	Confident	81.9	Confident	148 Å²	148	53.9 Å²	53.9	64%	0.643	29%	0.286	S	S	*	.	H	α-helix	trans	-64.6	-42.5	178.2	-171.3	174.7	-179.1	176.2	0	112.3	S440 L444 L445 Q446	S440-K442 VanDerWaalsContact C-N 3.31Å; S440-K442 PolarHBondContact O-N 2.86Å; K442-L444 VanDerWaalsContact C-N 3.33Å; K442-L445 PolarHBondContact O-N 2.97Å; K442-Q446 PolarHBondContact O-N 3.27Å
443	K	84.7	Confident	82.9	Confident	129 Å²	129	50.7 Å²	50.7	56%	0.561	27%	0.27	S	S	*	.	H	α-helix	trans	-65.8	-38.6	174.3	-68.3	-173	177.8	-175	0	111.3	I438 S440 Q446 I447	I438-K443 HydrophobicContact CG2-CB 3.98Å; S440-K443 PolarHBondContact O-N 3.4Å; K443-Q446 PolarHBondContact O-N 3.11Å; K443-I447 WeakPolarHBondContact O-CG1 3.24Å; K443-I447 PolarHBondContact O-N 3.39Å
444	L	85.8	Confident	84.3	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.9	-44	177.5	-168.4	60.6	0	0	0	111.7	P365 T366 L416 T428 S440 R441 K442 Q446 I447 I448	P365-L444 HydrophobicContact CB-CD1 4.04Å; P365-L444 HydrophobicContact CG-CD1 3.96Å; P365-L444 HydrophobicContact CG-CD2 4.15Å; P365-L444 HydrophobicContact CG-CG 4.27Å; T366-L444 HydrophobicContact CG2-CD1 4.16Å; L416-L444 HydrophobicContact CD1-CD2 3.64Å; L416-L444 HydrophobicContact CD1-CG 3.95Å; L416-L444 HydrophobicContact CD2-CD2 4.29Å; T428-L444 HydrophobicContact CG2-CD2 4.39Å; S440-L444 PolarHBondContact O-N 2.93Å; R441-L444 PolarHBondContact O-N 3.49Å; K442-L444 VanDerWaalsContact C-N 3.33Å; L444-Q446 VanDerWaalsContact C-N 3.33Å; L444-Q446 PolarHBondContact O-N 3.38Å; L444-I447 PolarHBondContact O-N 2.65Å; L444-I448 HydrophobicContact CG-CD1 4.05Å; L444-I448 WeakPolarHBondContact O-CB 3.26Å; L444-I448 WeakPolarHBondContact O-CG1 3.48Å; L444-I448 PolarHBondContact O-N 3.33Å
445	L	88.4	Confident	85.7	Confident	3 Å²	3	39.4 Å²	39.4	2%	0.016	19%	0.194	C	C	.	.	H	α-helix	trans	-60.9	-40.6	173.1	-76.8	168.9	0	0	0	112.3	R413 L416 L420 R441 K442 I447 I448 D449 H474	R413-L445 HydrophobicContact CG-CD2 4.09Å; L416-L445 HydrophobicContact CB-CD2 3.83Å; L416-L445 HydrophobicContact CB-CG 4.22Å; L416-L445 HydrophobicContact CD1-CD2 4.38Å; L420-L445 HydrophobicContact CD1-CD1 4.09Å; L420-L445 HydrophobicContact CD2-CD1 3.58Å; L420-L445 HydrophobicContact CG-CD1 3.95Å; R441-L445 WeakPolarHBondContact O-CG 3.17Å; R441-L445 PolarHBondContact O-N 3.48Å; K442-L445 PolarHBondContact O-N 2.97Å; L445-I447 PolarHBondContact O-N 3.49Å; L445-I448 PolarHBondContact O-N 3.21Å; L445-D449 WeakPolarHBondContact O-CB 3.28Å; L445-D449 PolarHBondContact O-N 3Å; L445-H474 HydrophobicContact CB-CB 4.2Å
446	Q	90	Very high	86.7	Confident	70 Å²	70	39.8 Å²	39.8	33%	0.327	19%	0.193	S	C	.	.	H	α-helix	trans	-61.5	-43.1	175.4	170.6	169.5	64.4	0	0	112.4	K442 K443 L444 T450 H474 H476	K442-Q446 PolarHBondContact O-N 3.27Å; K443-Q446 PolarHBondContact O-N 3.11Å; L444-Q446 VanDerWaalsContact C-N 3.33Å; L444-Q446 PolarHBondContact O-N 3.38Å; Q446-T450 VanDerWaalsContact O-CB 3.3Å; Q446-T450 WeakPolarHBondContact O-CB 3.49Å; Q446-T450 PolarHBondContact O-N 3.34Å; Q446-T450 PolarHBondContact O-OG1 3.37Å; Q446-H474 VanDerWaalsContact CA-O 3.28Å; Q446-H474 WeakPolarHBondContact CA-O 3.36Å; Q446-H474 HydrophobicContact CB-CB 4.23Å; Q446-H474 VanDerWaalsContact CB-O 3.29Å; Q446-H474 WeakPolarHBondContact CB-O 3.41Å; Q446-H474 VanDerWaalsContact CG-O 3.24Å; Q446-H474 WeakPolarHBondContact CG-O 3.36Å; Q446-H476 HydrophobicContact CG-CB 4.09Å
447	I	89.7	Confident	87.5	Confident	40 Å²	40	38 Å²	38	21%	0.205	18%	0.18	C	C	.	.	H	α-helix	trans	-64.5	-48.1	176	-67.4	164.7	0	0	0	109.9	T366 I369 L376 I438 K443 L444 L445 D449 T450 T451	T366-I447 HydrophobicContact CG2-CD1 4.18Å; I369-I447 HydrophobicContact CD1-CG2 3.87Å; L376-I447 HydrophobicContact CD2-CG2 4.01Å; I438-I447 HydrophobicContact CD1-CD1 3.21Å; K443-I447 WeakPolarHBondContact O-CG1 3.24Å; K443-I447 PolarHBondContact O-N 3.39Å; L444-I447 PolarHBondContact O-N 2.65Å; L445-I447 PolarHBondContact O-N 3.49Å; I447-D449 PolarHBondContact O-N 2.9Å; I447-T450 PolarHBondContact O-N 3.42Å; I447-T451 WeakPolarHBondContact O-CB 3.3Å; I447-T451 PolarHBondContact O-N 3.07Å; I447-T451 PolarHBondContact O-OG1 3.43Å
448	I	90.9	Very high	87.9	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-58.1	-50.9	179.4	-68.2	166.3	0	0	0	111.2	P365 L409 R413 L416 L444 L445 T450 T451 L452	P365-I448 HydrophobicContact CB-CD1 4.3Å; P365-I448 HydrophobicContact CB-CG1 4.2Å; P365-I448 HydrophobicContact CG-CD1 4.14Å; L409-I448 HydrophobicContact CB-CG2 4.12Å; L409-I448 HydrophobicContact CD2-CG1 4.18Å; L409-I448 HydrophobicContact CD2-CG2 4.28Å; R413-I448 HydrophobicContact CB-CG2 4Å; R413-I448 HydrophobicContact CG-CG2 4.47Å; L416-I448 HydrophobicContact CD1-CD1 3.54Å; L444-I448 HydrophobicContact CG-CD1 4.05Å; L444-I448 WeakPolarHBondContact O-CB 3.26Å; L444-I448 WeakPolarHBondContact O-CG1 3.48Å; L444-I448 PolarHBondContact O-N 3.33Å; L445-I448 PolarHBondContact O-N 3.21Å; I448-T450 PolarHBondContact O-N 2.97Å; I448-T451 PolarHBondContact O-N 3.46Å; I448-L452 HydrophobicContact CG2-CD1 3.9Å; I448-L452 HydrophobicContact CG2-CG 4.33Å; I448-L452 WeakPolarHBondContact O-CB 3.42Å; I448-L452 WeakPolarHBondContact O-CG 3.31Å; I448-L452 PolarHBondContact O-N 3.15Å
449	D	91.9	Very high	88.4	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-63.7	-41.8	-178.3	-77	-5	0	0	0	111.3	R413 L445 I447 T451 L452 L453 H474	R413-D449 WeakPolarHBondContact CD-OD1 3.38Å; R413-D449 IonicContact CZ-OD1 2.74Å; R413-D449 IonicContact NE-OD1 2.64Å; R413-D449 PolarHBondContact NE-OD1 3.46Å; R413-D449 IonicContact NE-OD2 3.08Å; L445-D449 WeakPolarHBondContact O-CB 3.28Å; L445-D449 PolarHBondContact O-N 3Å; I447-D449 PolarHBondContact O-N 2.9Å; D449-T451 PolarHBondContact O-N 3.42Å; D449-L452 PolarHBondContact O-N 3.46Å; D449-L453 PolarHBondContact O-N 3.19Å; D449-H474 WeakPolarHBondContact OD2-CB 3.39Å; D449-H474 PolarHBondContact OD2-N 3.41Å; D449-H474 IonicContact OD2-ND1 3.05Å
450	T	92.3	Very high	89	Confident	13 Å²	13	37.3 Å²	37.3	8%	0.08	18%	0.18	C	C	.	.	H	α-helix	trans	-66.2	-38.6	177.2	-50.8	0	0	0	0	111.5	Q446 I447 I448 K454 H476 E479	Q446-T450 VanDerWaalsContact O-CB 3.3Å; Q446-T450 WeakPolarHBondContact O-CB 3.49Å; Q446-T450 PolarHBondContact O-N 3.34Å; Q446-T450 PolarHBondContact O-OG1 3.37Å; I447-T450 PolarHBondContact O-N 3.42Å; I448-T450 PolarHBondContact O-N 2.97Å; T450-K454 PolarHBondContact O-N 3.15Å; T450-H476 HydrophobicContact CG2-CB 4.27Å; T450-H476 WeakPolarHBondContact OG1-CB 3.34Å; T450-H476 PolarHBondContact OG1-N 2.94Å; T450-E479 HydrophobicContact CG2-CB 4.14Å; T450-E479 HydrophobicContact CG2-CG 3.77Å
451	T	92.7	Very high	89.3	Confident	4 Å²	4	37.1 Å²	37.1	3%	0.025	18%	0.176	C	C	.	.	H	α-helix	trans	-69.3	-41.6	175.3	-60.1	0	0	0	0	111.5	I369 L375 L405 L409 I447 I448 D449 L453 K454 C455	I369-T451 HydrophobicContact CD1-CG2 4.24Å; I369-T451 HydrophobicContact CG1-CG2 4.14Å; I369-T451 HydrophobicContact CG2-CG2 3.77Å; L375-T451 HydrophobicContact CB-CG2 4.26Å; L375-T451 HydrophobicContact CD1-CG2 3.83Å; L375-T451 HydrophobicContact CD2-CG2 4.48Å; L375-T451 HydrophobicContact CG-CG2 4.42Å; L405-T451 HydrophobicContact CD2-CG2 4.26Å; L409-T451 HydrophobicContact CD1-CG2 3.72Å; I447-T451 WeakPolarHBondContact O-CB 3.3Å; I447-T451 PolarHBondContact O-N 3.07Å; I447-T451 PolarHBondContact O-OG1 3.43Å; I448-T451 PolarHBondContact O-N 3.46Å; D449-T451 PolarHBondContact O-N 3.42Å; T451-L453 VanDerWaalsContact C-N 3.3Å; T451-L453 PolarHBondContact O-N 3.41Å; T451-K454 PolarHBondContact O-N 3.33Å; T451-K454 VanDerWaalsContact O-N 3.17Å; T451-C455 PolarHBondContact O-N 3.25Å; T451-C455 PolarHBondContact O-SG 3.35Å
452	L	93	Very high	89.5	Confident	2 Å²	2	38.9 Å²	38.9	1%	0.01	20%	0.198	C	C	.	.	H	α-helix	trans	-58.2	-42.9	174.6	-79.5	172.5	0	0	0	111.2	I406 L409 I448 D449 K454 C455 Y456 L467	I406-L452 HydrophobicContact CB-CD2 4.47Å; I406-L452 HydrophobicContact CG1-CD2 4.29Å; I406-L452 HydrophobicContact CG2-CD2 4.41Å; L409-L452 HydrophobicContact CB-CD1 4.41Å; L409-L452 HydrophobicContact CB-CD2 3.7Å; L409-L452 HydrophobicContact CB-CG 3.99Å; L409-L452 HydrophobicContact CD1-CD2 4.14Å; L409-L452 HydrophobicContact CD1-CG 4.18Å; I448-L452 HydrophobicContact CG2-CD1 3.9Å; I448-L452 HydrophobicContact CG2-CG 4.33Å; I448-L452 WeakPolarHBondContact O-CB 3.42Å; I448-L452 WeakPolarHBondContact O-CG 3.31Å; I448-L452 PolarHBondContact O-N 3.15Å; D449-L452 PolarHBondContact O-N 3.46Å; L452-K454 PolarHBondContact O-N 3.1Å; L452-C455 PolarHBondContact O-N 3.36Å; L452-Y456 HydrophobicContact CB-CE2 4.23Å; L452-Y456 VanDerWaalsContact O-CD2 3.3Å; L452-Y456 WeakPolarHBondContact O-CD2 3.34Å; L452-Y456 PolarHBondContact O-N 2.71Å; L452-L467 HydrophobicContact CB-CD2 4.03Å; L452-L467 HydrophobicContact CD1-CD1 4.48Å
453	L	93.1	Very high	89.8	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-56.4	-49.1	174.1	177.7	64	0	0	0	111.7	D449 T451 C455 Y456 L457 V464 L467 L468 S480 L484	D449-L453 PolarHBondContact O-N 3.19Å; T451-L453 VanDerWaalsContact C-N 3.3Å; T451-L453 PolarHBondContact O-N 3.41Å; L453-C455 PolarHBondContact O-N 2.86Å; L453-Y456 PolarHBondContact O-N 3.01Å; L453-L457 HydrophobicContact CD1-CD1 4.35Å; L453-L457 HydrophobicContact CG-CD1 4.31Å; L453-L457 WeakPolarHBondContact O-CG 3.41Å; L453-L457 PolarHBondContact O-N 3.49Å; L453-L457 VanDerWaalsContact O-N 3.08Å; L453-V464 HydrophobicContact CD1-CB 4.46Å; L453-V464 HydrophobicContact CD1-CG1 3.51Å; L453-V464 HydrophobicContact CD1-CG2 4.37Å; L453-L467 HydrophobicContact CB-CD2 4.05Å; L453-L468 HydrophobicContact CD1-CD2 4.4Å; L453-S480 VanDerWaalsContact CD2-CB 3.49Å; L453-S480 WeakPolarHBondContact CD2-OG 3.13Å; L453-L484 HydrophobicContact CD1-CD2 4.41Å
454	K	91.9	Very high	90.1	Very high	25 Å²	25	29 Å²	29	11%	0.109	16%	0.158	C	C	.	.	H	α-helix	trans	-60.9	-42.9	176.4	-69.4	179.5	177.5	-172.2	0	112	L375 T450 T451 L452 L457 H458 E479 V483	L375-K454 HydrophobicContact CD2-CB 3.97Å; L375-K454 HydrophobicContact CD2-CD 4.21Å; L375-K454 PolarHBondContact O-NZ 2.93Å; T450-K454 PolarHBondContact O-N 3.15Å; T451-K454 PolarHBondContact O-N 3.33Å; T451-K454 VanDerWaalsContact O-N 3.17Å; L452-K454 PolarHBondContact O-N 3.1Å; K454-L457 PolarHBondContact O-N 3.15Å; K454-H458 PolarHBondContact O-N 3.01Å; K454-E479 WeakPolarHBondContact CE-OE1 3.24Å; K454-E479 IonicContact NZ-OE1 3.83Å; K454-E479 PolarHBondContact NZ-OE1 3.49Å; K454-V483 HydrophobicContact CG-CG1 4.4Å; K454-V483 HydrophobicContact CG-CG2 4.3Å
455	C	91.4	Very high	90.2	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64.8	-43	179.1	-61.6	0	0	0	0	111.9	I406 T451 L452 L453 L457 H458 T459	I406-C455 HydrophobicContact CD1-CB 3.8Å; I406-C455 HydrophobicContact CG1-CB 3.61Å; T451-C455 PolarHBondContact O-N 3.25Å; T451-C455 PolarHBondContact O-SG 3.35Å; L452-C455 PolarHBondContact O-N 3.36Å; L453-C455 PolarHBondContact O-N 2.86Å; C455-L457 VanDerWaalsContact C-N 3.35Å; C455-H458 PolarHBondContact O-N 3.41Å; C455-T459 PolarHBondContact O-N 3.22Å; C455-T459 PolarHBondContact O-OG1 3.46Å
456	Y	92.3	Very high	90.2	Very high	24 Å²	24	32.7 Å²	32.7	9%	0.094	18%	0.183	C	C	.	.	H	α-helix	trans	-65.6	-37	177.6	-68.6	-34.9	0	0	0	112.4	I406 L452 L453 H458 T459 N460 V461 L463 L467	I406-Y456 HydrophobicContact CB-CE1 4.46Å; I406-Y456 HydrophobicContact CD1-CD1 3.72Å; I406-Y456 HydrophobicContact CD1-CE1 3.83Å; I406-Y456 HydrophobicContact CG1-CD1 4.24Å; I406-Y456 HydrophobicContact CG1-CE1 3.99Å; I406-Y456 HydrophobicContact CG2-CE1 3.6Å; L452-Y456 HydrophobicContact CB-CE2 4.23Å; L452-Y456 VanDerWaalsContact O-CD2 3.3Å; L452-Y456 WeakPolarHBondContact O-CD2 3.34Å; L452-Y456 PolarHBondContact O-N 2.71Å; L453-Y456 PolarHBondContact O-N 3.01Å; Y456-H458 PolarHBondContact O-N 3.21Å; Y456-T459 PolarHBondContact O-N 3.35Å; Y456-N460 CarbonylContact O-C 3.39Å; Y456-N460 PolarHBondContact O-N 3.04Å; Y456-N460 VanDerWaalsContact O-O 3.13Å; Y456-V461 PolarHBondContact O-N 2.94Å; Y456-L463 HydrophobicContact CD1-CB 3.79Å; Y456-L463 HydrophobicContact CD1-CD1 3.86Å; Y456-L463 HydrophobicContact CD1-CG 4.48Å; Y456-L463 HydrophobicContact CD2-CB 4.05Å; Y456-L463 HydrophobicContact CE1-CB 3.94Å; Y456-L463 HydrophobicContact CE1-CD1 3.59Å; Y456-L463 HydrophobicContact CE1-CG 4.43Å; Y456-L463 HydrophobicContact CE2-CB 4.2Å; Y456-L463 HydrophobicContact CG-CB 3.86Å; Y456-L467 HydrophobicContact CD2-CB 4.31Å; Y456-L467 HydrophobicContact CD2-CD2 3.89Å; Y456-L467 HydrophobicContact CE2-CB 4.1Å; Y456-L467 HydrophobicContact CE2-CD1 4.4Å; Y456-L467 HydrophobicContact CE2-CD2 3.93Å; Y456-L467 HydrophobicContact CE2-CG 4.37Å
457	L	90.4	Very high	90.2	Very high	19 Å²	19	29.9 Å²	29.9	10%	0.099	17%	0.17	C	C	.	.	H	α-helix	trans	-63.9	-27.6	175.1	-72.9	169.2	0	0	0	113.1	L453 K454 C455 V464 V483 L484 K489	L453-L457 HydrophobicContact CD1-CD1 4.35Å; L453-L457 HydrophobicContact CG-CD1 4.31Å; L453-L457 WeakPolarHBondContact O-CG 3.41Å; L453-L457 PolarHBondContact O-N 3.49Å; L453-L457 VanDerWaalsContact O-N 3.08Å; K454-L457 PolarHBondContact O-N 3.15Å; C455-L457 VanDerWaalsContact C-N 3.35Å; L457-V464 HydrophobicContact CD2-CG2 3.85Å; L457-V464 HydrophobicContact CG-CG2 4Å; L457-V483 HydrophobicContact CD1-CG1 3.43Å; L457-V483 VanDerWaalsContact CD1-CG1 3.43Å; L457-L484 HydrophobicContact CD1-CD2 4.17Å; L457-L484 HydrophobicContact CD2-CD2 4.28Å; L457-K489 HydrophobicContact CD2-CG 3.98Å
458	H	86.7	Confident	90.2	Very high	116 Å²	116	28 Å²	28	54%	0.537	16%	0.16	S	C	.	.	H	α-helix	trans	-88.9	-24.7	176.4	-69.7	174.4	0	0	0	114.4	H402 K454 C455 Y456	H402-H458 AromaticContact CE1-ND1 3.61Å; H402-H458 AromaticContact NE2-ND1 3.75Å; K454-H458 PolarHBondContact O-N 3.01Å; C455-H458 PolarHBondContact O-N 3.41Å; Y456-H458 PolarHBondContact O-N 3.21Å
459	T	88.8	Confident	90.1	Very high	27 Å²	27	34.6 Å²	34.6	17%	0.166	19%	0.185	C	C	.	.	S	Bend	trans	-110.8	-64	-173.4	53.1	0	0	0	0	112	E399 H402 L403 I406 C455 Y456	E399-T459 HydrophobicContact CG-CG2 4.03Å; H402-T459 HydrophobicContact CB-CG2 3.56Å; L403-T459 HydrophobicContact CD2-CG2 3.97Å; L403-T459 HydrophobicContact CG-CG2 4.08Å; I406-T459 HydrophobicContact CD1-CG2 4.29Å; I406-T459 WeakPolarHBondContact CD1-OG1 3.39Å; C455-T459 PolarHBondContact O-N 3.22Å; C455-T459 PolarHBondContact O-OG1 3.46Å; Y456-T459 PolarHBondContact O-N 3.35Å
460	N	87.5	Confident	89.8	Confident	74 Å²	74	37.9 Å²	37.9	40%	0.396	20%	0.203	S	C	.	.			trans	-139.1	99.1	-177	-173.3	-7	0	0	0	111.9	Y456 A462 L463	Y456-N460 CarbonylContact O-C 3.39Å; Y456-N460 PolarHBondContact O-N 3.04Å; Y456-N460 VanDerWaalsContact O-O 3.13Å; N460-A462 PolarHBondContact O-N 3.39Å; N460-A462 VanDerWaalsContact OD1-CB 3.31Å; N460-A462 WeakPolarHBondContact OD1-CB 3.44Å; N460-A462 PolarHBondContact OD1-N 3.34Å; N460-A462 VanDerWaalsContact OD1-N 3.08Å; N460-L463 HydrophobicContact CB-CD1 4.22Å; N460-L463 HydrophobicContact CB-CG 4.4Å; N460-L463 PolarHBondContact O-N 2.96Å
461	V	88.6	Confident	88.9	Confident	49 Å²	49	46.3 Å²	46.3	30%	0.297	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-61.9	-26.3	-178.4	-177.9	0	0	0	0	112.5	Y456 L463 V464 K489	Y456-V461 PolarHBondContact O-N 2.94Å; V461-L463 PolarHBondContact O-N 3.06Å; V461-L463 VanDerWaalsContact O-N 3.17Å; V461-V464 WeakPolarHBondContact O-CB 3.36Å; V461-V464 WeakPolarHBondContact O-CG2 3.4Å; V461-V464 PolarHBondContact O-N 3.14Å; V461-V464 VanDerWaalsContact O-N 3.12Å; V461-K489 HydrophobicContact CG1-CD 4.15Å
462	A	87.1	Confident	88.2	Confident	72 Å²	72	50.8 Å²	50.8	60%	0.595	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-63.9	-23	-179.6	0	0	0	0	0	113	N460 P466	N460-A462 PolarHBondContact O-N 3.39Å; N460-A462 VanDerWaalsContact OD1-CB 3.31Å; N460-A462 WeakPolarHBondContact OD1-CB 3.44Å; N460-A462 PolarHBondContact OD1-N 3.34Å; N460-A462 VanDerWaalsContact OD1-N 3.08Å; A462-P466 WeakPolarHBondContact O-CD 3.3Å
463	L	88.8	Confident	87.7	Confident	70 Å²	70	51.2 Å²	51.2	37%	0.366	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-83.7	-10.9	179.4	-62.2	178.4	0	0	0	113.7	Y456 N460 V461 P466 L467	Y456-L463 HydrophobicContact CD1-CB 3.79Å; Y456-L463 HydrophobicContact CD1-CD1 3.86Å; Y456-L463 HydrophobicContact CD1-CG 4.48Å; Y456-L463 HydrophobicContact CD2-CB 4.05Å; Y456-L463 HydrophobicContact CE1-CB 3.94Å; Y456-L463 HydrophobicContact CE1-CD1 3.59Å; Y456-L463 HydrophobicContact CE1-CG 4.43Å; Y456-L463 HydrophobicContact CE2-CB 4.2Å; Y456-L463 HydrophobicContact CG-CB 3.86Å; N460-L463 HydrophobicContact CB-CD1 4.22Å; N460-L463 HydrophobicContact CB-CG 4.4Å; N460-L463 PolarHBondContact O-N 2.96Å; V461-L463 PolarHBondContact O-N 3.06Å; V461-L463 VanDerWaalsContact O-N 3.17Å; L463-P466 WeakPolarHBondContact O-CD 3.4Å; L463-L467 PolarHBondContact O-N 3.46Å; L463-L467 VanDerWaalsContact O-N 3.15Å
464	V	90.9	Very high	87.4	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65.1	-50.6	178.7	176.2	0	0	0	0	111.3	L453 L457 V461 L467 L468 L484 E492	L453-V464 HydrophobicContact CD1-CB 4.46Å; L453-V464 HydrophobicContact CD1-CG1 3.51Å; L453-V464 HydrophobicContact CD1-CG2 4.37Å; L457-V464 HydrophobicContact CD2-CG2 3.85Å; L457-V464 HydrophobicContact CG-CG2 4Å; V461-V464 WeakPolarHBondContact O-CB 3.36Å; V461-V464 WeakPolarHBondContact O-CG2 3.4Å; V461-V464 PolarHBondContact O-N 3.14Å; V461-V464 VanDerWaalsContact O-N 3.12Å; V464-L467 PolarHBondContact O-N 3.1Å; V464-L468 HydrophobicContact CG1-CD1 3.84Å; V464-L468 HydrophobicContact CG1-CG 4.3Å; V464-L468 WeakPolarHBondContact O-CG 3.26Å; V464-L468 PolarHBondContact O-N 3Å; V464-L484 HydrophobicContact CG1-CD2 4.32Å; V464-E492 HydrophobicContact CB-CG 4.14Å; V464-E492 HydrophobicContact CG1-CB 3.93Å; V464-E492 HydrophobicContact CG1-CG 3.57Å
465	S	87.8	Confident	87.2	Confident	17 Å²	17	51.7 Å²	51.7	12%	0.119	27%	0.27	C	S	.	.	H	α-helix	trans	-57.9	-48.6	179.4	-86.7	0	0	0	0	112.6	L467 L468 R469 E492	S465-L467 PolarHBondContact O-N 3.5Å; S465-L468 PolarHBondContact O-N 3.47Å; S465-R469 WeakPolarHBondContact O-CG 3.37Å; S465-R469 PolarHBondContact O-N 2.88Å; S465-R469 VanDerWaalsContact O-N 3.15Å; S465-E492 PolarHBondContact OG-OE1 3.05Å
466	P	89.3	Confident	87.2	Confident	64 Å²	64	55 Å²	55	42%	0.416	29%	0.285	S	S	.	.	H	α-helix	trans	-55.4	-46.4	172.3	-28.6	34.7	0	0	0	114.4	A462 L463 L468 R469	A462-P466 WeakPolarHBondContact O-CD 3.3Å; L463-P466 WeakPolarHBondContact O-CD 3.4Å; P466-L468 VanDerWaalsContact C-N 3.32Å; P466-L468 PolarHBondContact O-N 3.23Å; P466-R469 PolarHBondContact O-N 3.17Å
467	L	89.1	Confident	87	Confident	10 Å²	10	56.7 Å²	56.7	5%	0.052	30%	0.295	C	S	.	.	H	α-helix	trans	-58.9	-45.5	178.1	178.7	71	0	0	0	111.1	L452 L453 Y456 L463 V464 S465 R469 L470	L452-L467 HydrophobicContact CB-CD2 4.03Å; L452-L467 HydrophobicContact CD1-CD1 4.48Å; L453-L467 HydrophobicContact CB-CD2 4.05Å; Y456-L467 HydrophobicContact CD2-CB 4.31Å; Y456-L467 HydrophobicContact CD2-CD2 3.89Å; Y456-L467 HydrophobicContact CE2-CB 4.1Å; Y456-L467 HydrophobicContact CE2-CD1 4.4Å; Y456-L467 HydrophobicContact CE2-CD2 3.93Å; Y456-L467 HydrophobicContact CE2-CG 4.37Å; L463-L467 PolarHBondContact O-N 3.46Å; L463-L467 VanDerWaalsContact O-N 3.15Å; V464-L467 PolarHBondContact O-N 3.1Å; S465-L467 PolarHBondContact O-N 3.5Å; L467-R469 VanDerWaalsContact C-N 3.31Å; L467-R469 PolarHBondContact O-N 3.17Å; L467-L470 HydrophobicContact CD1-CD1 4.07Å; L467-L470 WeakPolarHBondContact O-CB 3.25Å; L467-L470 WeakPolarHBondContact O-CG 3.42Å; L467-L470 PolarHBondContact O-N 3.41Å
468	L	89.9	Confident	86.9	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-68.2	-30.1	-176	-68.6	178	0	0	0	113.3	L453 V464 S465 P466 L470 N473 L484 E492 I495 L496	L453-L468 HydrophobicContact CD1-CD2 4.4Å; V464-L468 HydrophobicContact CG1-CD1 3.84Å; V464-L468 HydrophobicContact CG1-CG 4.3Å; V464-L468 WeakPolarHBondContact O-CG 3.26Å; V464-L468 PolarHBondContact O-N 3Å; S465-L468 PolarHBondContact O-N 3.47Å; P466-L468 VanDerWaalsContact C-N 3.32Å; P466-L468 PolarHBondContact O-N 3.23Å; L468-L470 VanDerWaalsContact C-N 3.32Å; L468-N473 WeakPolarHBondContact CA-ND2 3.34Å; L468-N473 PolarHBondContact O-ND2 3.48Å; L468-N473 VanDerWaalsContact O-ND2 3.1Å; L468-L484 HydrophobicContact CD1-CD1 4.37Å; L468-E492 HydrophobicContact CD1-CB 3.91Å; L468-E492 VanDerWaalsContact CD1-O 3.28Å; L468-E492 WeakPolarHBondContact CD1-O 3.49Å; L468-I495 HydrophobicContact CB-CG2 3.85Å; L468-L496 HydrophobicContact CD1-CB 4.37Å; L468-L496 HydrophobicContact CD2-CB 4.35Å; L468-L496 HydrophobicContact CD2-CD1 3.95Å
469	R	88.6	Confident	87	Confident	140 Å²	140	60.4 Å²	60.4	53%	0.528	31%	0.312	S	S	.	.	H	α-helix	trans	-78	-11.2	179.8	-71.4	178	-163.2	145.6	6.4	114.4	S465 P466 L467 E471 I495	S465-R469 WeakPolarHBondContact O-CG 3.37Å; S465-R469 PolarHBondContact O-N 2.88Å; S465-R469 VanDerWaalsContact O-N 3.15Å; P466-R469 PolarHBondContact O-N 3.17Å; L467-R469 VanDerWaalsContact C-N 3.31Å; L467-R469 PolarHBondContact O-N 3.17Å; R469-E471 PolarHBondContact O-N 3.21Å; R469-I495 HydrophobicContact CG-CG2 3.79Å
470	L	85.9	Confident	87.1	Confident	69 Å²	69	59.1 Å²	59.1	36%	0.361	31%	0.305	S	S	.	.			trans	-59.3	134.7	178.4	-64.5	175	0	0	0	110.6	R413 L467 L468 N472 N473	R413-L470 VanDerWaalsContact NH2-CD1 3.33Å; L467-L470 HydrophobicContact CD1-CD1 4.07Å; L467-L470 WeakPolarHBondContact O-CB 3.25Å; L467-L470 WeakPolarHBondContact O-CG 3.42Å; L467-L470 PolarHBondContact O-N 3.41Å; L468-L470 VanDerWaalsContact C-N 3.32Å; L470-N472 VanDerWaalsContact C-N 3.25Å; L470-N472 PolarHBondContact O-N 2.78Å; L470-N473 VanDerWaalsContact O-CB 3.26Å; L470-N473 WeakPolarHBondContact O-CB 3.48Å; L470-N473 PolarHBondContact O-N 3.1Å
471	E	72.7	Confident	87.3	Confident	189 Å²	189	57.3 Å²	57.3	88%	0.883	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-38.2	179.5	-65.1	-179.4	169.6	0	0	111.9	R469 N473	R469-E471 PolarHBondContact O-N 3.21Å; E471-N473 PolarHBondContact O-N 2.76Å
472	N	77.5	Confident	87.4	Confident	98 Å²	98	60.7 Å²	60.7	52%	0.524	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	46.9	176.9	-68.4	-34.1	0	0	0	112.4	R413 L470 H474	R413-N472 PolarHBondContact NH2-O 2.66Å; L470-N472 VanDerWaalsContact C-N 3.25Å; L470-N472 PolarHBondContact O-N 2.78Å; N472-H474 PolarHBondContact O-CE1 3.38Å; N472-H474 PolarHBondContact O-ND1 3.15Å
473	N	84.1	Confident	87.5	Confident	11 Å²	11	58.2 Å²	58.2	6%	0.059	28%	0.282	C	S	.	.			trans	-79.3	116.3	174.8	174.8	-6.6	0	0	0	110.9	L468 L470 E471 C475 K500	L468-N473 WeakPolarHBondContact CA-ND2 3.34Å; L468-N473 PolarHBondContact O-ND2 3.48Å; L468-N473 VanDerWaalsContact O-ND2 3.1Å; L470-N473 VanDerWaalsContact O-CB 3.26Å; L470-N473 WeakPolarHBondContact O-CB 3.48Å; L470-N473 PolarHBondContact O-N 3.1Å; E471-N473 PolarHBondContact O-N 2.76Å; N473-C475 WeakPolarHBondContact OD1-CB 3.49Å; N473-C475 PolarHBondContact OD1-N 3.36Å; N473-C475 PolarHBondContact OD1-SG 2.85Å; N473-K500 PolarHBondContact O-NZ 3.01Å
474	H	86.1	Confident	87.7	Confident	35 Å²	35	54.9 Å²	54.9	16%	0.162	27%	0.265	C	S	.	.			trans	-102.4	8.4	-178.9	-63.2	83.8	0	0	0	114.1	L445 Q446 D449 N472 H476	L445-H474 HydrophobicContact CB-CB 4.2Å; Q446-H474 VanDerWaalsContact CA-O 3.28Å; Q446-H474 WeakPolarHBondContact CA-O 3.36Å; Q446-H474 HydrophobicContact CB-CB 4.23Å; Q446-H474 VanDerWaalsContact CB-O 3.29Å; Q446-H474 WeakPolarHBondContact CB-O 3.41Å; Q446-H474 VanDerWaalsContact CG-O 3.24Å; Q446-H474 WeakPolarHBondContact CG-O 3.36Å; D449-H474 WeakPolarHBondContact OD2-CB 3.39Å; D449-H474 PolarHBondContact OD2-N 3.41Å; D449-H474 IonicContact OD2-ND1 3.05Å; N472-H474 PolarHBondContact O-CE1 3.38Å; N472-H474 PolarHBondContact O-ND1 3.15Å; H474-H476 PolarHBondContact O-N 2.68Å
475	C	88.9	Confident	87.6	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.014	28%	0.283	C	S	.	.			trans	-46.6	135.3	179.5	-76.5	0	0	0	0	112.5	N473 I477 S480 L496	N473-C475 WeakPolarHBondContact OD1-CB 3.49Å; N473-C475 PolarHBondContact OD1-N 3.36Å; N473-C475 PolarHBondContact OD1-SG 2.85Å; C475-I477 PolarHBondContact O-N 2.67Å; C475-S480 WeakPolarHBondContact CB-OG 3.36Å; C475-L496 HydrophobicContact CB-CD1 4.47Å
476	H	90	Very high	87.7	Confident	70 Å²	70	66 Å²	66	32%	0.324	31%	0.311	S	S	.	.			trans	-69.2	121.3	174	-171.9	-93.8	0	0	0	109.7	Q446 T450 H474 E478 E479 S480	Q446-H476 HydrophobicContact CG-CB 4.09Å; T450-H476 HydrophobicContact CG2-CB 4.27Å; T450-H476 WeakPolarHBondContact OG1-CB 3.34Å; T450-H476 PolarHBondContact OG1-N 2.94Å; H474-H476 PolarHBondContact O-N 2.68Å; H476-E478 IonicContact CE1-OE2 2.64Å; H476-E479 HydrophobicContact CB-CB 4.24Å; H476-E479 PolarHBondContact ND1-N 3.39Å; H476-S480 WeakPolarHBondContact O-CB 3.04Å; H476-S480 PolarHBondContact O-N 2.98Å; H476-S480 PolarHBondContact O-OG 3.34Å
477	I	88.3	Confident	87.7	Confident	59 Å²	59	65.3 Å²	65.3	30%	0.303	31%	0.306	S	S	.	.	H	α-helix	trans	-62.9	-53.3	-167.1	-61.7	173.4	0	0	0	111.4	C475 E479 S480 E481 K500 L502	C475-I477 PolarHBondContact O-N 2.67Å; I477-E479 VanDerWaalsContact C-N 3.35Å; I477-E479 PolarHBondContact O-N 2.99Å; I477-S480 PolarHBondContact O-N 3.09Å; I477-E481 VanDerWaalsContact O-CB 3.26Å; I477-E481 WeakPolarHBondContact O-CB 3.38Å; I477-E481 PolarHBondContact O-N 3.23Å; I477-K500 HydrophobicContact CD1-CB 4.47Å; I477-K500 HydrophobicContact CD1-CD 4.21Å; I477-K500 HydrophobicContact CD1-CG 4.25Å; I477-K500 HydrophobicContact CG1-CD 4.33Å; I477-K500 HydrophobicContact CG1-CG 4.28Å; I477-L502 HydrophobicContact CD1-CD1 4.46Å; I477-L502 HydrophobicContact CG2-CD1 4.07Å
478	E	89	Confident	87.7	Confident	148 Å²	148	71.8 Å²	71.8	69%	0.692	34%	0.336	S	S	*	.	H	α-helix	trans	-65	-39.4	-174.3	-60.7	176.1	168.3	0	0	112.3	H476 F482	H476-E478 IonicContact CE1-OE2 2.64Å; E478-F482 WeakPolarHBondContact O-CB 3.19Å; E478-F482 PolarHBondContact O-N 2.81Å
479	E	88.3	Confident	87.7	Confident	64 Å²	64	75.2 Å²	75.2	30%	0.299	35%	0.35	S	S	.	.	H	α-helix	trans	-71.5	-43.1	179.8	-175.5	64.6	-167.1	0	0	110.5	T450 K454 H476 I477 E481 F482 V483	T450-E479 HydrophobicContact CG2-CB 4.14Å; T450-E479 HydrophobicContact CG2-CG 3.77Å; K454-E479 WeakPolarHBondContact CE-OE1 3.24Å; K454-E479 IonicContact NZ-OE1 3.83Å; K454-E479 PolarHBondContact NZ-OE1 3.49Å; H476-E479 HydrophobicContact CB-CB 4.24Å; H476-E479 PolarHBondContact ND1-N 3.39Å; I477-E479 VanDerWaalsContact C-N 3.35Å; I477-E479 PolarHBondContact O-N 2.99Å; E479-E481 VanDerWaalsContact C-N 3.33Å; E479-E481 PolarHBondContact O-N 3.07Å; E479-F482 PolarHBondContact O-N 3.29Å; E479-V483 VanDerWaalsContact O-CG2 3.25Å; E479-V483 WeakPolarHBondContact O-CG2 3.26Å; E479-V483 PolarHBondContact O-N 2.98Å
480	S	90.9	Very high	87.7	Confident	1 Å²	1	71 Å²	71	1%	0.007	34%	0.335	C	S	.	.	H	α-helix	trans	-64.2	-40.7	176.8	-56.7	0	0	0	0	111.1	L453 C475 H476 I477 V483 L484	L453-S480 VanDerWaalsContact CD2-CB 3.49Å; L453-S480 WeakPolarHBondContact CD2-OG 3.13Å; C475-S480 WeakPolarHBondContact CB-OG 3.36Å; H476-S480 WeakPolarHBondContact O-CB 3.04Å; H476-S480 PolarHBondContact O-N 2.98Å; H476-S480 PolarHBondContact O-OG 3.34Å; I477-S480 PolarHBondContact O-N 3.09Å; S480-V483 PolarHBondContact O-N 3.41Å; S480-L484 VanDerWaalsContact O-CB 3.27Å; S480-L484 WeakPolarHBondContact O-CB 3.24Å; S480-L484 WeakPolarHBondContact O-CD1 3.18Å; S480-L484 WeakPolarHBondContact O-CG 3.44Å; S480-L484 PolarHBondContact O-N 3.18Å
481	E	91.9	Very high	87.9	Confident	35 Å²	35	69.4 Å²	69.4	16%	0.164	33%	0.329	C	S	.	.	H	α-helix	trans	-59.5	-49.5	173.8	174.7	174.8	161.7	0	0	111.3	I477 E479 V483 L484 K485 L493 Y497 K505	I477-E481 VanDerWaalsContact O-CB 3.26Å; I477-E481 WeakPolarHBondContact O-CB 3.38Å; I477-E481 PolarHBondContact O-N 3.23Å; E479-E481 VanDerWaalsContact C-N 3.33Å; E479-E481 PolarHBondContact O-N 3.07Å; E481-V483 PolarHBondContact O-N 2.84Å; E481-L484 PolarHBondContact O-N 3.48Å; E481-K485 HydrophobicContact CG-CD 3.96Å; E481-K485 WeakPolarHBondContact O-CB 3.35Å; E481-K485 VanDerWaalsContact O-CG 3.32Å; E481-K485 WeakPolarHBondContact O-CG 3.33Å; E481-K485 PolarHBondContact O-N 2.88Å; E481-K485 WeakPolarHBondContact OE1-CE 3.44Å; E481-K485 IonicContact OE1-NZ 3.04Å; E481-K485 PolarHBondContact OE1-NZ 3.11Å; E481-L493 HydrophobicContact CB-CD1 4.25Å; E481-L493 HydrophobicContact CG-CD1 4.26Å; E481-Y497 WeakPolarHBondContact CG-OH 3.38Å; E481-Y497 PolarHBondContact OE1-OH 3.2Å; E481-Y497 PolarHBondContact OE2-OH 3.43Å; E481-K505 IonicContact OE2-NZ 2.73Å
482	F	90.3	Very high	88.7	Confident	120 Å²	120	61.9 Å²	61.9	53%	0.526	29%	0.294	S	S	.	.	H	α-helix	trans	-58.1	-48.8	178.7	173.9	-104.2	0	0	0	112	E478 E479 K485 K486	E478-F482 WeakPolarHBondContact O-CB 3.19Å; E478-F482 PolarHBondContact O-N 2.81Å; E479-F482 PolarHBondContact O-N 3.29Å; F482-K485 PolarHBondContact O-N 3.29Å; F482-K486 HydrophobicContact CE1-CD 4.43Å; F482-K486 HydrophobicContact CZ-CD 4.47Å; F482-K486 VanDerWaalsContact O-CB 3.31Å; F482-K486 WeakPolarHBondContact O-CB 3.34Å; F482-K486 PolarHBondContact O-N 3.32Å
483	V	90	Very high	89.4	Confident	21 Å²	21	57.2 Å²	57.2	13%	0.127	27%	0.269	C	S	.	.	H	α-helix	trans	-69.2	-40.7	-176.9	-179.3	0	0	0	0	111.8	K454 L457 E479 S480 E481 K486 T487	K454-V483 HydrophobicContact CG-CG1 4.4Å; K454-V483 HydrophobicContact CG-CG2 4.3Å; L457-V483 HydrophobicContact CD1-CG1 3.43Å; L457-V483 VanDerWaalsContact CD1-CG1 3.43Å; E479-V483 VanDerWaalsContact O-CG2 3.25Å; E479-V483 WeakPolarHBondContact O-CG2 3.26Å; E479-V483 PolarHBondContact O-N 2.98Å; S480-V483 PolarHBondContact O-N 3.41Å; E481-V483 PolarHBondContact O-N 2.84Å; V483-K486 PolarHBondContact O-N 3.44Å; V483-T487 WeakPolarHBondContact O-CG2 3.34Å; V483-T487 PolarHBondContact O-N 2.97Å; V483-T487 PolarHBondContact O-OG1 3.24Å
484	L	91.6	Very high	89.7	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-67.1	-39	177.5	-71.6	170.1	0	0	0	112.1	L453 L457 V464 L468 S480 E481 T487 Q488 K489 E492 L493 L496	L453-L484 HydrophobicContact CD1-CD2 4.41Å; L457-L484 HydrophobicContact CD1-CD2 4.17Å; L457-L484 HydrophobicContact CD2-CD2 4.28Å; V464-L484 HydrophobicContact CG1-CD2 4.32Å; L468-L484 HydrophobicContact CD1-CD1 4.37Å; S480-L484 VanDerWaalsContact O-CB 3.27Å; S480-L484 WeakPolarHBondContact O-CB 3.24Å; S480-L484 WeakPolarHBondContact O-CD1 3.18Å; S480-L484 WeakPolarHBondContact O-CG 3.44Å; S480-L484 PolarHBondContact O-N 3.18Å; E481-L484 PolarHBondContact O-N 3.48Å; L484-T487 PolarHBondContact O-N 3.42Å; L484-T487 PolarHBondContact O-OG1 3.17Å; L484-Q488 PolarHBondContact O-N 3.36Å; L484-Q488 VanDerWaalsContact O-N 3.15Å; L484-K489 HydrophobicContact CD2-CB 3.93Å; L484-K489 PolarHBondContact O-N 3.19Å; L484-E492 HydrophobicContact CD2-CB 3.86Å; L484-L493 HydrophobicContact CB-CB 4.28Å; L484-L493 HydrophobicContact CB-CD1 4.33Å; L484-L493 HydrophobicContact CD1-CB 4.29Å; L484-L493 HydrophobicContact CD1-CD1 4.14Å; L484-L496 HydrophobicContact CD1-CD2 4.13Å
485	K	90	Very high	89.9	Confident	88 Å²	88	56.7 Å²	56.7	38%	0.383	27%	0.267	S	S	.	.	H	α-helix	trans	-64.9	-45.6	173	-75.8	179.3	174.1	176.5	0	111.6	E481 F482 T487 Q488 L493	E481-K485 HydrophobicContact CG-CD 3.96Å; E481-K485 WeakPolarHBondContact O-CB 3.35Å; E481-K485 VanDerWaalsContact O-CG 3.32Å; E481-K485 WeakPolarHBondContact O-CG 3.33Å; E481-K485 PolarHBondContact O-N 2.88Å; E481-K485 WeakPolarHBondContact OE1-CE 3.44Å; E481-K485 IonicContact OE1-NZ 3.04Å; E481-K485 PolarHBondContact OE1-NZ 3.11Å; F482-K485 PolarHBondContact O-N 3.29Å; K485-T487 PolarHBondContact O-N 2.93Å; K485-Q488 PolarHBondContact O-N 3.25Å; K485-L493 HydrophobicContact CG-CD2 3.85Å
486	K	90.2	Very high	90	Very high	161 Å²	161	56.6 Å²	56.6	70%	0.7	27%	0.267	S	S	*	.	H	α-helix	trans	-58.3	-35.7	177.6	-175	179.8	178.4	-176.6	0	112.4	F482 V483	F482-K486 HydrophobicContact CE1-CD 4.43Å; F482-K486 HydrophobicContact CZ-CD 4.47Å; F482-K486 VanDerWaalsContact O-CB 3.31Å; F482-K486 WeakPolarHBondContact O-CB 3.34Å; F482-K486 PolarHBondContact O-N 3.32Å; V483-K486 PolarHBondContact O-N 3.44Å
487	T	88.1	Confident	90.1	Very high	51 Å²	51	53.4 Å²	53.4	31%	0.313	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	4.8	179.1	54.1	0	0	0	0	114	V483 L484 K485 K489	V483-T487 WeakPolarHBondContact O-CG2 3.34Å; V483-T487 PolarHBondContact O-N 2.97Å; V483-T487 PolarHBondContact O-OG1 3.24Å; L484-T487 PolarHBondContact O-N 3.42Å; L484-T487 PolarHBondContact O-OG1 3.17Å; K485-T487 PolarHBondContact O-N 2.93Å; T487-K489 PolarHBondContact O-N 3.08Å
488	Q	89	Confident	90.2	Very high	146 Å²	146	53.8 Å²	53.8	68%	0.682	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	30	-177.7	-57.9	-176.4	-14.3	0	0	114.2	L484 K485 Y490	L484-Q488 PolarHBondContact O-N 3.36Å; L484-Q488 VanDerWaalsContact O-N 3.15Å; K485-Q488 PolarHBondContact O-N 3.25Å; Q488-Y490 HydrophobicContact CB-CE2 3.94Å; Q488-Y490 HydrophobicContact CG-CE2 4.39Å; Q488-Y490 WeakPolarHBondContact O-CD2 3.46Å; Q488-Y490 PolarHBondContact O-N 3.19Å
489	K	89.6	Confident	90.2	Very high	71 Å²	71	51.9 Å²	51.9	31%	0.309	24%	0.242	S	C	.	.			trans	-92.7	66.5	179.1	-63.7	-57.6	179.4	-178.7	0	111.4	L457 V461 L484 T487 E492 L493	L457-K489 HydrophobicContact CD2-CG 3.98Å; V461-K489 HydrophobicContact CG1-CD 4.15Å; L484-K489 HydrophobicContact CD2-CB 3.93Å; L484-K489 PolarHBondContact O-N 3.19Å; T487-K489 PolarHBondContact O-N 3.08Å; K489-E492 HydrophobicContact CB-CB 4.36Å; K489-E492 WeakPolarHBondContact CB-OE2 3.37Å; K489-E492 PolarHBondContact O-N 3.37Å; K489-L493 PolarHBondContact O-N 3.02Å; K489-L493 VanDerWaalsContact O-N 3.12Å
490	Y	89.8	Confident	90.1	Very high	53 Å²	53	52.3 Å²	52.3	21%	0.208	24%	0.242	C	C	.	.	H	α-helix	trans	-70.1	-30.6	-175	-60.5	-73	0	0	0	113.7	Q488 L493 I494 V509 Q513	Q488-Y490 HydrophobicContact CB-CE2 3.94Å; Q488-Y490 HydrophobicContact CG-CE2 4.39Å; Q488-Y490 WeakPolarHBondContact O-CD2 3.46Å; Q488-Y490 PolarHBondContact O-N 3.19Å; Y490-L493 HydrophobicContact CD1-CD2 4.43Å; Y490-L493 WeakPolarHBondContact O-CB 3.06Å; Y490-L493 PolarHBondContact O-N 3.31Å; Y490-I494 WeakPolarHBondContact O-CG1 3.46Å; Y490-I494 PolarHBondContact O-N 3.49Å; Y490-V509 HydrophobicContact CD1-CG1 4.01Å; Y490-V509 HydrophobicContact CG-CG1 4.46Å; Y490-Q513 HydrophobicContact CD2-CG 4.47Å; Y490-Q513 HydrophobicContact CG-CG 4.24Å
491	S	89.2	Confident	90	Very high	34 Å²	34	54.4 Å²	54.4	24%	0.238	26%	0.264	C	S	.	.	H	α-helix	trans	-63.5	-43.9	176.6	-61.5	0	0	0	0	111.2	I494 I495	S491-I494 PolarHBondContact O-N 2.74Å; S491-I495 WeakPolarHBondContact O-CG1 3.49Å; S491-I495 PolarHBondContact O-N 3.37Å
492	E	90.9	Very high	89.9	Confident	31 Å²	31	55.4 Å²	55.4	15%	0.145	27%	0.27	C	S	.	.	H	α-helix	trans	-67.1	-37	175	-69.2	67.8	-153.2	0	0	111.7	V464 S465 L468 L484 K489 I494 I495 L496	V464-E492 HydrophobicContact CB-CG 4.14Å; V464-E492 HydrophobicContact CG1-CB 3.93Å; V464-E492 HydrophobicContact CG1-CG 3.57Å; S465-E492 PolarHBondContact OG-OE1 3.05Å; L468-E492 HydrophobicContact CD1-CB 3.91Å; L468-E492 VanDerWaalsContact CD1-O 3.28Å; L468-E492 WeakPolarHBondContact CD1-O 3.49Å; L484-E492 HydrophobicContact CD2-CB 3.86Å; K489-E492 HydrophobicContact CB-CB 4.36Å; K489-E492 WeakPolarHBondContact CB-OE2 3.37Å; K489-E492 PolarHBondContact O-N 3.37Å; E492-I494 VanDerWaalsContact C-N 3.33Å; E492-I494 PolarHBondContact O-N 3.47Å; E492-I495 WeakPolarHBondContact O-CB 3.48Å; E492-I495 PolarHBondContact O-N 3.12Å; E492-L496 PolarHBondContact O-N 3.29Å
493	L	91.3	Very high	90	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-61.9	-39.6	175.1	-177	61.6	0	0	0	112.3	E481 L484 K485 K489 Y490 I495 L496 Y497 V509	E481-L493 HydrophobicContact CB-CD1 4.25Å; E481-L493 HydrophobicContact CG-CD1 4.26Å; L484-L493 HydrophobicContact CB-CB 4.28Å; L484-L493 HydrophobicContact CB-CD1 4.33Å; L484-L493 HydrophobicContact CD1-CB 4.29Å; L484-L493 HydrophobicContact CD1-CD1 4.14Å; K485-L493 HydrophobicContact CG-CD2 3.85Å; K489-L493 PolarHBondContact O-N 3.02Å; K489-L493 VanDerWaalsContact O-N 3.12Å; Y490-L493 HydrophobicContact CD1-CD2 4.43Å; Y490-L493 WeakPolarHBondContact O-CB 3.06Å; Y490-L493 PolarHBondContact O-N 3.31Å; L493-I495 VanDerWaalsContact C-N 3.35Å; L493-L496 HydrophobicContact CD1-CD2 4.3Å; L493-L496 WeakPolarHBondContact O-CB 3.31Å; L493-L496 PolarHBondContact O-N 3.41Å; L493-Y497 HydrophobicContact CD1-CD2 4.38Å; L493-Y497 HydrophobicContact CD1-CE1 4.16Å; L493-Y497 HydrophobicContact CD1-CE2 3.83Å; L493-Y497 HydrophobicContact CD2-CE2 3.97Å; L493-Y497 HydrophobicContact CG-CD2 4.08Å; L493-Y497 HydrophobicContact CG-CE2 3.6Å; L493-Y497 WeakPolarHBondContact O-CD2 3.45Å; L493-Y497 PolarHBondContact O-N 3.3Å; L493-V509 HydrophobicContact CD2-CG2 4.18Å
494	I	90.6	Very high	90.1	Very high	13 Å²	13	54.9 Å²	54.9	7%	0.067	27%	0.268	C	S	.	.	H	α-helix	trans	-62.3	-43.6	175.1	-69.4	159.8	0	0	0	110.6	Y490 S491 E492 L496 Y497 E498 A506 V509 L510 L521 Y530	Y490-I494 WeakPolarHBondContact O-CG1 3.46Å; Y490-I494 PolarHBondContact O-N 3.49Å; S491-I494 PolarHBondContact O-N 2.74Å; E492-I494 VanDerWaalsContact C-N 3.33Å; E492-I494 PolarHBondContact O-N 3.47Å; I494-L496 VanDerWaalsContact C-N 3.31Å; I494-L496 PolarHBondContact O-N 3.08Å; I494-Y497 PolarHBondContact O-N 2.94Å; I494-E498 WeakPolarHBondContact O-CB 3.43Å; I494-E498 PolarHBondContact O-N 3.27Å; I494-A506 HydrophobicContact CG2-CB 4.41Å; I494-V509 HydrophobicContact CD1-CG1 4.39Å; I494-V509 HydrophobicContact CG1-CG1 4.25Å; I494-L510 HydrophobicContact CD1-CD1 4.48Å; I494-L510 HydrophobicContact CD1-CD2 3.53Å; I494-L510 HydrophobicContact CD1-CG 3.69Å; I494-L510 HydrophobicContact CG1-CG 4.38Å; I494-L521 HydrophobicContact CD1-CD1 3.48Å; I494-L521 VanDerWaalsContact CD1-CD1 3.48Å; I494-L521 HydrophobicContact CD1-CD2 4.25Å; I494-L521 HydrophobicContact CD1-CG 4.5Å; I494-Y530 HydrophobicContact CG2-CD2 4.06Å; I494-Y530 HydrophobicContact CG2-CE2 3.79Å
495	I	90.4	Very high	90.1	Very high	22 Å²	22	59.3 Å²	59.3	11%	0.113	29%	0.288	C	S	.	.	H	α-helix	trans	-60.4	-42.4	176.2	-63.7	169.2	0	0	0	110.7	L468 R469 S491 E492 L493 E498 K499	L468-I495 HydrophobicContact CB-CG2 3.85Å; R469-I495 HydrophobicContact CG-CG2 3.79Å; S491-I495 WeakPolarHBondContact O-CG1 3.49Å; S491-I495 PolarHBondContact O-N 3.37Å; E492-I495 WeakPolarHBondContact O-CB 3.48Å; E492-I495 PolarHBondContact O-N 3.12Å; L493-I495 VanDerWaalsContact C-N 3.35Å; I495-E498 PolarHBondContact O-N 3.35Å; I495-K499 HydrophobicContact CG2-CG 4.47Å; I495-K499 WeakPolarHBondContact O-CB 3.48Å; I495-K499 WeakPolarHBondContact O-CG 3.3Å; I495-K499 PolarHBondContact O-N 3.47Å
496	L	90.8	Very high	90.2	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60.2	-47.7	176.4	176.1	69.4	0	0	0	111.3	L468 C475 L484 E492 L493 I494 K499 K500	L468-L496 HydrophobicContact CD1-CB 4.37Å; L468-L496 HydrophobicContact CD2-CB 4.35Å; L468-L496 HydrophobicContact CD2-CD1 3.95Å; C475-L496 HydrophobicContact CB-CD1 4.47Å; L484-L496 HydrophobicContact CD1-CD2 4.13Å; E492-L496 PolarHBondContact O-N 3.29Å; L493-L496 HydrophobicContact CD1-CD2 4.3Å; L493-L496 WeakPolarHBondContact O-CB 3.31Å; L493-L496 PolarHBondContact O-N 3.41Å; I494-L496 VanDerWaalsContact C-N 3.31Å; I494-L496 PolarHBondContact O-N 3.08Å; L496-K499 PolarHBondContact O-N 3.24Å; L496-K500 HydrophobicContact CD1-CG 4.26Å; L496-K500 WeakPolarHBondContact O-CB 3.43Å; L496-K500 VanDerWaalsContact O-CG 3.25Å; L496-K500 WeakPolarHBondContact O-CG 3.47Å; L496-K500 PolarHBondContact O-N 3.14Å; L496-K500 VanDerWaalsContact O-N 3.1Å
497	Y	92.1	Very high	90.2	Very high	3 Å²	3	47.5 Å²	47.5	1%	0.012	24%	0.236	C	C	.	.	H	α-helix	trans	-66	-41.7	179.4	-70.6	-33.5	0	0	0	112.7	E481 L493 I494 K499 K500 G501 L502 K505 A506 V509	E481-Y497 WeakPolarHBondContact CG-OH 3.38Å; E481-Y497 PolarHBondContact OE1-OH 3.2Å; E481-Y497 PolarHBondContact OE2-OH 3.43Å; L493-Y497 HydrophobicContact CD1-CD2 4.38Å; L493-Y497 HydrophobicContact CD1-CE1 4.16Å; L493-Y497 HydrophobicContact CD1-CE2 3.83Å; L493-Y497 HydrophobicContact CD2-CE2 3.97Å; L493-Y497 HydrophobicContact CG-CD2 4.08Å; L493-Y497 HydrophobicContact CG-CE2 3.6Å; L493-Y497 WeakPolarHBondContact O-CD2 3.45Å; L493-Y497 PolarHBondContact O-N 3.3Å; I494-Y497 PolarHBondContact O-N 2.94Å; Y497-K499 PolarHBondContact O-N 3.22Å; Y497-K500 CarbonylContact O-C 2.98Å; Y497-K500 PolarHBondContact O-N 2.95Å; Y497-G501 PolarHBondContact O-N 3.48Å; Y497-L502 HydrophobicContact CD1-CB 4.03Å; Y497-L502 HydrophobicContact CD1-CD1 3.97Å; Y497-L502 HydrophobicContact CE1-CD1 4.37Å; Y497-L502 HydrophobicContact CG-CB 4.35Å; Y497-L502 PolarHBondContact O-N 3.32Å; Y497-K505 HydrophobicContact CD1-CB 4.31Å; Y497-K505 HydrophobicContact CD2-CB 3.93Å; Y497-K505 HydrophobicContact CE1-CB 4.21Å; Y497-K505 HydrophobicContact CE1-CD 3.98Å; Y497-K505 HydrophobicContact CE2-CB 3.8Å; Y497-K505 HydrophobicContact CG-CB 4.18Å; Y497-A506 HydrophobicContact CD2-CB 4.25Å; Y497-V509 HydrophobicContact CE2-CG2 4.08Å
498	E	89.8	Confident	90.3	Very high	67 Å²	67	50.5 Å²	50.5	31%	0.313	25%	0.248	S	C	.	.	H	α-helix	trans	-56	-51.4	174.4	-173.4	-171	156.3	0	0	111.1	I494 I495 K500 G501 Y530	I494-E498 WeakPolarHBondContact O-CB 3.43Å; I494-E498 PolarHBondContact O-N 3.27Å; I495-E498 PolarHBondContact O-N 3.35Å; E498-K500 PolarHBondContact O-N 3.1Å; E498-G501 PolarHBondContact O-N 2.86Å; E498-G501 VanDerWaalsContact O-N 3.14Å; E498-Y530 WeakPolarHBondContact CA-OH 3.22Å; E498-Y530 HydrophobicContact CB-CE2 4.03Å; E498-Y530 HydrophobicContact CG-CE2 4.06Å
499	K	88.6	Confident	90.4	Very high	109 Å²	109	44.3 Å²	44.3	47%	0.474	22%	0.22	S	C	.	.	H	α-helix	trans	-69.4	-16.1	179.8	-68	-60.6	-174	-172.8	0	114.3	I495 L496 Y497	I495-K499 HydrophobicContact CG2-CG 4.47Å; I495-K499 WeakPolarHBondContact O-CB 3.48Å; I495-K499 WeakPolarHBondContact O-CG 3.3Å; I495-K499 PolarHBondContact O-N 3.47Å; L496-K499 PolarHBondContact O-N 3.24Å; Y497-K499 PolarHBondContact O-N 3.22Å
500	K	87.8	Confident	90.4	Very high	72 Å²	72	41.1 Å²	41.1	31%	0.313	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	3.6	175.1	-64.5	-65.6	179	-170.5	0	113.2	N473 I477 L496 Y497 E498 L502	N473-K500 PolarHBondContact O-NZ 3.01Å; I477-K500 HydrophobicContact CD1-CB 4.47Å; I477-K500 HydrophobicContact CD1-CD 4.21Å; I477-K500 HydrophobicContact CD1-CG 4.25Å; I477-K500 HydrophobicContact CG1-CD 4.33Å; I477-K500 HydrophobicContact CG1-CG 4.28Å; L496-K500 HydrophobicContact CD1-CG 4.26Å; L496-K500 WeakPolarHBondContact O-CB 3.43Å; L496-K500 VanDerWaalsContact O-CG 3.25Å; L496-K500 WeakPolarHBondContact O-CG 3.47Å; L496-K500 PolarHBondContact O-N 3.14Å; L496-K500 VanDerWaalsContact O-N 3.1Å; Y497-K500 CarbonylContact O-C 2.98Å; Y497-K500 PolarHBondContact O-N 2.95Å; E498-K500 PolarHBondContact O-N 3.1Å; K500-L502 HydrophobicContact CB-CD1 4.29Å; K500-L502 HydrophobicContact CB-CG 4.24Å; K500-L502 PolarHBondContact O-N 3.24Å
501	G	87.4	Confident	90.4	Very high	45 Å²	45	41.9 Å²	41.9	46%	0.464	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.4	15.1	-178.5	0	0	0	0	0	114.4	Y497 E498 H503	Y497-G501 PolarHBondContact O-N 3.48Å; E498-G501 PolarHBondContact O-N 2.86Å; E498-G501 VanDerWaalsContact O-N 3.14Å; G501-H503 VanDerWaalsContact C-N 3.26Å; G501-H503 PolarHBondContact O-N 2.86Å; G501-H503 VanDerWaalsContact O-N 3.15Å
502	L	91.5	Very high	90.4	Very high	56 Å²	56	44.2 Å²	44.2	29%	0.293	22%	0.223	S	C	.	.			trans	-90	55	-178.3	-62.1	176.8	0	0	0	111.1	I477 Y497 K500 Q504 K505 A506	I477-L502 HydrophobicContact CD1-CD1 4.46Å; I477-L502 HydrophobicContact CG2-CD1 4.07Å; Y497-L502 HydrophobicContact CD1-CB 4.03Å; Y497-L502 HydrophobicContact CD1-CD1 3.97Å; Y497-L502 HydrophobicContact CE1-CD1 4.37Å; Y497-L502 HydrophobicContact CG-CB 4.35Å; Y497-L502 PolarHBondContact O-N 3.32Å; K500-L502 HydrophobicContact CB-CD1 4.29Å; K500-L502 HydrophobicContact CB-CG 4.24Å; K500-L502 PolarHBondContact O-N 3.24Å; L502-Q504 PolarHBondContact O-N 2.99Å; L502-K505 HydrophobicContact CB-CB 4.49Å; L502-K505 HydrophobicContact CD1-CD 4.49Å; L502-K505 PolarHBondContact O-N 3.01Å; L502-A506 PolarHBondContact O-N 3.42Å
503	H	92.2	Very high	90.3	Very high	31 Å²	31	43 Å²	43	14%	0.144	22%	0.218	C	C	.	.	H	α-helix	trans	-61.1	-37.6	-170.1	-58.9	-57.1	0	0	0	113.9	G501 K505 A506 L507 Y530 L534 I541	G501-H503 VanDerWaalsContact C-N 3.26Å; G501-H503 PolarHBondContact O-N 2.86Å; G501-H503 VanDerWaalsContact O-N 3.15Å; H503-K505 PolarHBondContact O-N 3.46Å; H503-A506 WeakPolarHBondContact O-CB 3.47Å; H503-A506 PolarHBondContact O-N 3.17Å; H503-L507 PolarHBondContact O-N 2.71Å; H503-Y530 HydrophobicContact CB-CE1 4.39Å; H503-Y530 AromaticContact ND1-CZ 3.87Å; H503-Y530 PolarHBondContact ND1-OH 3.27Å; H503-L534 HydrophobicContact CB-CD2 4.02Å; H503-L534 VanDerWaalsContact CG-CD2 3.46Å; H503-L534 VanDerWaalsContact ND1-CD2 3.3Å; H503-L534 WeakPolarHBondContact ND1-CD2 3.14Å; H503-I541 HydrophobicContact CB-CD1 3.99Å
504	Q	91.3	Very high	90	Very high	99 Å²	99	43.8 Å²	43.8	46%	0.463	22%	0.223	S	C	.	.	H	α-helix	trans	-61.9	-43.4	177.7	-164.7	176.2	24.1	0	0	111.7	L502 A506 L507 M508 F545	L502-Q504 PolarHBondContact O-N 2.99Å; Q504-A506 VanDerWaalsContact C-N 3.33Å; Q504-A506 PolarHBondContact O-N 3.32Å; Q504-L507 PolarHBondContact O-N 3.16Å; Q504-M508 WeakPolarHBondContact O-CB 3.38Å; Q504-M508 VanDerWaalsContact O-CG 3.28Å; Q504-M508 WeakPolarHBondContact O-CG 3.33Å; Q504-M508 PolarHBondContact O-N 3.23Å; Q504-F545 HydrophobicContact CG-CE2 3.99Å; Q504-F545 HydrophobicContact CG-CZ 3.98Å
505	K	91.1	Very high	89.7	Confident	94 Å²	94	48.7 Å²	48.7	41%	0.409	25%	0.254	S	S	.	.	H	α-helix	trans	-64.6	-37.7	175.7	-69.8	-171	174.8	-173	0	111.9	E481 Y497 L502 H503 V509	E481-K505 IonicContact OE2-NZ 2.73Å; Y497-K505 HydrophobicContact CD1-CB 4.31Å; Y497-K505 HydrophobicContact CD2-CB 3.93Å; Y497-K505 HydrophobicContact CE1-CB 4.21Å; Y497-K505 HydrophobicContact CE1-CD 3.98Å; Y497-K505 HydrophobicContact CE2-CB 3.8Å; Y497-K505 HydrophobicContact CG-CB 4.18Å; L502-K505 HydrophobicContact CB-CB 4.49Å; L502-K505 HydrophobicContact CD1-CD 4.49Å; L502-K505 PolarHBondContact O-N 3.01Å; H503-K505 PolarHBondContact O-N 3.46Å; K505-V509 WeakPolarHBondContact O-CG2 3.48Å; K505-V509 PolarHBondContact O-N 3.32Å; K505-V509 VanDerWaalsContact O-N 3.15Å
506	A	92.1	Very high	89.4	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62.6	-47.6	176.1	0	0	0	0	0	112.1	I494 Y497 L502 H503 Q504 V509 L510 Y530	I494-A506 HydrophobicContact CG2-CB 4.41Å; Y497-A506 HydrophobicContact CD2-CB 4.25Å; L502-A506 PolarHBondContact O-N 3.42Å; H503-A506 WeakPolarHBondContact O-CB 3.47Å; H503-A506 PolarHBondContact O-N 3.17Å; Q504-A506 VanDerWaalsContact C-N 3.33Å; Q504-A506 PolarHBondContact O-N 3.32Å; A506-V509 PolarHBondContact O-N 3.19Å; A506-L510 PolarHBondContact O-N 3.2Å; A506-Y530 HydrophobicContact CB-CE1 4.26Å; A506-Y530 HydrophobicContact CB-CE2 4.18Å; A506-Y530 WeakPolarHBondContact CB-OH 3.48Å
507	L	91.1	Very high	88.5	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-68.9	-35.1	179.6	-72.2	164.7	0	0	0	112.5	H503 Q504 V509 L510 L511 T527 Y530 L531 L534 I541 F545	H503-L507 PolarHBondContact O-N 2.71Å; Q504-L507 PolarHBondContact O-N 3.16Å; L507-V509 VanDerWaalsContact C-N 3.32Å; L507-V509 PolarHBondContact O-N 2.97Å; L507-L510 HydrophobicContact CD2-CD1 4.2Å; L507-L510 PolarHBondContact O-N 2.96Å; L507-L511 WeakPolarHBondContact O-CB 3.46Å; L507-L511 PolarHBondContact O-N 3.33Å; L507-T527 HydrophobicContact CD2-CG2 4.04Å; L507-Y530 HydrophobicContact CD1-CD1 4.47Å; L507-Y530 HydrophobicContact CD2-CD1 3.73Å; L507-Y530 HydrophobicContact CD2-CE1 4.36Å; L507-Y530 HydrophobicContact CD2-CG 4.37Å; L507-Y530 HydrophobicContact CG-CD1 3.98Å; L507-Y530 HydrophobicContact CG-CE1 4.11Å; L507-L531 HydrophobicContact CD1-CD2 3.69Å; L507-L531 HydrophobicContact CD2-CD2 3.7Å; L507-L531 HydrophobicContact CD2-CG 4.1Å; L507-L531 HydrophobicContact CG-CD2 4.36Å; L507-L534 HydrophobicContact CD1-CD1 4.18Å; L507-I541 HydrophobicContact CD1-CG2 3.29Å; L507-F545 HydrophobicContact CB-CD1 3.66Å; L507-F545 HydrophobicContact CB-CD2 4.26Å; L507-F545 HydrophobicContact CB-CE1 3.74Å; L507-F545 HydrophobicContact CB-CE2 4.35Å; L507-F545 HydrophobicContact CB-CG 3.93Å; L507-F545 HydrophobicContact CB-CZ 4.1Å; L507-F545 HydrophobicContact CD1-CB 4.11Å; L507-F545 HydrophobicContact CD1-CD1 4.47Å; L507-F545 HydrophobicContact CD1-CD2 3.8Å; L507-F545 HydrophobicContact CD1-CE2 4.35Å; L507-F545 HydrophobicContact CD1-CG 3.87Å; L507-F545 HydrophobicContact CG-CG 4.4Å
508	M	91	Very high	87.7	Confident	114 Å²	114	62.7 Å²	62.7	56%	0.562	34%	0.336	S	S	*	.	H	α-helix	trans	-60.4	-40.7	170.9	-75.6	-176.9	75.7	0	0	112.2	Q504 L511 D512 F545	Q504-M508 WeakPolarHBondContact O-CB 3.38Å; Q504-M508 VanDerWaalsContact O-CG 3.28Å; Q504-M508 WeakPolarHBondContact O-CG 3.33Å; Q504-M508 PolarHBondContact O-N 3.23Å; M508-L511 PolarHBondContact O-N 2.66Å; M508-D512 WeakPolarHBondContact O-CB 3.28Å; M508-D512 PolarHBondContact O-N 3.5Å; M508-F545 HydrophobicContact CG-CE1 4.31Å; M508-F545 HydrophobicContact CG-CZ 4.21Å
509	V	90.1	Very high	87.4	Confident	16 Å²	16	60.1 Å²	60.1	10%	0.097	33%	0.325	C	S	.	.	H	α-helix	trans	-65.9	-43.3	175.1	172.6	0	0	0	0	110.7	Y490 L493 I494 Y497 K505 A506 L507 L511 D512 Q513	Y490-V509 HydrophobicContact CD1-CG1 4.01Å; Y490-V509 HydrophobicContact CG-CG1 4.46Å; L493-V509 HydrophobicContact CD2-CG2 4.18Å; I494-V509 HydrophobicContact CD1-CG1 4.39Å; I494-V509 HydrophobicContact CG1-CG1 4.25Å; Y497-V509 HydrophobicContact CE2-CG2 4.08Å; K505-V509 WeakPolarHBondContact O-CG2 3.48Å; K505-V509 PolarHBondContact O-N 3.32Å; K505-V509 VanDerWaalsContact O-N 3.15Å; A506-V509 PolarHBondContact O-N 3.19Å; L507-V509 VanDerWaalsContact C-N 3.32Å; L507-V509 PolarHBondContact O-N 2.97Å; V509-L511 VanDerWaalsContact C-N 3.33Å; V509-L511 PolarHBondContact O-N 2.96Å; V509-D512 PolarHBondContact O-N 3.47Å; V509-Q513 HydrophobicContact CG1-CG 4.16Å; V509-Q513 VanDerWaalsContact O-CB 3.32Å; V509-Q513 WeakPolarHBondContact O-CB 3.43Å; V509-Q513 WeakPolarHBondContact O-CG 3.34Å; V509-Q513 PolarHBondContact O-N 3.48Å
510	L	90.4	Very high	86.8	Confident	3 Å²	3	59.9 Å²	59.9	2%	0.016	34%	0.335	C	S	.	.	H	α-helix	trans	-59.5	-43.3	175.4	-77.6	167.7	0	0	0	111.9	I494 A506 L507 Q513 S514 L521 R526 Y530	I494-L510 HydrophobicContact CD1-CD1 4.48Å; I494-L510 HydrophobicContact CD1-CD2 3.53Å; I494-L510 HydrophobicContact CD1-CG 3.69Å; I494-L510 HydrophobicContact CG1-CG 4.38Å; A506-L510 PolarHBondContact O-N 3.2Å; L507-L510 HydrophobicContact CD2-CD1 4.2Å; L507-L510 PolarHBondContact O-N 2.96Å; L510-Q513 PolarHBondContact O-N 3.5Å; L510-S514 WeakPolarHBondContact O-CB 3.32Å; L510-S514 PolarHBondContact O-N 2.99Å; L510-L521 HydrophobicContact CD2-CD2 4.32Å; L510-R526 HydrophobicContact CD2-CB 3.86Å; L510-Y530 HydrophobicContact CD1-CD2 4.34Å; L510-Y530 HydrophobicContact CD1-CG 4.15Å
511	L	89.7	Confident	86.6	Confident	70 Å²	70	56.7 Å²	56.7	37%	0.366	32%	0.321	S	S	.	.	H	α-helix	trans	-63.7	-49.4	177.3	-176.8	63.9	0	0	0	111.9	L507 M508 V509 Q513 S514 W548	L507-L511 WeakPolarHBondContact O-CB 3.46Å; L507-L511 PolarHBondContact O-N 3.33Å; M508-L511 PolarHBondContact O-N 2.66Å; V509-L511 VanDerWaalsContact C-N 3.33Å; V509-L511 PolarHBondContact O-N 2.96Å; L511-Q513 VanDerWaalsContact C-N 3.27Å; L511-Q513 PolarHBondContact O-N 2.79Å; L511-S514 PolarHBondContact O-N 2.95Å; L511-S514 PolarHBondContact O-OG 2.84Å; L511-W548 HydrophobicContact CD1-CD2 3.86Å; L511-W548 HydrophobicContact CD1-CE3 4.41Å; L511-W548 HydrophobicContact CD1-CG 4.01Å; L511-W548 HydrophobicContact CD1-CZ2 4.31Å
512	D	87.9	Confident	86.5	Confident	82 Å²	82	60.9 Å²	60.9	44%	0.439	33%	0.326	S	S	.	.	H	α-helix	trans	-60.9	-35	177.2	167.8	69.2	0	0	0	112.5	M508 V509 K516	M508-D512 WeakPolarHBondContact O-CB 3.28Å; M508-D512 PolarHBondContact O-N 3.5Å; V509-D512 PolarHBondContact O-N 3.47Å; D512-K516 VanDerWaalsContact O-CE 3.29Å; D512-K516 WeakPolarHBondContact O-CE 3.18Å; D512-K516 IonicContact OD1-NZ 2.66Å; D512-K516 PolarHBondContact OD1-NZ 3.28Å; D512-K516 IonicContact OD2-NZ 3.65Å; D512-K516 PolarHBondContact OD2-NZ 3.44Å
513	Q	88.9	Confident	86.2	Confident	7 Å²	7	59.6 Å²	59.6	3%	0.033	33%	0.327	C	S	.	.	H	α-helix	trans	-82.9	-23.6	179.9	-65.6	-61.3	-50.6	0	0	113.6	Y490 V509 L510 L511 T515 K516 S519 L521	Y490-Q513 HydrophobicContact CD2-CG 4.47Å; Y490-Q513 HydrophobicContact CG-CG 4.24Å; V509-Q513 HydrophobicContact CG1-CG 4.16Å; V509-Q513 VanDerWaalsContact O-CB 3.32Å; V509-Q513 WeakPolarHBondContact O-CB 3.43Å; V509-Q513 WeakPolarHBondContact O-CG 3.34Å; V509-Q513 PolarHBondContact O-N 3.48Å; L510-Q513 PolarHBondContact O-N 3.5Å; L511-Q513 VanDerWaalsContact C-N 3.27Å; L511-Q513 PolarHBondContact O-N 2.79Å; Q513-T515 PolarHBondContact O-N 3.48Å; Q513-K516 VanDerWaalsContact NE2-NZ 3.18Å; Q513-K516 PolarHBondContact O-N 2.84Å; Q513-K516 VanDerWaalsContact O-N 3.11Å; Q513-S519 PolarHBondContact OE1-OG 2.9Å; Q513-L521 HydrophobicContact CB-CB 4Å; Q513-L521 HydrophobicContact CB-CD1 4.38Å; Q513-L521 HydrophobicContact CG-CD1 4.37Å
514	S	85.5	Confident	85.9	Confident	15 Å²	15	59.8 Å²	59.8	11%	0.105	33%	0.328	C	S	.	.	H	α-helix	trans	-59.1	-30.9	-176.6	70.2	0	0	0	0	113.7	L510 L511 G523	L510-S514 WeakPolarHBondContact O-CB 3.32Å; L510-S514 PolarHBondContact O-N 2.99Å; L511-S514 PolarHBondContact O-N 2.95Å; L511-S514 PolarHBondContact O-OG 2.84Å; S514-G523 PolarHBondContact O-N 2.86Å
515	T	83.3	Confident	85.8	Confident	117 Å²	117	61.3 Å²	61.3	72%	0.718	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-9	-178.1	59.5	0	0	0	0	113.7	Q513	Q513-T515 PolarHBondContact O-N 3.48Å
516	K	85.5	Confident	85.6	Confident	79 Å²	79	63.5 Å²	63.5	34%	0.343	34%	0.34	S	S	.	.			trans	-87.2	120	-174.3	-67.6	177.3	-174.2	166.7	0	110.9	D512 Q513 N518 S519	D512-K516 VanDerWaalsContact O-CE 3.29Å; D512-K516 WeakPolarHBondContact O-CE 3.18Å; D512-K516 IonicContact OD1-NZ 2.66Å; D512-K516 PolarHBondContact OD1-NZ 3.28Å; D512-K516 IonicContact OD2-NZ 3.65Å; D512-K516 PolarHBondContact OD2-NZ 3.44Å; Q513-K516 VanDerWaalsContact NE2-NZ 3.18Å; Q513-K516 PolarHBondContact O-N 2.84Å; Q513-K516 VanDerWaalsContact O-N 3.11Å; K516-N518 VanDerWaalsContact C-N 3.28Å; K516-N518 PolarHBondContact O-N 3.18Å; K516-S519 PolarHBondContact O-N 3.3Å
517	A	72	Confident	85.5	Confident	73 Å²	73	63.6 Å²	63.6	60%	0.603	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-33.4	-172.6	0	0	0	0	0	114.8
518	N	75.5	Confident	85.5	Confident	166 Å²	166	64 Å²	64	89%	0.888	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	13.2	-176.6	-65.6	-15.1	0	0	0	113.5	K516	K516-N518 VanDerWaalsContact C-N 3.28Å; K516-N518 PolarHBondContact O-N 3.18Å
519	S	82.4	Confident	85.4	Confident	14 Å²	14	62.5 Å²	62.5	10%	0.098	34%	0.335	C	S	.	.			trans	-84.7	136.7	-179.9	-169.1	0	0	0	0	111.4	Q513 K516 L521 K522	Q513-S519 PolarHBondContact OE1-OG 2.9Å; K516-S519 PolarHBondContact O-N 3.3Å; S519-L521 PolarHBondContact O-N 3.24Å; S519-L521 VanDerWaalsContact O-N 3.1Å; S519-L521 PolarHBondContact OG-N 3.22Å; S519-K522 WeakPolarHBondContact O-CB 3.35Å; S519-K522 PolarHBondContact O-N 3.31Å
520	P	76.6	Confident	85.4	Confident	104 Å²	104	62.7 Å²	62.7	68%	0.675	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-8	171.6	29.6	-35.4	0	0	0	112.8
521	L	83.9	Confident	85.4	Confident	4 Å²	4	62.6 Å²	62.6	2%	0.021	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	19.9	179.1	-58.6	170.5	0	0	0	111.9	I494 L510 Q513 S519 R526	I494-L521 HydrophobicContact CD1-CD1 3.48Å; I494-L521 VanDerWaalsContact CD1-CD1 3.48Å; I494-L521 HydrophobicContact CD1-CD2 4.25Å; I494-L521 HydrophobicContact CD1-CG 4.5Å; L510-L521 HydrophobicContact CD2-CD2 4.32Å; Q513-L521 HydrophobicContact CB-CB 4Å; Q513-L521 HydrophobicContact CB-CD1 4.38Å; Q513-L521 HydrophobicContact CG-CD1 4.37Å; S519-L521 PolarHBondContact O-N 3.24Å; S519-L521 VanDerWaalsContact O-N 3.1Å; S519-L521 PolarHBondContact OG-N 3.22Å; L521-R526 HydrophobicContact CD2-CG 4.26Å
522	K	84.7	Confident	85.5	Confident	133 Å²	133	60 Å²	60	58%	0.578	32%	0.32	S	S	*	.			trans	-64	140.9	177.6	-175.7	-176.7	177.9	-172.7	0	110.7	S519	S519-K522 WeakPolarHBondContact O-CB 3.35Å; S519-K522 PolarHBondContact O-N 3.31Å
523	G	85.8	Confident	85.5	Confident	29 Å²	29	63.7 Å²	63.7	30%	0.299	33%	0.328	S	S	.	.	S	Bend	trans	92.5	-176.9	177.6	0	0	0	0	0	114.3	S514	S514-G523 PolarHBondContact O-N 2.86Å
524	H	85.9	Confident	85.4	Confident	35 Å²	35	64.1 Å²	64.1	16%	0.162	33%	0.33	C	S	.	.	S	Bend	trans	-95.5	-17.2	-173.5	56.4	-70.5	0	0	0	114.3	R526 T527 V528 W548 V549 D556	H524-R526 PolarHBondContact O-N 2.72Å; H524-T527 WeakPolarHBondContact O-CB 3.27Å; H524-T527 PolarHBondContact O-N 3.12Å; H524-V528 PolarHBondContact O-N 3.44Å; H524-W548 HydrophobicContact CB-CH2 3.8Å; H524-W548 HydrophobicContact CB-CZ3 4.07Å; H524-V549 HydrophobicContact CB-CG1 3.95Å; H524-V549 HydrophobicContact CB-CG2 4.16Å; H524-D556 IonicContact CD2-OD2 3.93Å; H524-D556 IonicContact CE1-OD2 3.89Å; H524-D556 IonicContact NE2-OD2 3.64Å; H524-D556 PolarHBondContact NE2-OD2 3.44Å
525	E	88.3	Confident	85.3	Confident	132 Å²	132	63.9 Å²	63.9	62%	0.617	33%	0.33	S	S	*	.	H	α-helix	trans	-53.4	-47.6	-174.2	-63.1	176.2	-171.6	0	0	113.9	T527 V528 Q529	E525-T527 VanDerWaalsContact C-N 3.3Å; E525-T527 PolarHBondContact O-N 3.26Å; E525-V528 PolarHBondContact O-N 2.87Å; E525-Q529 WeakPolarHBondContact O-CG 3.47Å; E525-Q529 PolarHBondContact O-N 3.4Å
526	R	87.9	Confident	85.4	Confident	139 Å²	139	60.7 Å²	60.7	53%	0.525	31%	0.313	S	S	.	.	H	α-helix	trans	-67.5	-31	179.9	-73.3	-63.2	-171.2	123.6	0.8	112.9	L510 L521 H524 Y530	L510-R526 HydrophobicContact CD2-CB 3.86Å; L521-R526 HydrophobicContact CD2-CG 4.26Å; H524-R526 PolarHBondContact O-N 2.72Å; R526-Y530 WeakPolarHBondContact O-CB 3.41Å; R526-Y530 PolarHBondContact O-N 3.15Å
527	T	89.9	Confident	85.4	Confident	3 Å²	3	65.8 Å²	65.8	2%	0.018	34%	0.338	C	S	.	.	H	α-helix	trans	-70.3	-43.7	175.7	-56.2	0	0	0	0	110.4	L507 H524 E525 Q529 Y530 L531 W548 V549	L507-T527 HydrophobicContact CD2-CG2 4.04Å; H524-T527 WeakPolarHBondContact O-CB 3.27Å; H524-T527 PolarHBondContact O-N 3.12Å; E525-T527 VanDerWaalsContact C-N 3.3Å; E525-T527 PolarHBondContact O-N 3.26Å; T527-Q529 PolarHBondContact O-N 2.95Å; T527-Y530 PolarHBondContact O-N 3.16Å; T527-L531 HydrophobicContact CG2-CD1 4.02Å; T527-L531 HydrophobicContact CG2-CG 4.29Å; T527-L531 WeakPolarHBondContact O-CB 3.41Å; T527-L531 VanDerWaalsContact O-CG 3.29Å; T527-L531 WeakPolarHBondContact O-CG 3.25Å; T527-L531 PolarHBondContact O-N 3.19Å; T527-W548 HydrophobicContact CG2-CZ2 3.82Å; T527-V549 HydrophobicContact CG2-CG2 4.27Å
528	V	89.5	Confident	86.1	Confident	9 Å²	9	64.2 Å²	64.2	6%	0.055	32%	0.319	C	S	.	.	H	α-helix	trans	-56.7	-52.5	174	174	0	0	0	0	110.5	H524 E525 Y530 L531 Q532 V549 K559 I560	H524-V528 PolarHBondContact O-N 3.44Å; E525-V528 PolarHBondContact O-N 2.87Å; V528-Y530 VanDerWaalsContact C-N 3.28Å; V528-Y530 PolarHBondContact O-N 3.23Å; V528-L531 PolarHBondContact O-N 3.46Å; V528-Q532 HydrophobicContact CG1-CG 4.35Å; V528-Q532 WeakPolarHBondContact O-CB 3.43Å; V528-Q532 VanDerWaalsContact O-CG 3.28Å; V528-Q532 WeakPolarHBondContact O-CG 3.4Å; V528-Q532 PolarHBondContact O-N 3.23Å; V528-V549 HydrophobicContact CG2-CG1 3.79Å; V528-K559 HydrophobicContact CG1-CB 4.46Å; V528-I560 HydrophobicContact CB-CG1 4.26Å; V528-I560 HydrophobicContact CG1-CG1 3.92Å; V528-I560 HydrophobicContact CG2-CD1 4.24Å; V528-I560 HydrophobicContact CG2-CG1 4.05Å
529	Q	89.6	Confident	86.7	Confident	82 Å²	82	57.2 Å²	57.2	38%	0.383	28%	0.282	S	S	.	.	H	α-helix	trans	-59.6	-35.8	178.7	-70.5	174.5	6.6	0	0	113.2	E525 T527 R533	E525-Q529 WeakPolarHBondContact O-CG 3.47Å; E525-Q529 PolarHBondContact O-N 3.4Å; T527-Q529 PolarHBondContact O-N 2.95Å; Q529-R533 WeakPolarHBondContact O-CG 3.42Å
530	Y	90.7	Very high	87	Confident	20 Å²	20	59.2 Å²	59.2	8%	0.078	30%	0.304	C	S	.	.	H	α-helix	trans	-70.2	-47.1	177.7	-165.2	-84.9	0	0	0	111.1	I494 E498 H503 A506 L507 L510 R526 T527 V528 Q532 R533 L534	I494-Y530 HydrophobicContact CG2-CD2 4.06Å; I494-Y530 HydrophobicContact CG2-CE2 3.79Å; E498-Y530 WeakPolarHBondContact CA-OH 3.22Å; E498-Y530 HydrophobicContact CB-CE2 4.03Å; E498-Y530 HydrophobicContact CG-CE2 4.06Å; H503-Y530 HydrophobicContact CB-CE1 4.39Å; H503-Y530 AromaticContact ND1-CZ 3.87Å; H503-Y530 PolarHBondContact ND1-OH 3.27Å; A506-Y530 HydrophobicContact CB-CE1 4.26Å; A506-Y530 HydrophobicContact CB-CE2 4.18Å; A506-Y530 WeakPolarHBondContact CB-OH 3.48Å; L507-Y530 HydrophobicContact CD1-CD1 4.47Å; L507-Y530 HydrophobicContact CD2-CD1 3.73Å; L507-Y530 HydrophobicContact CD2-CE1 4.36Å; L507-Y530 HydrophobicContact CD2-CG 4.37Å; L507-Y530 HydrophobicContact CG-CD1 3.98Å; L507-Y530 HydrophobicContact CG-CE1 4.11Å; L510-Y530 HydrophobicContact CD1-CD2 4.34Å; L510-Y530 HydrophobicContact CD1-CG 4.15Å; R526-Y530 WeakPolarHBondContact O-CB 3.41Å; R526-Y530 PolarHBondContact O-N 3.15Å; T527-Y530 PolarHBondContact O-N 3.16Å; V528-Y530 VanDerWaalsContact C-N 3.28Å; V528-Y530 PolarHBondContact O-N 3.23Å; Y530-Q532 VanDerWaalsContact C-N 3.35Å; Y530-Q532 PolarHBondContact O-N 2.92Å; Y530-R533 PolarHBondContact O-N 3.28Å; Y530-L534 HydrophobicContact CD1-CD1 4.12Å; Y530-L534 HydrophobicContact CD1-CD2 4.35Å; Y530-L534 HydrophobicContact CD1-CG 4.18Å; Y530-L534 HydrophobicContact CE1-CD1 4.12Å; Y530-L534 HydrophobicContact CE1-CD2 3.82Å; Y530-L534 HydrophobicContact CE1-CG 4.13Å
531	L	90.4	Very high	87.6	Confident	1 Å²	1	56 Å²	56	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-63.5	-38.5	-179.9	-69.3	-179.9	0	0	0	112.4	L507 T527 V528 R533 L534 I542 F545 I560	L507-L531 HydrophobicContact CD1-CD2 3.69Å; L507-L531 HydrophobicContact CD2-CD2 3.7Å; L507-L531 HydrophobicContact CD2-CG 4.1Å; L507-L531 HydrophobicContact CG-CD2 4.36Å; T527-L531 HydrophobicContact CG2-CD1 4.02Å; T527-L531 HydrophobicContact CG2-CG 4.29Å; T527-L531 WeakPolarHBondContact O-CB 3.41Å; T527-L531 VanDerWaalsContact O-CG 3.29Å; T527-L531 WeakPolarHBondContact O-CG 3.25Å; T527-L531 PolarHBondContact O-N 3.19Å; V528-L531 PolarHBondContact O-N 3.46Å; L531-R533 PolarHBondContact O-N 2.96Å; L531-L534 HydrophobicContact CD2-CD1 3.87Å; L531-L534 PolarHBondContact O-N 3.23Å; L531-I542 HydrophobicContact CD2-CG1 4.41Å; L531-F545 HydrophobicContact CD1-CB 4.41Å; L531-F545 HydrophobicContact CD2-CB 4.26Å; L531-I560 HydrophobicContact CB-CG2 3.91Å; L531-I560 HydrophobicContact CD1-CD1 3.9Å; L531-I560 HydrophobicContact CD1-CG2 4.43Å
532	Q	90.3	Very high	87.8	Confident	16 Å²	16	55.8 Å²	55.8	8%	0.075	28%	0.28	C	S	.	.	H	α-helix	trans	-59.4	-28.3	176	-75.4	171.1	-28.3	0	0	113.2	V528 Y530 K559 E563 L565 E567 V568	V528-Q532 HydrophobicContact CG1-CG 4.35Å; V528-Q532 WeakPolarHBondContact O-CB 3.43Å; V528-Q532 VanDerWaalsContact O-CG 3.28Å; V528-Q532 WeakPolarHBondContact O-CG 3.4Å; V528-Q532 PolarHBondContact O-N 3.23Å; Y530-Q532 VanDerWaalsContact C-N 3.35Å; Y530-Q532 PolarHBondContact O-N 2.92Å; Q532-K559 PolarHBondContact NE2-O 2.92Å; Q532-E563 VanDerWaalsContact NE2-CB 3.31Å; Q532-L565 HydrophobicContact CB-CD1 3.83Å; Q532-L565 HydrophobicContact CG-CD1 4.37Å; Q532-E567 WeakPolarHBondContact O-CB 3.24Å; Q532-V568 HydrophobicContact CB-CG2 4Å; Q532-V568 HydrophobicContact CG-CG2 4.1Å
533	R	88.8	Confident	88.1	Confident	159 Å²	159	51.4 Å²	51.4	60%	0.6	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-8.9	-177	-67.1	176	-173.8	176.4	3.5	114.7	Q529 Y530 L531 G535	Q529-R533 WeakPolarHBondContact O-CG 3.42Å; Y530-R533 PolarHBondContact O-N 3.28Å; L531-R533 PolarHBondContact O-N 2.96Å; R533-G535 VanDerWaalsContact C-N 3.31Å; R533-G535 PolarHBondContact O-N 3.49Å
534	L	86	Confident	88.3	Confident	16 Å²	16	55.2 Å²	55.2	8%	0.084	27%	0.272	C	S	.	.	S	Bend	trans	-74.8	-19.9	-174.8	-76.9	179.4	0	0	0	113.8	H503 L507 Y530 L531 N538 I541 I542	H503-L534 HydrophobicContact CB-CD2 4.02Å; H503-L534 VanDerWaalsContact CG-CD2 3.46Å; H503-L534 VanDerWaalsContact ND1-CD2 3.3Å; H503-L534 WeakPolarHBondContact ND1-CD2 3.14Å; L507-L534 HydrophobicContact CD1-CD1 4.18Å; Y530-L534 HydrophobicContact CD1-CD1 4.12Å; Y530-L534 HydrophobicContact CD1-CD2 4.35Å; Y530-L534 HydrophobicContact CD1-CG 4.18Å; Y530-L534 HydrophobicContact CE1-CD1 4.12Å; Y530-L534 HydrophobicContact CE1-CD2 3.82Å; Y530-L534 HydrophobicContact CE1-CG 4.13Å; L531-L534 HydrophobicContact CD2-CD1 3.87Å; L531-L534 PolarHBondContact O-N 3.23Å; L534-N538 HydrophobicContact CB-CB 3.95Å; L534-N538 PolarHBondContact O-ND2 3.02Å; L534-I541 HydrophobicContact CD1-CG2 4.19Å; L534-I542 HydrophobicContact CB-CD1 4.13Å; L534-I542 HydrophobicContact CB-CG1 4.18Å; L534-I542 HydrophobicContact CD1-CG1 4.27Å
535	G	84.4	Confident	88.5	Confident	10 Å²	10	54.3 Å²	54.3	10%	0.103	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	-177.8	178.7	0	0	0	0	0	114.7	R533 E537 N538 I542	R533-G535 VanDerWaalsContact C-N 3.31Å; R533-G535 PolarHBondContact O-N 3.49Å; G535-E537 VanDerWaalsContact C-N 3.32Å; G535-E537 PolarHBondContact O-N 3.4Å; G535-N538 PolarHBondContact O-N 3.29Å; G535-I542 WeakPolarHBondContact O-CD1 3.44Å
536	S	85.1	Confident	88.6	Confident	51 Å²	51	48 Å²	48	36%	0.357	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-66.6	-27.1	-175.3	59.4	0	0	0	0	114.7	N538 L539 T570	S536-N538 PolarHBondContact O-N 2.92Å; S536-L539 WeakPolarHBondContact O-CB 3.33Å; S536-L539 PolarHBondContact O-N 3.18Å; S536-T570 WeakPolarHBondContact CB-O 3.24Å
537	E	84.9	Confident	88.7	Confident	186 Å²	186	43 Å²	43	87%	0.869	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-60.6	-28.9	178.4	-62.5	-172.1	167.4	0	0	112.7	G535	G535-E537 VanDerWaalsContact C-N 3.32Å; G535-E537 PolarHBondContact O-N 3.4Å
538	N	88.4	Confident	88.7	Confident	40 Å²	40	45.2 Å²	45.2	21%	0.214	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-109	22.6	-177	-66.9	-70.3	0	0	0	112.7	L534 G535 S536 G540 I541 I542	L534-N538 HydrophobicContact CB-CB 3.95Å; L534-N538 PolarHBondContact O-ND2 3.02Å; G535-N538 PolarHBondContact O-N 3.29Å; S536-N538 PolarHBondContact O-N 2.92Å; N538-G540 PolarHBondContact O-N 3.49Å; N538-G540 VanDerWaalsContact O-N 3.1Å; N538-I541 WeakPolarHBondContact O-CB 3.18Å; N538-I541 PolarHBondContact O-N 3.39Å; N538-I542 PolarHBondContact O-N 2.99Å; N538-I542 VanDerWaalsContact O-N 3.14Å
539	L	87.1	Confident	88.6	Confident	19 Å²	19	44.8 Å²	44.8	10%	0.099	23%	0.229	C	C	.	.	H	α-helix	trans	-50.7	-38.6	-177.6	-179.5	68.3	0	0	0	113.1	S536 I541 I542 L543 L571 P572 K575 V576	S536-L539 WeakPolarHBondContact O-CB 3.33Å; S536-L539 PolarHBondContact O-N 3.18Å; L539-I541 VanDerWaalsContact C-N 3.32Å; L539-I541 PolarHBondContact O-N 3.47Å; L539-I542 PolarHBondContact O-N 3.49Å; L539-L543 HydrophobicContact CD1-CD1 4.21Å; L539-L543 HydrophobicContact CD1-CD2 4.49Å; L539-L543 HydrophobicContact CD1-CG 4.16Å; L539-L543 HydrophobicContact CD2-CD1 4.47Å; L539-L543 HydrophobicContact CG-CD1 3.97Å; L539-L543 HydrophobicContact CG-CG 4.29Å; L539-L543 WeakPolarHBondContact O-CG 3.26Å; L539-L543 PolarHBondContact O-N 3.02Å; L539-L571 HydrophobicContact CD1-CD2 4.13Å; L539-P572 HydrophobicContact CD2-CG 4.09Å; L539-K575 HydrophobicContact CD2-CB 4.42Å; L539-K575 HydrophobicContact CD2-CD 3.97Å; L539-V576 HydrophobicContact CD1-CG2 4.48Å
540	G	87.7	Confident	88.4	Confident	55 Å²	55	41 Å²	41	57%	0.567	21%	0.212	S	C	*	.	H	α-helix	trans	-58.5	-42.3	177.6	0	0	0	0	0	113	N538 L543 E544	N538-G540 PolarHBondContact O-N 3.49Å; N538-G540 VanDerWaalsContact O-N 3.1Å; G540-L543 PolarHBondContact O-N 3.12Å; G540-E544 WeakPolarHBondContact O-CB 3.47Å; G540-E544 PolarHBondContact O-N 3.23Å
541	I	89.6	Confident	88.1	Confident	36 Å²	36	47.4 Å²	47.4	19%	0.185	24%	0.24	C	C	.	.	H	α-helix	trans	-69.4	-38.7	177.4	-59.3	178.1	0	0	0	110.2	H503 L507 L534 N538 L539 L543 E544 F545	H503-I541 HydrophobicContact CB-CD1 3.99Å; L507-I541 HydrophobicContact CD1-CG2 3.29Å; L534-I541 HydrophobicContact CD1-CG2 4.19Å; N538-I541 WeakPolarHBondContact O-CB 3.18Å; N538-I541 PolarHBondContact O-N 3.39Å; L539-I541 VanDerWaalsContact C-N 3.32Å; L539-I541 PolarHBondContact O-N 3.47Å; I541-L543 PolarHBondContact O-N 3.25Å; I541-E544 PolarHBondContact O-N 3.01Å; I541-F545 HydrophobicContact CG2-CD2 3.89Å; I541-F545 HydrophobicContact CG2-CE2 4.26Å; I541-F545 WeakPolarHBondContact O-CD2 3.31Å; I541-F545 PolarHBondContact O-N 3.27Å
542	I	89.6	Confident	87.7	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-60.6	-46.1	177.6	-61.4	172.4	0	0	0	110.8	L531 L534 G535 N538 L539 E544 S546 I560 F561 L571	L531-I542 HydrophobicContact CD2-CG1 4.41Å; L534-I542 HydrophobicContact CB-CD1 4.13Å; L534-I542 HydrophobicContact CB-CG1 4.18Å; L534-I542 HydrophobicContact CD1-CG1 4.27Å; G535-I542 WeakPolarHBondContact O-CD1 3.44Å; N538-I542 PolarHBondContact O-N 2.99Å; N538-I542 VanDerWaalsContact O-N 3.14Å; L539-I542 PolarHBondContact O-N 3.49Å; I542-E544 VanDerWaalsContact C-N 3.35Å; I542-S546 WeakPolarHBondContact O-CB 3.35Å; I542-S546 PolarHBondContact O-N 2.95Å; I542-S546 PolarHBondContact O-OG 3.05Å; I542-I560 HydrophobicContact CG2-CG2 3.86Å; I542-F561 HydrophobicContact CG2-CE1 3.81Å; I542-F561 HydrophobicContact CG2-CZ 4.32Å; I542-L571 HydrophobicContact CD1-CD2 3.91Å
543	L	89.6	Confident	87.4	Confident	40 Å²	40	53.8 Å²	53.8	21%	0.209	28%	0.276	C	S	.	.	H	α-helix	trans	-71.6	-28.4	179.8	-61.5	175.1	0	0	0	112.9	L539 G540 I541 P547 F561 F579	L539-L543 HydrophobicContact CD1-CD1 4.21Å; L539-L543 HydrophobicContact CD1-CD2 4.49Å; L539-L543 HydrophobicContact CD1-CG 4.16Å; L539-L543 HydrophobicContact CD2-CD1 4.47Å; L539-L543 HydrophobicContact CG-CD1 3.97Å; L539-L543 HydrophobicContact CG-CG 4.29Å; L539-L543 WeakPolarHBondContact O-CG 3.26Å; L539-L543 PolarHBondContact O-N 3.02Å; G540-L543 PolarHBondContact O-N 3.12Å; I541-L543 PolarHBondContact O-N 3.25Å; L543-P547 VanDerWaalsContact O-CD 3.27Å; L543-P547 WeakPolarHBondContact O-CD 3.39Å; L543-P547 WeakPolarHBondContact O-CG 3.5Å; L543-F561 HydrophobicContact CD2-CE1 4.14Å; L543-F561 HydrophobicContact CD2-CZ 4.24Å; L543-F579 HydrophobicContact CB-CD2 4.44Å; L543-F579 HydrophobicContact CB-CE2 4.39Å; L543-F579 HydrophobicContact CD2-CB 4.04Å; L543-F579 HydrophobicContact CD2-CD1 3.79Å; L543-F579 HydrophobicContact CD2-CD2 3.98Å; L543-F579 HydrophobicContact CD2-CE1 4.19Å; L543-F579 HydrophobicContact CD2-CE2 4.35Å; L543-F579 HydrophobicContact CD2-CG 3.67Å; L543-F579 HydrophobicContact CD2-CZ 4.44Å
544	E	90.3	Very high	86.9	Confident	109 Å²	109	48.7 Å²	48.7	51%	0.509	26%	0.263	S	S	.	.	H	α-helix	trans	-71	-40.4	175.6	-174.9	-174.6	169.6	0	0	112	G540 I541 I542 P547	G540-E544 WeakPolarHBondContact O-CB 3.47Å; G540-E544 PolarHBondContact O-N 3.23Å; I541-E544 PolarHBondContact O-N 3.01Å; I542-E544 VanDerWaalsContact C-N 3.35Å; E544-P547 VanDerWaalsContact O-CD 3.29Å; E544-P547 WeakPolarHBondContact O-CD 3.43Å
545	F	90.1	Very high	86.4	Confident	16 Å²	16	54.5 Å²	54.5	7%	0.07	29%	0.29	C	S	.	.	H	α-helix	trans	-102.3	-7.9	-172.7	-74.2	-90.8	0	0	0	115.2	Q504 L507 M508 L531 I541 P547 W548	Q504-F545 HydrophobicContact CG-CE2 3.99Å; Q504-F545 HydrophobicContact CG-CZ 3.98Å; L507-F545 HydrophobicContact CB-CD1 3.66Å; L507-F545 HydrophobicContact CB-CD2 4.26Å; L507-F545 HydrophobicContact CB-CE1 3.74Å; L507-F545 HydrophobicContact CB-CE2 4.35Å; L507-F545 HydrophobicContact CB-CG 3.93Å; L507-F545 HydrophobicContact CB-CZ 4.1Å; L507-F545 HydrophobicContact CD1-CB 4.11Å; L507-F545 HydrophobicContact CD1-CD1 4.47Å; L507-F545 HydrophobicContact CD1-CD2 3.8Å; L507-F545 HydrophobicContact CD1-CE2 4.35Å; L507-F545 HydrophobicContact CD1-CG 3.87Å; L507-F545 HydrophobicContact CG-CG 4.4Å; M508-F545 HydrophobicContact CG-CE1 4.31Å; M508-F545 HydrophobicContact CG-CZ 4.21Å; L531-F545 HydrophobicContact CD1-CB 4.41Å; L531-F545 HydrophobicContact CD2-CB 4.26Å; I541-F545 HydrophobicContact CG2-CD2 3.89Å; I541-F545 HydrophobicContact CG2-CE2 4.26Å; I541-F545 WeakPolarHBondContact O-CD2 3.31Å; I541-F545 PolarHBondContact O-N 3.27Å; F545-P547 VanDerWaalsContact C-CD 3.41Å; F545-W548 PolarHBondContact O-NE1 3.23Å; F545-W548 VanDerWaalsContact O-NE1 3.07Å
546	S	89.9	Confident	86.1	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.295	C	S	.	.	S	Bend	trans	-72	-29.7	171.6	69	0	0	0	0	116.3	I542 W548 V549 L550 F579	I542-S546 WeakPolarHBondContact O-CB 3.35Å; I542-S546 PolarHBondContact O-N 2.95Å; I542-S546 PolarHBondContact O-OG 3.05Å; S546-W548 VanDerWaalsContact C-N 3.34Å; S546-W548 PolarHBondContact O-N 3.23Å; S546-V549 PolarHBondContact O-N 2.85Å; S546-V549 VanDerWaalsContact O-N 3.15Å; S546-L550 PolarHBondContact O-N 3.31Å; S546-F579 WeakPolarHBondContact OG-CZ 3.46Å
547	P	90.7	Very high	86.1	Confident	33 Å²	33	53.5 Å²	53.5	21%	0.214	28%	0.278	C	S	.	.	H	α-helix	trans	-61.3	-35.7	-169.9	-26.5	33.7	0	0	0	114.9	L543 E544 F545 V549 L550 K551 F579 F584	L543-P547 VanDerWaalsContact O-CD 3.27Å; L543-P547 WeakPolarHBondContact O-CD 3.39Å; L543-P547 WeakPolarHBondContact O-CG 3.5Å; E544-P547 VanDerWaalsContact O-CD 3.29Å; E544-P547 WeakPolarHBondContact O-CD 3.43Å; F545-P547 VanDerWaalsContact C-CD 3.41Å; P547-V549 VanDerWaalsContact C-N 3.35Å; P547-L550 PolarHBondContact O-N 3.06Å; P547-K551 WeakPolarHBondContact O-CB 3.37Å; P547-K551 VanDerWaalsContact O-CG 3.26Å; P547-K551 WeakPolarHBondContact O-CG 3.35Å; P547-K551 PolarHBondContact O-N 3.4Å; P547-F579 HydrophobicContact CG-CE2 4.35Å; P547-F579 HydrophobicContact CG-CZ 4.04Å; P547-F584 HydrophobicContact CB-CZ 4.17Å
548	W	89.1	Confident	86	Confident	50 Å²	50	46.2 Å²	46.2	19%	0.189	25%	0.245	C	C	.	.	H	α-helix	trans	-70.6	-34.7	-178.9	77.9	-89	0	0	0	111.6	L511 H524 T527 F545 S546 I552	L511-W548 HydrophobicContact CD1-CD2 3.86Å; L511-W548 HydrophobicContact CD1-CE3 4.41Å; L511-W548 HydrophobicContact CD1-CG 4.01Å; L511-W548 HydrophobicContact CD1-CZ2 4.31Å; H524-W548 HydrophobicContact CB-CH2 3.8Å; H524-W548 HydrophobicContact CB-CZ3 4.07Å; T527-W548 HydrophobicContact CG2-CZ2 3.82Å; F545-W548 PolarHBondContact O-NE1 3.23Å; F545-W548 VanDerWaalsContact O-NE1 3.07Å; S546-W548 VanDerWaalsContact C-N 3.34Å; S546-W548 PolarHBondContact O-N 3.23Å; W548-I552 HydrophobicContact CE3-CD1 3.82Å; W548-I552 HydrophobicContact CZ3-CD1 4.19Å; W548-I552 WeakPolarHBondContact O-CG1 3.35Å; W548-I552 PolarHBondContact O-N 3.46Å
549	V	88.3	Confident	85.8	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-67.8	-48.6	174.3	-177	0	0	0	0	109.6	H524 T527 V528 S546 P547 K551 I552 C553 I560	H524-V549 HydrophobicContact CB-CG1 3.95Å; H524-V549 HydrophobicContact CB-CG2 4.16Å; T527-V549 HydrophobicContact CG2-CG2 4.27Å; V528-V549 HydrophobicContact CG2-CG1 3.79Å; S546-V549 PolarHBondContact O-N 2.85Å; S546-V549 VanDerWaalsContact O-N 3.15Å; P547-V549 VanDerWaalsContact C-N 3.35Å; V549-K551 PolarHBondContact O-N 2.96Å; V549-I552 PolarHBondContact O-N 3.19Å; V549-I552 VanDerWaalsContact O-N 3.13Å; V549-C553 CarbonylContact O-C 3.2Å; V549-C553 PolarHBondContact O-N 3.15Å; V549-I560 HydrophobicContact CB-CD1 4.36Å; V549-I560 HydrophobicContact CG1-CD1 4.43Å
550	L	85.1	Confident	85.7	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-58.4	-32.7	179	-73.2	163.6	0	0	0	113.2	S546 P547 G557 L558 F561 F579 L580 F584 L587	S546-L550 PolarHBondContact O-N 3.31Å; P547-L550 PolarHBondContact O-N 3.06Å; L550-G557 VanDerWaalsContact CD2-C 3.42Å; L550-L558 HydrophobicContact CD2-CD2 4.47Å; L550-F561 HydrophobicContact CD1-CE2 4.25Å; L550-F579 HydrophobicContact CD1-CE1 3.73Å; L550-F579 HydrophobicContact CD1-CZ 4.16Å; L550-L580 HydrophobicContact CD1-CD2 4.38Å; L550-F584 HydrophobicContact CB-CD1 3.99Å; L550-F584 HydrophobicContact CB-CE1 3.47Å; L550-F584 VanDerWaalsContact CB-CE1 3.47Å; L550-F584 HydrophobicContact CB-CE2 4.13Å; L550-F584 HydrophobicContact CB-CZ 3.56Å; L550-F584 HydrophobicContact CD1-CD2 3.93Å; L550-F584 HydrophobicContact CD1-CE1 4.45Å; L550-F584 HydrophobicContact CD1-CE2 3.6Å; L550-F584 HydrophobicContact CD1-CZ 3.89Å; L550-F584 HydrophobicContact CG-CZ 4.38Å; L550-L587 HydrophobicContact CD2-CD1 4.14Å
551	K	84.4	Confident	85.6	Confident	156 Å²	156	45.1 Å²	45.1	68%	0.678	22%	0.222	S	C	*	.	H	α-helix	trans	-75.5	-35.8	176.7	-73.9	176.3	-176.8	-178.8	0	113.7	P547 V549 F584	P547-K551 WeakPolarHBondContact O-CB 3.37Å; P547-K551 VanDerWaalsContact O-CG 3.26Å; P547-K551 WeakPolarHBondContact O-CG 3.35Å; P547-K551 PolarHBondContact O-N 3.4Å; V549-K551 PolarHBondContact O-N 2.96Å; K551-F584 HydrophobicContact CG-CE1 3.84Å; K551-F584 HydrophobicContact CG-CZ 4.28Å
552	I	83.3	Confident	85.1	Confident	121 Å²	121	47.7 Å²	47.7	62%	0.621	24%	0.239	S	C	*	.	H	α-helix	trans	-88.8	-41.3	-175.4	-64.6	178.4	0	0	0	111.2	W548 V549	W548-I552 HydrophobicContact CE3-CD1 3.82Å; W548-I552 HydrophobicContact CZ3-CD1 4.19Å; W548-I552 WeakPolarHBondContact O-CG1 3.35Å; W548-I552 PolarHBondContact O-N 3.46Å; V549-I552 PolarHBondContact O-N 3.19Å; V549-I552 VanDerWaalsContact O-N 3.13Å
553	C	82.6	Confident	84.8	Confident	30 Å²	30	51.2 Å²	51.2	20%	0.203	26%	0.255	C	S	.	.			trans	-140.1	89	-179.6	-168.2	0	0	0	0	109.8	V549 E555 D556 G557	V549-C553 CarbonylContact O-C 3.2Å; V549-C553 PolarHBondContact O-N 3.15Å; C553-E555 PolarHBondContact O-N 3.45Å; C553-D556 HydrophobicContact CB-CB 4.46Å; C553-D556 PolarHBondContact O-N 3.28Å; C553-G557 PolarHBondContact O-N 3.06Å
554	P	78.6	Confident	84.4	Confident	51 Å²	51	56 Å²	56	33%	0.331	28%	0.281	S	S	.	.	H	α-helix	trans	-58.6	-42.2	-176.2	-25.6	33.4	0	0	0	114	G557 L558 L587	P554-G557 PolarHBondContact O-N 3.41Å; P554-L558 WeakPolarHBondContact O-CG 3.47Å; P554-L558 PolarHBondContact O-N 2.94Å; P554-L587 HydrophobicContact CB-CD1 3.9Å; P554-L587 HydrophobicContact CB-CD2 3.57Å; P554-L587 HydrophobicContact CB-CG 4.31Å
555	E	75.9	Confident	84	Confident	138 Å²	138	53.5 Å²	53.5	65%	0.645	27%	0.271	S	S	*	.	H	α-helix	trans	-59.8	-50.9	-179.5	-63.6	-62.2	155.6	0	0	112.3	C553 G557 L558 K559	C553-E555 PolarHBondContact O-N 3.45Å; E555-G557 VanDerWaalsContact C-N 3.33Å; E555-L558 PolarHBondContact O-N 2.94Å; E555-K559 PolarHBondContact O-N 3.15Å
556	D	78.3	Confident	83.7	Confident	40 Å²	40	56.7 Å²	56.7	21%	0.214	29%	0.293	C	S	.	.	H	α-helix	trans	-73.9	-27.7	178.3	-72.3	-25.4	0	0	0	112.3	H524 C553 L558 K559	H524-D556 IonicContact CD2-OD2 3.93Å; H524-D556 IonicContact CE1-OD2 3.89Å; H524-D556 IonicContact NE2-OD2 3.64Å; H524-D556 PolarHBondContact NE2-OD2 3.44Å; C553-D556 HydrophobicContact CB-CB 4.46Å; C553-D556 PolarHBondContact O-N 3.28Å; D556-L558 VanDerWaalsContact C-N 3.34Å; D556-K559 WeakPolarHBondContact O-CB 3.49Å; D556-K559 PolarHBondContact O-N 3.35Å; D556-K559 WeakPolarHBondContact OD1-CE 3.42Å; D556-K559 IonicContact OD1-NZ 3.87Å; D556-K559 PolarHBondContact OD1-NZ 3.36Å
557	G	84.2	Confident	83.5	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-65	-36.9	172.1	0	0	0	0	0	112.5	L550 C553 P554 E555 K559 I560	L550-G557 VanDerWaalsContact CD2-C 3.42Å; C553-G557 PolarHBondContact O-N 3.06Å; P554-G557 PolarHBondContact O-N 3.41Å; E555-G557 VanDerWaalsContact C-N 3.33Å; G557-K559 VanDerWaalsContact C-N 3.34Å; G557-I560 VanDerWaalsContact O-CB 3.29Å; G557-I560 WeakPolarHBondContact O-CB 3.42Å; G557-I560 WeakPolarHBondContact O-CD1 3.48Å; G557-I560 WeakPolarHBondContact O-CG1 3.4Å; G557-I560 PolarHBondContact O-N 2.89Å
558	L	83.2	Confident	83.2	Confident	33 Å²	33	58.7 Å²	58.7	17%	0.173	30%	0.3	C	S	.	.	H	α-helix	trans	-67.1	-35	175.6	-75.2	175.4	0	0	0	112.3	L550 P554 E555 D556 I560 F561 T562 L580 L587	L550-L558 HydrophobicContact CD2-CD2 4.47Å; P554-L558 WeakPolarHBondContact O-CG 3.47Å; P554-L558 PolarHBondContact O-N 2.94Å; E555-L558 PolarHBondContact O-N 2.94Å; D556-L558 VanDerWaalsContact C-N 3.34Å; L558-I560 PolarHBondContact O-N 3.06Å; L558-F561 PolarHBondContact O-N 3.49Å; L558-T562 PolarHBondContact O-N 3.47Å; L558-T562 PolarHBondContact O-OG1 3.31Å; L558-T562 VanDerWaalsContact O-OG1 3.11Å; L558-L580 HydrophobicContact CD2-CD1 4.2Å; L558-L580 HydrophobicContact CD2-CD2 4.3Å; L558-L587 HydrophobicContact CD1-CB 4.21Å; L558-L587 HydrophobicContact CD1-CD1 4.49Å; L558-L587 HydrophobicContact CD1-CD2 3.99Å; L558-L587 HydrophobicContact CD1-CG 4.45Å; L558-L587 HydrophobicContact CD2-CB 4.18Å; L558-L587 HydrophobicContact CD2-CD1 4.26Å; L558-L587 HydrophobicContact CG-CD1 4.24Å
559	K	83.4	Confident	82.9	Confident	87 Å²	87	62.1 Å²	62.1	38%	0.378	32%	0.318	S	S	.	.	H	α-helix	trans	-56.7	-23.3	175	-65.6	177.7	-174.3	161	0	113.4	V528 Q532 E555 D556 G557 F561 E563	V528-K559 HydrophobicContact CG1-CB 4.46Å; Q532-K559 PolarHBondContact NE2-O 2.92Å; E555-K559 PolarHBondContact O-N 3.15Å; D556-K559 WeakPolarHBondContact O-CB 3.49Å; D556-K559 PolarHBondContact O-N 3.35Å; D556-K559 WeakPolarHBondContact OD1-CE 3.42Å; D556-K559 IonicContact OD1-NZ 3.87Å; D556-K559 PolarHBondContact OD1-NZ 3.36Å; G557-K559 VanDerWaalsContact C-N 3.34Å; K559-F561 PolarHBondContact O-N 3.2Å; K559-E563 VanDerWaalsContact O-CB 3.26Å; K559-E563 WeakPolarHBondContact O-CB 3.28Å; K559-E563 PolarHBondContact O-N 3.31Å
560	I	85.9	Confident	82.7	Confident	1 Å²	1	66 Å²	66	1%	0.005	34%	0.342	C	S	.	.	H	α-helix	trans	-56	-32.7	172.7	-60.6	169.1	0	0	0	111	V528 L531 I542 V549 G557 L558	V528-I560 HydrophobicContact CB-CG1 4.26Å; V528-I560 HydrophobicContact CG1-CG1 3.92Å; V528-I560 HydrophobicContact CG2-CD1 4.24Å; V528-I560 HydrophobicContact CG2-CG1 4.05Å; L531-I560 HydrophobicContact CB-CG2 3.91Å; L531-I560 HydrophobicContact CD1-CD1 3.9Å; L531-I560 HydrophobicContact CD1-CG2 4.43Å; I542-I560 HydrophobicContact CG2-CG2 3.86Å; V549-I560 HydrophobicContact CB-CD1 4.36Å; V549-I560 HydrophobicContact CG1-CD1 4.43Å; G557-I560 VanDerWaalsContact O-CB 3.29Å; G557-I560 WeakPolarHBondContact O-CB 3.42Å; G557-I560 WeakPolarHBondContact O-CD1 3.48Å; G557-I560 WeakPolarHBondContact O-CG1 3.4Å; G557-I560 PolarHBondContact O-N 2.89Å; L558-I560 PolarHBondContact O-N 3.06Å
561	F	84.8	Confident	82.7	Confident	4 Å²	4	66.2 Å²	66.2	2%	0.018	34%	0.343	C	S	.	.	H	α-helix	trans	-110.1	-18.7	-175.8	-52.5	-71.1	0	0	0	114.1	I542 L543 L550 L558 K559 V568 L571 R573 V576 F579	I542-F561 HydrophobicContact CG2-CE1 3.81Å; I542-F561 HydrophobicContact CG2-CZ 4.32Å; L543-F561 HydrophobicContact CD2-CE1 4.14Å; L543-F561 HydrophobicContact CD2-CZ 4.24Å; L550-F561 HydrophobicContact CD1-CE2 4.25Å; L558-F561 PolarHBondContact O-N 3.49Å; K559-F561 PolarHBondContact O-N 3.2Å; F561-V568 WeakPolarHBondContact O-CG1 3.48Å; F561-L571 HydrophobicContact CD1-CD1 4.14Å; F561-R573 PolarHBondContact O-NH1 3.11Å; F561-V576 HydrophobicContact CB-CG1 3.84Å; F561-V576 HydrophobicContact CD1-CB 4.35Å; F561-V576 HydrophobicContact CD1-CG1 3.51Å; F561-V576 HydrophobicContact CD1-CG2 3.84Å; F561-V576 HydrophobicContact CD2-CG1 4.19Å; F561-V576 HydrophobicContact CE1-CG1 4.07Å; F561-V576 HydrophobicContact CE1-CG2 4.19Å; F561-V576 HydrophobicContact CG-CG1 3.57Å; F561-F579 HydrophobicContact CE2-CE1 4.41Å; F561-F579 HydrophobicContact CZ-CD1 4.44Å; F561-F579 HydrophobicContact CZ-CE1 4.16Å
562	T	79.1	Confident	82.8	Confident	89 Å²	89	61.2 Å²	61.2	55%	0.546	33%	0.326	S	S	.	.	H	α-helix	trans	-114.2	-3	-171.1	63.3	0	0	0	0	114.8	L558	L558-T562 PolarHBondContact O-N 3.47Å; L558-T562 PolarHBondContact O-OG1 3.31Å; L558-T562 VanDerWaalsContact O-OG1 3.11Å
563	E	84.3	Confident	82.7	Confident	75 Å²	75	61.1 Å²	61.1	35%	0.35	32%	0.318	S	S	.	.	S	Bend	trans	-68.3	146.8	178.1	-166.7	70.9	-94.1	0	0	112.1	Q532 K559 L565 V568	Q532-E563 VanDerWaalsContact NE2-CB 3.31Å; K559-E563 VanDerWaalsContact O-CB 3.26Å; K559-E563 WeakPolarHBondContact O-CB 3.28Å; K559-E563 PolarHBondContact O-N 3.31Å; E563-L565 HydrophobicContact CB-CD1 4.47Å; E563-L565 HydrophobicContact CG-CD1 3.96Å; E563-L565 HydrophobicContact CG-CG 3.93Å; E563-L565 PolarHBondContact O-N 2.98Å; E563-V568 WeakPolarHBondContact O-CG1 3.49Å
564	D	80.1	Confident	82.4	Confident	141 Å²	141	66.2 Å²	66.2	75%	0.754	34%	0.344	S	S	*	.	S	Bend	trans	-76.7	63.9	178.9	-66	-26.3	0	0	0	111.4
565	L	83.6	Confident	82.5	Confident	56 Å²	56	69.7 Å²	69.7	29%	0.293	35%	0.354	S	S	.	.			trans	-122	141.1	176	-67.8	172	0	0	0	110.6	Q532 E563 E567 V568 E569	Q532-L565 HydrophobicContact CB-CD1 3.83Å; Q532-L565 HydrophobicContact CG-CD1 4.37Å; E563-L565 HydrophobicContact CB-CD1 4.47Å; E563-L565 HydrophobicContact CG-CD1 3.96Å; E563-L565 HydrophobicContact CG-CG 3.93Å; E563-L565 PolarHBondContact O-N 2.98Å; L565-E567 VanDerWaalsContact C-N 3.26Å; L565-E567 PolarHBondContact O-N 3.47Å; L565-V568 HydrophobicContact CB-CB 4.23Å; L565-V568 HydrophobicContact CB-CG2 3.93Å; L565-V568 HydrophobicContact CD1-CG2 4.41Å; L565-V568 WeakPolarHBondContact O-CA 3.31Å; L565-V568 WeakPolarHBondContact O-CB 3.3Å; L565-V568 PolarHBondContact O-N 2.87Å; L565-E569 PolarHBondContact O-N 2.93Å
566	P	82.9	Confident	82.8	Confident	83 Å²	83	63.4 Å²	63.4	54%	0.539	33%	0.325	S	S	.	.	H	α-helix	trans	-61.4	-36.1	-175.9	23.3	-30.7	0	0	0	112	V568 E569 T570	P566-V568 VanDerWaalsContact C-N 3.31Å; P566-V568 PolarHBondContact O-N 3.18Å; P566-E569 PolarHBondContact O-N 3.09Å; P566-T570 VanDerWaalsContact O-CG2 3.24Å; P566-T570 WeakPolarHBondContact O-CG2 3.39Å; P566-T570 PolarHBondContact O-N 3.08Å
567	E	85.6	Confident	82.7	Confident	74 Å²	74	65.2 Å²	65.2	35%	0.346	33%	0.334	S	S	.	.	H	α-helix	trans	-64	-36.4	175.7	-62	84	178.3	0	0	112.1	Q532 L565 T570	Q532-E567 WeakPolarHBondContact O-CB 3.24Å; L565-E567 VanDerWaalsContact C-N 3.26Å; L565-E567 PolarHBondContact O-N 3.47Å; E567-T570 PolarHBondContact O-OG1 2.87Å
568	V	85.1	Confident	82.4	Confident	1 Å²	1	70.5 Å²	70.5	1%	0.006	36%	0.359	C	S	.	.	H	α-helix	trans	-75.2	-37.8	179.1	178.4	0	0	0	0	110.9	Q532 F561 E563 L565 P566 T570 L571	Q532-V568 HydrophobicContact CB-CG2 4Å; Q532-V568 HydrophobicContact CG-CG2 4.1Å; F561-V568 WeakPolarHBondContact O-CG1 3.48Å; E563-V568 WeakPolarHBondContact O-CG1 3.49Å; L565-V568 HydrophobicContact CB-CB 4.23Å; L565-V568 HydrophobicContact CB-CG2 3.93Å; L565-V568 HydrophobicContact CD1-CG2 4.41Å; L565-V568 WeakPolarHBondContact O-CA 3.31Å; L565-V568 WeakPolarHBondContact O-CB 3.3Å; L565-V568 PolarHBondContact O-N 2.87Å; P566-V568 VanDerWaalsContact C-N 3.31Å; P566-V568 PolarHBondContact O-N 3.18Å; V568-T570 PolarHBondContact O-N 2.93Å; V568-L571 HydrophobicContact CG1-CD1 4.21Å; V568-L571 VanDerWaalsContact O-CB 3.31Å; V568-L571 WeakPolarHBondContact O-CB 3.31Å; V568-L571 WeakPolarHBondContact O-CG 3.41Å; V568-L571 PolarHBondContact O-N 3.16Å; V568-L571 VanDerWaalsContact O-N 3.12Å
569	E	82.4	Confident	82.4	Confident	122 Å²	122	70.8 Å²	70.8	57%	0.57	36%	0.359	S	S	*	.	H	α-helix	trans	-60	-34.2	174.9	-72.6	-177.8	173.8	0	0	112.9	L565 P566 L571	L565-E569 PolarHBondContact O-N 2.93Å; P566-E569 PolarHBondContact O-N 3.09Å; E569-L571 PolarHBondContact O-N 3.27Å
570	T	84.7	Confident	82.2	Confident	81 Å²	81	67.5 Å²	67.5	50%	0.497	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-7.3	178.6	68.5	0	0	0	0	114.2	S536 P566 E567 V568	S536-T570 WeakPolarHBondContact CB-O 3.24Å; P566-T570 VanDerWaalsContact O-CG2 3.24Å; P566-T570 WeakPolarHBondContact O-CG2 3.39Å; P566-T570 PolarHBondContact O-N 3.08Å; E567-T570 PolarHBondContact O-OG1 2.87Å; V568-T570 PolarHBondContact O-N 2.93Å
571	L	85.1	Confident	81.6	Confident	7 Å²	7	73.2 Å²	73.2	4%	0.037	37%	0.37	C	S	.	.	S	Bend	trans	-69	135.2	-178.8	-63.7	176.8	0	0	0	111.5	L539 I542 F561 V568 E569 R573 V576	L539-L571 HydrophobicContact CD1-CD2 4.13Å; I542-L571 HydrophobicContact CD1-CD2 3.91Å; F561-L571 HydrophobicContact CD1-CD1 4.14Å; V568-L571 HydrophobicContact CG1-CD1 4.21Å; V568-L571 VanDerWaalsContact O-CB 3.31Å; V568-L571 WeakPolarHBondContact O-CB 3.31Å; V568-L571 WeakPolarHBondContact O-CG 3.41Å; V568-L571 PolarHBondContact O-N 3.16Å; V568-L571 VanDerWaalsContact O-N 3.12Å; E569-L571 PolarHBondContact O-N 3.27Å; L571-R573 PolarHBondContact O-N 3.43Å; L571-V576 HydrophobicContact CB-CG2 4.45Å
572	P	85.6	Confident	81.1	Confident	51 Å²	51	80 Å²	80	33%	0.331	40%	0.402	S	S	.	.			trans	-62.7	103.2	176.8	-22.9	33.6	0	0	0	112.3	L539 D574 K575 V576	L539-P572 HydrophobicContact CD2-CG 4.09Å; P572-D574 VanDerWaalsContact C-N 3.29Å; P572-D574 PolarHBondContact O-N 3.05Å; P572-K575 HydrophobicContact CB-CB 4.33Å; P572-K575 HydrophobicContact CB-CD 4.28Å; P572-K575 HydrophobicContact CB-CG 4.29Å; P572-K575 PolarHBondContact O-N 2.8Å; P572-K575 VanDerWaalsContact O-N 3.16Å; P572-V576 PolarHBondContact O-N 2.65Å; P572-V576 VanDerWaalsContact O-N 3.15Å
573	R	81.3	Confident	80.6	Confident	119 Å²	119	78.1 Å²	78.1	45%	0.449	40%	0.4	S	S	.	.	H	α-helix	trans	-58.5	-37.9	-173.8	-58.1	-55.8	-174.5	174.5	2.9	113	F561 L571 K575 V576 L577	F561-R573 PolarHBondContact O-NH1 3.11Å; L571-R573 PolarHBondContact O-N 3.43Å; R573-K575 PolarHBondContact O-N 2.65Å; R573-V576 PolarHBondContact O-N 3.45Å; R573-L577 VanDerWaalsContact O-CB 3.26Å; R573-L577 WeakPolarHBondContact O-CB 3.31Å; R573-L577 PolarHBondContact O-N 3.22Å
574	D	75.9	Confident	80.1	Confident	138 Å²	138	75.9 Å²	75.9	74%	0.738	39%	0.389	S	S	*	.	H	α-helix	trans	-62.8	-41.7	179.3	-59.6	-37.8	0	0	0	112.5	P572 L577 Q578	P572-D574 VanDerWaalsContact C-N 3.29Å; P572-D574 PolarHBondContact O-N 3.05Å; D574-L577 PolarHBondContact O-N 2.85Å; D574-Q578 WeakPolarHBondContact O-CB 3.41Å; D574-Q578 PolarHBondContact O-N 3.05Å
575	K	80.6	Confident	79.2	Confident	123 Å²	123	73.9 Å²	73.9	54%	0.535	38%	0.381	S	S	.	.	H	α-helix	trans	-72.1	-39	179.7	-66.6	-173.7	177.4	-179.4	0	111.9	L539 P572 R573 Q578 F579	L539-K575 HydrophobicContact CD2-CB 4.42Å; L539-K575 HydrophobicContact CD2-CD 3.97Å; P572-K575 HydrophobicContact CB-CB 4.33Å; P572-K575 HydrophobicContact CB-CD 4.28Å; P572-K575 HydrophobicContact CB-CG 4.29Å; P572-K575 PolarHBondContact O-N 2.8Å; P572-K575 VanDerWaalsContact O-N 3.16Å; R573-K575 PolarHBondContact O-N 2.65Å; K575-Q578 PolarHBondContact O-N 3.5Å; K575-F579 WeakPolarHBondContact O-CB 3.09Å; K575-F579 PolarHBondContact O-N 3.32Å
576	V	83	Confident	77.9	Confident	7 Å²	7	79.5 Å²	79.5	4%	0.042	41%	0.406	C	S	.	.	H	α-helix	trans	-64.2	-44.9	174.6	174.8	0	0	0	0	110.2	L539 F561 L571 P572 R573 Q578 F579 L580	L539-V576 HydrophobicContact CD1-CG2 4.48Å; F561-V576 HydrophobicContact CB-CG1 3.84Å; F561-V576 HydrophobicContact CD1-CB 4.35Å; F561-V576 HydrophobicContact CD1-CG1 3.51Å; F561-V576 HydrophobicContact CD1-CG2 3.84Å; F561-V576 HydrophobicContact CD2-CG1 4.19Å; F561-V576 HydrophobicContact CE1-CG1 4.07Å; F561-V576 HydrophobicContact CE1-CG2 4.19Å; F561-V576 HydrophobicContact CG-CG1 3.57Å; L571-V576 HydrophobicContact CB-CG2 4.45Å; P572-V576 PolarHBondContact O-N 2.65Å; P572-V576 VanDerWaalsContact O-N 3.15Å; R573-V576 PolarHBondContact O-N 3.45Å; V576-Q578 VanDerWaalsContact C-N 3.34Å; V576-Q578 PolarHBondContact O-N 3.02Å; V576-F579 PolarHBondContact O-N 3.41Å; V576-L580 HydrophobicContact CG1-CD1 4.11Å; V576-L580 HydrophobicContact CG1-CG 4.48Å; V576-L580 WeakPolarHBondContact O-CG 3.43Å; V576-L580 PolarHBondContact O-N 2.86Å
577	L	75.9	Confident	76.8	Confident	77 Å²	77	78.1 Å²	78.1	40%	0.403	39%	0.394	S	S	.	.	H	α-helix	trans	-63.8	-39.9	177.7	-173.8	67.4	0	0	0	111.6	R573 D574 L580 K581	R573-L577 VanDerWaalsContact O-CB 3.26Å; R573-L577 WeakPolarHBondContact O-CB 3.31Å; R573-L577 PolarHBondContact O-N 3.22Å; D574-L577 PolarHBondContact O-N 2.85Å; L577-L580 PolarHBondContact O-N 3.17Å; L577-K581 HydrophobicContact CG-CD 4.24Å; L577-K581 WeakPolarHBondContact O-CB 3.49Å; L577-K581 VanDerWaalsContact O-CG 3.25Å; L577-K581 WeakPolarHBondContact O-CG 3.4Å; L577-K581 PolarHBondContact O-N 3.29Å
578	Q	78.7	Confident	75.2	Confident	112 Å²	112	75.7 Å²	75.7	52%	0.523	39%	0.387	S	S	.	.	H	α-helix	trans	-61.7	-47.4	174.1	-177.8	173.1	3.6	0	0	111.5	D574 K575 V576 L580 K581 E582	D574-Q578 WeakPolarHBondContact O-CB 3.41Å; D574-Q578 PolarHBondContact O-N 3.05Å; K575-Q578 PolarHBondContact O-N 3.5Å; V576-Q578 VanDerWaalsContact C-N 3.34Å; V576-Q578 PolarHBondContact O-N 3.02Å; Q578-L580 PolarHBondContact O-N 3.03Å; Q578-K581 PolarHBondContact O-N 3.43Å; Q578-E582 HydrophobicContact CG-CG 4.43Å; Q578-E582 WeakPolarHBondContact CG-OE1 3.26Å; Q578-E582 PolarHBondContact NE2-OE1 3.45Å; Q578-E582 WeakPolarHBondContact O-CG 3.36Å; Q578-E582 PolarHBondContact O-N 3.02Å
579	F	83.4	Confident	73.7	Confident	39 Å²	39	81 Å²	81	17%	0.171	41%	0.414	C	S	.	.	H	α-helix	trans	-58.4	-44.5	175.9	166.8	-98	0	0	0	112.7	L543 S546 P547 L550 F561 K575 V576 E582 G583 F584	L543-F579 HydrophobicContact CB-CD2 4.44Å; L543-F579 HydrophobicContact CB-CE2 4.39Å; L543-F579 HydrophobicContact CD2-CB 4.04Å; L543-F579 HydrophobicContact CD2-CD1 3.79Å; L543-F579 HydrophobicContact CD2-CD2 3.98Å; L543-F579 HydrophobicContact CD2-CE1 4.19Å; L543-F579 HydrophobicContact CD2-CE2 4.35Å; L543-F579 HydrophobicContact CD2-CG 3.67Å; L543-F579 HydrophobicContact CD2-CZ 4.44Å; S546-F579 WeakPolarHBondContact OG-CZ 3.46Å; P547-F579 HydrophobicContact CG-CE2 4.35Å; P547-F579 HydrophobicContact CG-CZ 4.04Å; L550-F579 HydrophobicContact CD1-CE1 3.73Å; L550-F579 HydrophobicContact CD1-CZ 4.16Å; F561-F579 HydrophobicContact CE2-CE1 4.41Å; F561-F579 HydrophobicContact CZ-CD1 4.44Å; F561-F579 HydrophobicContact CZ-CE1 4.16Å; K575-F579 WeakPolarHBondContact O-CB 3.09Å; K575-F579 PolarHBondContact O-N 3.32Å; V576-F579 PolarHBondContact O-N 3.41Å; F579-E582 PolarHBondContact O-N 2.93Å; F579-G583 PolarHBondContact O-N 3.29Å; F579-G583 VanDerWaalsContact O-N 3.1Å; F579-F584 HydrophobicContact CE1-CD2 4.34Å; F579-F584 HydrophobicContact CE1-CE2 4.15Å; F579-F584 AromaticContact CZ-CE2 3.95Å; F579-F584 HydrophobicContact CZ-CE2 3.95Å
580	L	78.6	Confident	72.5	Confident	17 Å²	17	79 Å²	79	9%	0.089	41%	0.412	C	S	.	.	H	α-helix	trans	-66.5	-37.6	177.1	-68.5	175	0	0	0	111.8	L550 L558 V576 L577 Q578 F584 V585	L550-L580 HydrophobicContact CD1-CD2 4.38Å; L558-L580 HydrophobicContact CD2-CD1 4.2Å; L558-L580 HydrophobicContact CD2-CD2 4.3Å; V576-L580 HydrophobicContact CG1-CD1 4.11Å; V576-L580 HydrophobicContact CG1-CG 4.48Å; V576-L580 WeakPolarHBondContact O-CG 3.43Å; V576-L580 PolarHBondContact O-N 2.86Å; L577-L580 PolarHBondContact O-N 3.17Å; Q578-L580 PolarHBondContact O-N 3.03Å; L580-F584 HydrophobicContact CD2-CB 4.38Å; L580-F584 HydrophobicContact CD2-CD2 4.38Å; L580-F584 CarbonylContact O-C 3.26Å; L580-F584 VanDerWaalsContact O-CA 3.26Å; L580-F584 WeakPolarHBondContact O-CA 3.37Å; L580-F584 PolarHBondContact O-N 3.29Å; L580-V585 PolarHBondContact O-N 3.46Å
581	K	73.2	Confident	71	Confident	122 Å²	122	76.3 Å²	76.3	53%	0.53	40%	0.395	S	S	.	.	H	α-helix	trans	-67.7	-35.3	175.5	-77.2	174.9	177	178.5	0	113.2	L577 Q578 V585 A588	L577-K581 HydrophobicContact CG-CD 4.24Å; L577-K581 WeakPolarHBondContact O-CB 3.49Å; L577-K581 VanDerWaalsContact O-CG 3.25Å; L577-K581 WeakPolarHBondContact O-CG 3.4Å; L577-K581 PolarHBondContact O-N 3.29Å; Q578-K581 PolarHBondContact O-N 3.43Å; K581-V585 VanDerWaalsContact O-CG2 3.26Å; K581-V585 WeakPolarHBondContact O-CG2 3.28Å; K581-A588 HydrophobicContact CG-CB 4.49Å
582	E	75	Confident	69.5	Low	146 Å²	146	80.9 Å²	80.9	68%	0.682	42%	0.416	S	S	*	.	H	α-helix	trans	-77.4	-32.8	-179.1	-73.1	172.9	-172.2	0	0	112.4	Q578 F579	Q578-E582 HydrophobicContact CG-CG 4.43Å; Q578-E582 WeakPolarHBondContact CG-OE1 3.26Å; Q578-E582 PolarHBondContact NE2-OE1 3.45Å; Q578-E582 WeakPolarHBondContact O-CG 3.36Å; Q578-E582 PolarHBondContact O-N 3.02Å; F579-E582 PolarHBondContact O-N 2.93Å
583	G	68.6	Low	68.2	Low	49 Å²	49	79.9 Å²	79.9	51%	0.505	42%	0.415	S	S	.	.	H	α-helix	trans	-117	-20.1	-172.5	0	0	0	0	0	117.2	F579	F579-G583 PolarHBondContact O-N 3.29Å; F579-G583 VanDerWaalsContact O-N 3.1Å
584	F	73.7	Confident	67	Low	28 Å²	28	77.3 Å²	77.3	12%	0.123	41%	0.41	C	S	.	.			trans	-145.7	51.9	-166.5	-59.3	-82.1	0	0	0	112.4	P547 L550 K551 F579 L580 E586 L587	P547-F584 HydrophobicContact CB-CZ 4.17Å; L550-F584 HydrophobicContact CB-CD1 3.99Å; L550-F584 HydrophobicContact CB-CE1 3.47Å; L550-F584 VanDerWaalsContact CB-CE1 3.47Å; L550-F584 HydrophobicContact CB-CE2 4.13Å; L550-F584 HydrophobicContact CB-CZ 3.56Å; L550-F584 HydrophobicContact CD1-CD2 3.93Å; L550-F584 HydrophobicContact CD1-CE1 4.45Å; L550-F584 HydrophobicContact CD1-CE2 3.6Å; L550-F584 HydrophobicContact CD1-CZ 3.89Å; L550-F584 HydrophobicContact CG-CZ 4.38Å; K551-F584 HydrophobicContact CG-CE1 3.84Å; K551-F584 HydrophobicContact CG-CZ 4.28Å; F579-F584 HydrophobicContact CE1-CD2 4.34Å; F579-F584 HydrophobicContact CE1-CE2 4.15Å; F579-F584 AromaticContact CZ-CE2 3.95Å; F579-F584 HydrophobicContact CZ-CE2 3.95Å; L580-F584 HydrophobicContact CD2-CB 4.38Å; L580-F584 HydrophobicContact CD2-CD2 4.38Å; L580-F584 CarbonylContact O-C 3.26Å; L580-F584 VanDerWaalsContact O-CA 3.26Å; L580-F584 WeakPolarHBondContact O-CA 3.37Å; L580-F584 PolarHBondContact O-N 3.29Å; F584-E586 PolarHBondContact O-N 2.97Å; F584-E586 VanDerWaalsContact O-N 3.13Å; F584-L587 HydrophobicContact CB-CD1 4.04Å; F584-L587 HydrophobicContact CD1-CD1 4.45Å; F584-L587 PolarHBondContact O-N 2.93Å
585	V	60.8	Low	66.1	Low	99 Å²	99	71.1 Å²	71.1	60%	0.6	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-53.1	-36.5	-172.6	-178.6	0	0	0	0	113.6	L580 K581 L587 A588	L580-V585 PolarHBondContact O-N 3.46Å; K581-V585 VanDerWaalsContact O-CG2 3.26Å; K581-V585 WeakPolarHBondContact O-CG2 3.28Å; V585-L587 PolarHBondContact O-N 3.19Å; V585-A588 PolarHBondContact O-N 2.96Å; V585-A588 VanDerWaalsContact O-N 3.09Å
586	E	56.7	Low	65.2	Low	175 Å²	175	71.6 Å²	71.6	82%	0.818	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-63.3	-28.2	-179.2	-63	-177.8	173.5	0	0	113.3	F584 A588	F584-E586 PolarHBondContact O-N 2.97Å; F584-E586 VanDerWaalsContact O-N 3.13Å; E586-A588 VanDerWaalsContact C-N 3.31Å
587	L	58.1	Low	64.1	Low	53 Å²	53	77.3 Å²	77.3	28%	0.277	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-85.4	-5.4	178.4	-59.8	172.9	0	0	0	113	L550 P554 L558 F584 V585	L550-L587 HydrophobicContact CD2-CD1 4.14Å; P554-L587 HydrophobicContact CB-CD1 3.9Å; P554-L587 HydrophobicContact CB-CD2 3.57Å; P554-L587 HydrophobicContact CB-CG 4.31Å; L558-L587 HydrophobicContact CD1-CB 4.21Å; L558-L587 HydrophobicContact CD1-CD1 4.49Å; L558-L587 HydrophobicContact CD1-CD2 3.99Å; L558-L587 HydrophobicContact CD1-CG 4.45Å; L558-L587 HydrophobicContact CD2-CB 4.18Å; L558-L587 HydrophobicContact CD2-CD1 4.26Å; L558-L587 HydrophobicContact CG-CD1 4.24Å; F584-L587 HydrophobicContact CB-CD1 4.04Å; F584-L587 HydrophobicContact CD1-CD1 4.45Å; F584-L587 PolarHBondContact O-N 2.93Å; V585-L587 PolarHBondContact O-N 3.19Å
588	A	52.5	Low	63.4	Low	24 Å²	24	74 Å²	74	20%	0.198	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-109.5	8.8	-171	0	0	0	0	0	114.1	K581 V585 E586 P590	K581-A588 HydrophobicContact CG-CB 4.49Å; V585-A588 PolarHBondContact O-N 2.96Å; V585-A588 VanDerWaalsContact O-N 3.09Å; E586-A588 VanDerWaalsContact C-N 3.31Å; A588-P590 WeakPolarHBondContact O-CD 3.4Å
589	I	54.5	Low	62.6	Low	113 Å²	113	71.3 Å²	71.3	58%	0.579	38%	0.376	S	S	*	.			trans	-74.5	113.8	-175.9	-59.5	165.8	0	0	0	110.6	L594	I589-L594 HydrophobicContact CG2-CD1 4.03Å
590	P	56.5	Low	61.5	Low	80 Å²	80	76.1 Å²	76.1	52%	0.519	40%	0.404	S	S	.	.			trans	-80.5	134.4	175.9	-6.6	26.5	0	0	0	110	A588 Q592 G593	A588-P590 WeakPolarHBondContact O-CD 3.4Å; P590-Q592 PolarHBondContact O-N 2.84Å; P590-Q592 VanDerWaalsContact O-N 3.08Å; P590-G593 WeakPolarHBondContact O-CA 3.46Å; P590-G593 PolarHBondContact O-N 2.92Å
591	V	52.5	Low	60.6	Low	24 Å²	24	78 Å²	78	15%	0.145	42%	0.418	C	S	.	.	H	α-helix	trans	-49.9	-33.6	172.8	179.8	0	0	0	0	112.4	G593 L594 M595 F628 L640	V591-G593 PolarHBondContact O-N 3.44Å; V591-L594 PolarHBondContact O-N 3.07Å; V591-M595 PolarHBondContact O-N 3.26Å; V591-M595 VanDerWaalsContact O-N 3.09Å; V591-F628 HydrophobicContact CB-CE1 4.39Å; V591-F628 HydrophobicContact CG1-CD1 4.49Å; V591-F628 HydrophobicContact CG1-CE1 4.28Å; V591-F628 HydrophobicContact CG2-CD1 4Å; V591-F628 HydrophobicContact CG2-CE1 3.19Å; V591-F628 HydrophobicContact CG2-CE2 4.33Å; V591-F628 HydrophobicContact CG2-CZ 3.38Å; V591-L640 HydrophobicContact CG1-CD1 4.22Å; V591-L640 HydrophobicContact CG1-CD2 4.12Å
592	Q	54.2	Low	60	Low	102 Å²	102	76.2 Å²	76.2	48%	0.477	41%	0.414	S	S	.	.	H	α-helix	trans	-61.9	-27.8	174.5	-78.5	-179.4	-25.8	0	0	113.9	P590 K596 D643	P590-Q592 PolarHBondContact O-N 2.84Å; P590-Q592 VanDerWaalsContact O-N 3.08Å; Q592-K596 WeakPolarHBondContact O-CB 3.29Å; Q592-K596 WeakPolarHBondContact O-CG 3.29Å; Q592-K596 PolarHBondContact O-N 2.95Å; Q592-K596 VanDerWaalsContact O-N 3.1Å; Q592-D643 PolarHBondContact NE2-OD2 3.27Å
593	G	57.9	Low	59.1	Low	30 Å²	30	73.1 Å²	73.1	31%	0.309	41%	0.407	S	S	.	.	H	α-helix	trans	-70.5	-45.7	176.4	0	0	0	0	0	112.3	P590 V591 Q597	P590-G593 WeakPolarHBondContact O-CA 3.46Å; P590-G593 PolarHBondContact O-N 2.92Å; V591-G593 PolarHBondContact O-N 3.44Å; G593-Q597 WeakPolarHBondContact O-CB 3.25Å; G593-Q597 VanDerWaalsContact O-CG 3.29Å; G593-Q597 WeakPolarHBondContact O-CG 3.33Å; G593-Q597 PolarHBondContact O-N 3.45Å; G593-Q597 VanDerWaalsContact O-N 3.09Å
594	L	56.9	Low	58.2	Low	66 Å²	66	80.5 Å²	80.5	35%	0.346	43%	0.428	S	S	.	.	H	α-helix	trans	-63.7	-43.6	175.5	-80.9	148.1	0	0	0	111.6	I589 V591 Q597 Y598	I589-L594 HydrophobicContact CG2-CD1 4.03Å; V591-L594 PolarHBondContact O-N 3.07Å; L594-Q597 PolarHBondContact O-N 2.64Å; L594-Y598 PolarHBondContact O-N 2.92Å; L594-Y598 VanDerWaalsContact O-N 3.1Å
595	M	55.9	Low	57.3	Low	7 Å²	7	83.1 Å²	83.1	3%	0.034	46%	0.463	C	S	.	.	H	α-helix	trans	-64.6	-43	178.6	-171.9	179	78.5	0	0	112.7	V591 Y598 L599 L640 D643 F644	V591-M595 PolarHBondContact O-N 3.26Å; V591-M595 VanDerWaalsContact O-N 3.09Å; M595-Y598 PolarHBondContact O-N 2.86Å; M595-L599 HydrophobicContact CG-CD1 4.07Å; M595-L599 WeakPolarHBondContact O-CG 3.43Å; M595-L599 PolarHBondContact O-N 3.45Å; M595-L640 HydrophobicContact SD-CD1 4.38Å; M595-D643 HydrophobicContact CE-CB 3.56Å; M595-F644 HydrophobicContact CG-CE2 4.46Å; M595-F644 HydrophobicContact SD-CD2 3.63Å; M595-F644 HydrophobicContact SD-CE2 3.27Å; M595-F644 WeakPolarHBondContact SD-CE2 3.26Å; M595-F644 HydrophobicContact SD-CZ 4.03Å
596	K	61.9	Low	57	Low	133 Å²	133	83.1 Å²	83.1	58%	0.578	46%	0.463	S	S	*	.	H	α-helix	trans	-66	-37.8	176	-82.4	-178.4	177	178.4	0	112.7	Q592 Y598 N600	Q592-K596 WeakPolarHBondContact O-CB 3.29Å; Q592-K596 WeakPolarHBondContact O-CG 3.29Å; Q592-K596 PolarHBondContact O-N 2.95Å; Q592-K596 VanDerWaalsContact O-N 3.1Å; K596-Y598 VanDerWaalsContact C-N 3.34Å; K596-N600 VanDerWaalsContact O-CB 3.26Å; K596-N600 WeakPolarHBondContact O-CB 3.37Å; K596-N600 PolarHBondContact O-N 3.12Å; K596-N600 PolarHBondContact O-ND2 3.49Å
597	Q	60.9	Low	56.9	Low	127 Å²	127	79.8 Å²	79.8	59%	0.593	46%	0.456	S	S	*	.	H	α-helix	trans	-65.5	-38.9	177.5	-76.1	173.6	-5	0	0	111.8	G593 L594 S601	G593-Q597 WeakPolarHBondContact O-CB 3.25Å; G593-Q597 VanDerWaalsContact O-CG 3.29Å; G593-Q597 WeakPolarHBondContact O-CG 3.33Å; G593-Q597 PolarHBondContact O-N 3.45Å; G593-Q597 VanDerWaalsContact O-N 3.09Å; L594-Q597 PolarHBondContact O-N 2.64Å; Q597-S601 PolarHBondContact O-N 2.95Å; Q597-S601 PolarHBondContact O-OG 3.42Å
598	Y	60.5	Low	56.8	Low	9 Å²	9	81.4 Å²	81.4	4%	0.035	48%	0.477	C	S	.	.	H	α-helix	trans	-68.4	-48.1	174.6	179.2	-92.4	0	0	0	112.2	L594 M595 K596 N600 S601 L602 E614 L618 F621 R622 L649	L594-Y598 PolarHBondContact O-N 2.92Å; L594-Y598 VanDerWaalsContact O-N 3.1Å; M595-Y598 PolarHBondContact O-N 2.86Å; K596-Y598 VanDerWaalsContact C-N 3.34Å; Y598-N600 VanDerWaalsContact C-N 3.31Å; Y598-N600 PolarHBondContact O-N 3Å; Y598-S601 PolarHBondContact O-N 3.33Å; Y598-S601 VanDerWaalsContact O-N 3.15Å; Y598-S601 PolarHBondContact O-OG 2.8Å; Y598-L602 HydrophobicContact CE1-CD1 4.17Å; Y598-L602 HydrophobicContact CE1-CD2 4.43Å; Y598-L602 HydrophobicContact CE1-CG 4.43Å; Y598-E614 VanDerWaalsContact CE2-OE2 3.31Å; Y598-E614 WeakPolarHBondContact CE2-OE2 3.37Å; Y598-E614 VanDerWaalsContact OH-CD 3.26Å; Y598-E614 PolarHBondContact OH-OE1 3.27Å; Y598-E614 PolarHBondContact OH-OE2 3.41Å; Y598-L618 HydrophobicContact CD2-CD2 4.32Å; Y598-L618 HydrophobicContact CE2-CD2 4.39Å; Y598-F621 HydrophobicContact CD2-CB 4.35Å; Y598-R622 HydrophobicContact CE2-CB 3.89Å; Y598-R622 HydrophobicContact CE2-CG 4.36Å; Y598-R622 WeakPolarHBondContact OH-CD 3.44Å; Y598-L649 HydrophobicContact CD1-CD1 4.41Å; Y598-L649 HydrophobicContact CD1-CD2 4.34Å; Y598-L649 HydrophobicContact CE1-CD1 4.28Å; Y598-L649 HydrophobicContact CE1-CD2 3.65Å; Y598-L649 HydrophobicContact CE1-CG 4.26Å
599	L	61.5	Low	57.3	Low	54 Å²	54	83.1 Å²	83.1	28%	0.283	49%	0.485	S	S	.	.	H	α-helix	trans	-62.6	-36	179.6	-72.3	169.1	0	0	0	113	M595 S601 L602 P645 L649	M595-L599 HydrophobicContact CG-CD1 4.07Å; M595-L599 WeakPolarHBondContact O-CG 3.43Å; M595-L599 PolarHBondContact O-N 3.45Å; L599-S601 VanDerWaalsContact C-N 3.26Å; L599-S601 PolarHBondContact O-N 3.44Å; L599-L602 HydrophobicContact CD2-CD1 4.16Å; L599-P645 HydrophobicContact CD2-CG 4.08Å; L599-L649 HydrophobicContact CD2-CD1 4.29Å
600	N	61.9	Low	57.7	Low	141 Å²	141	80.9 Å²	80.9	75%	0.754	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-11.4	179	-70.7	-14.8	0	0	0	114	K596 Y598	K596-N600 VanDerWaalsContact O-CB 3.26Å; K596-N600 WeakPolarHBondContact O-CB 3.37Å; K596-N600 PolarHBondContact O-N 3.12Å; K596-N600 PolarHBondContact O-ND2 3.49Å; Y598-N600 VanDerWaalsContact C-N 3.31Å; Y598-N600 PolarHBondContact O-N 3Å
601	S	59.5	Low	58	Low	55 Å²	55	78 Å²	78	39%	0.385	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	3.8	-177	49.8	0	0	0	0	113.8	Q597 Y598 L599 L618	Q597-S601 PolarHBondContact O-N 2.95Å; Q597-S601 PolarHBondContact O-OG 3.42Å; Y598-S601 PolarHBondContact O-N 3.33Å; Y598-S601 VanDerWaalsContact O-N 3.15Å; Y598-S601 PolarHBondContact O-OG 2.8Å; L599-S601 VanDerWaalsContact C-N 3.26Å; L599-S601 PolarHBondContact O-N 3.44Å; S601-L618 VanDerWaalsContact OG-CD2 3.24Å; S601-L618 WeakPolarHBondContact OG-CD2 3.36Å
602	L	59.1	Low	58.4	Low	85 Å²	85	78.1 Å²	78.1	45%	0.445	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-73.6	127.3	173.4	-75.3	160.9	0	0	0	111.2	Y598 L599	Y598-L602 HydrophobicContact CE1-CD1 4.17Å; Y598-L602 HydrophobicContact CE1-CD2 4.43Å; Y598-L602 HydrophobicContact CE1-CG 4.43Å; L599-L602 HydrophobicContact CD2-CD1 4.16Å
603	P	56.4	Low	58.8	Low	82 Å²	82	79.9 Å²	79.9	53%	0.532	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-70.8	138.1	170.2	-4.9	18.6	0	0	0	111.3	G605 V606	P603-G605 PolarHBondContact O-N 2.87Å; P603-V606 HydrophobicContact CB-CG2 3.97Å; P603-V606 HydrophobicContact CG-CG2 4.13Å
604	E	50.1	Low	59.4	Low	203 Å²	203	79.8 Å²	79.8	95%	0.949	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	123.3	174.1	-76.9	-178.7	165.7	0	0	111
605	G	54.4	Low	59.5	Low	83 Å²	83	85.5 Å²	85.5	86%	0.856	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.4	11.5	168.9	0	0	0	0	0	117.4	P603	P603-G605 PolarHBondContact O-N 2.87Å
606	V	54.7	Low	60.1	Low	99 Å²	99	88.1 Å²	88.1	60%	0.6	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-91.3	132.1	174.6	-170.5	0	0	0	0	110.3	P603	P603-V606 HydrophobicContact CB-CG2 3.97Å; P603-V606 HydrophobicContact CG-CG2 4.13Å
607	P	54.9	Low	60.2	Low	106 Å²	106	88.5 Å²	88.5	69%	0.688	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-63.4	144.5	176.5	25	-32.8	0	0	0	111.5	V609	P607-V609 PolarHBondContact O-N 3.23Å
608	A	57	Low	60.4	Low	86 Å²	86	84.3 Å²	84.3	71%	0.711	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-59.8	121	179.2	0	0	0	0	0	111
609	V	62.2	Low	60.6	Low	60 Å²	60	84.1 Å²	84.1	36%	0.364	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-92.6	152.4	170.8	-83.4	0	0	0	0	110.6	P607 E614 R622	P607-V609 PolarHBondContact O-N 3.23Å; V609-E614 HydrophobicContact CG2-CB 4.41Å; V609-E614 HydrophobicContact CG2-CG 3.36Å; V609-R622 PolarHBondContact O-NH1 3.41Å
610	P	61.9	Low	61	Low	67 Å²	67	87.3 Å²	87.3	44%	0.435	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-53.7	147.6	172.4	-24.3	34	0	0	0	111.6	G612 Q613	P610-G612 PolarHBondContact O-N 3.38Å; P610-Q613 PolarHBondContact O-N 2.85Å
611	A	62.8	Low	61.2	Low	18 Å²	18	83.9 Å²	83.9	15%	0.149	50%	0.499	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	136.2	-174.4	0	0	0	0	0	112.2	Q613 R622 L626 E651	A611-Q613 VanDerWaalsContact C-N 3.33Å; A611-Q613 PolarHBondContact O-N 2.92Å; A611-R622 HydrophobicContact CB-CG 4.22Å; A611-L626 HydrophobicContact CB-CD1 3.32Å; A611-E651 VanDerWaalsContact CB-OE1 3.29Å; A611-E651 WeakPolarHBondContact CB-OE1 3.32Å; A611-E651 PolarHBondContact N-OE1 2.95Å
612	G	61.2	Low	61.8	Low	28 Å²	28	82 Å²	82	29%	0.289	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.5	-3.2	-179.1	0	0	0	0	0	116	P610 N623	P610-G612 PolarHBondContact O-N 3.38Å; G612-N623 WeakPolarHBondContact CA-OD1 3.44Å
613	Q	64.1	Low	62.4	Low	139 Å²	139	81.7 Å²	81.7	65%	0.65	48%	0.482	S	S	*	.			trans	-98.8	9.2	176.1	-60.4	-175.2	18	0	0	113.7	P610 A611	P610-Q613 PolarHBondContact O-N 2.85Å; A611-Q613 VanDerWaalsContact C-N 3.33Å; A611-Q613 PolarHBondContact O-N 2.92Å
614	E	70.1	Confident	63.2	Low	28 Å²	28	83.1 Å²	83.1	13%	0.131	48%	0.48	C	S	.	.	S	Bend	trans	-73	144.2	176.5	-68.2	163	-177.5	0	0	111.1	Y598 V609 L618 R622	Y598-E614 VanDerWaalsContact CE2-OE2 3.31Å; Y598-E614 WeakPolarHBondContact CE2-OE2 3.37Å; Y598-E614 VanDerWaalsContact OH-CD 3.26Å; Y598-E614 PolarHBondContact OH-OE1 3.27Å; Y598-E614 PolarHBondContact OH-OE2 3.41Å; V609-E614 HydrophobicContact CG2-CB 4.41Å; V609-E614 HydrophobicContact CG2-CG 3.36Å; E614-L618 HydrophobicContact CB-CB 4.05Å; E614-R622 WeakPolarHBondContact OE1-CD 3.21Å; E614-R622 IonicContact OE1-CZ 2.93Å; E614-R622 IonicContact OE1-NE 2.85Å; E614-R622 IonicContact OE1-NH1 2.93Å; E614-R622 PolarHBondContact OE1-NH1 3.49Å
615	Q	58.8	Low	64.3	Low	185 Å²	185	74 Å²	74	86%	0.864	44%	0.438	S	S	*	.	S	Bend	trans	-73.8	135.1	178.8	-65.2	-159.6	0.5	0	0	111.6
616	G	68.6	Low	65.3	Low	63 Å²	63	71.3 Å²	71.3	65%	0.649	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.5	-154.7	174.4	0	0	0	0	0	114.4	L618 G619	G616-L618 PolarHBondContact O-N 2.93Å; G616-L618 VanDerWaalsContact O-N 3.16Å; G616-G619 PolarHBondContact O-N 3.07Å
617	E	63.6	Low	66.2	Low	141 Å²	141	69.2 Å²	69.2	66%	0.659	39%	0.394	S	S	*	.	H	α-helix	trans	-63.9	-18.6	-175.7	-60	-176	169.6	0	0	113.3	G619 E620 F621	E617-G619 PolarHBondContact O-N 2.83Å; E617-E620 PolarHBondContact O-N 3.48Å; E617-F621 HydrophobicContact CB-CD2 4.18Å; E617-F621 HydrophobicContact CB-CE2 3.73Å; E617-F621 WeakPolarHBondContact O-CD2 3.18Å; E617-F621 PolarHBondContact O-N 3.13Å
618	L	64.1	Low	67.1	Low	39 Å²	39	67.6 Å²	67.6	20%	0.204	38%	0.376	C	S	.	.	H	α-helix	trans	-58.7	-44.2	177.8	-70	172.5	0	0	0	112.5	Y598 S601 E614 G616 E620 F621 R622	Y598-L618 HydrophobicContact CD2-CD2 4.32Å; Y598-L618 HydrophobicContact CE2-CD2 4.39Å; S601-L618 VanDerWaalsContact OG-CD2 3.24Å; S601-L618 WeakPolarHBondContact OG-CD2 3.36Å; E614-L618 HydrophobicContact CB-CB 4.05Å; G616-L618 PolarHBondContact O-N 2.93Å; G616-L618 VanDerWaalsContact O-N 3.16Å; L618-E620 VanDerWaalsContact C-N 3.31Å; L618-E620 PolarHBondContact O-N 3.26Å; L618-F621 PolarHBondContact O-N 2.94Å; L618-R622 PolarHBondContact O-N 3.26Å
619	G	66.7	Low	68	Low	5 Å²	5	63.5 Å²	63.5	5%	0.052	34%	0.342	C	S	.	.	H	α-helix	trans	-64.4	-35.5	177.6	0	0	0	0	0	112.6	G616 E617 N623	G616-G619 PolarHBondContact O-N 3.07Å; E617-G619 PolarHBondContact O-N 2.83Å; G619-N623 WeakPolarHBondContact O-CB 3.36Å; G619-N623 VanDerWaalsContact O-CG 3.27Å; G619-N623 PolarHBondContact O-N 3.26Å; G619-N623 PolarHBondContact O-ND2 2.98Å
620	E	68.6	Low	68.5	Low	121 Å²	121	63.9 Å²	63.9	57%	0.565	34%	0.342	S	S	*	.	H	α-helix	trans	-68.2	-41.5	174.9	-65.8	-168.2	-178.9	0	0	112.1	E617 L618 N623 K624	E617-E620 PolarHBondContact O-N 3.48Å; L618-E620 VanDerWaalsContact C-N 3.31Å; L618-E620 PolarHBondContact O-N 3.26Å; E620-N623 PolarHBondContact O-N 3.05Å; E620-K624 WeakPolarHBondContact O-CB 3.27Å; E620-K624 WeakPolarHBondContact O-CG 3.29Å; E620-K624 PolarHBondContact O-N 3.14Å
621	F	67.4	Low	69	Low	69 Å²	69	67.1 Å²	67.1	30%	0.303	35%	0.354	S	S	.	.	H	α-helix	trans	-65.6	-42	177.1	-69.6	-56.4	0	0	0	111.9	Y598 E617 L618 K624 L625	Y598-F621 HydrophobicContact CD2-CB 4.35Å; E617-F621 HydrophobicContact CB-CD2 4.18Å; E617-F621 HydrophobicContact CB-CE2 3.73Å; E617-F621 WeakPolarHBondContact O-CD2 3.18Å; E617-F621 PolarHBondContact O-N 3.13Å; L618-F621 PolarHBondContact O-N 2.94Å; F621-K624 PolarHBondContact O-N 3.26Å; F621-L625 WeakPolarHBondContact O-CB 3.4Å; F621-L625 PolarHBondContact O-N 2.81Å
622	R	71.6	Confident	69.4	Low	14 Å²	14	67.3 Å²	67.3	5%	0.053	35%	0.354	C	S	.	.	H	α-helix	trans	-65.2	-40.8	176.7	-164.7	170	-178.6	-168.8	-9.4	112.3	Y598 V609 A611 E614 L618 L625 L626 E652	Y598-R622 HydrophobicContact CE2-CB 3.89Å; Y598-R622 HydrophobicContact CE2-CG 4.36Å; Y598-R622 WeakPolarHBondContact OH-CD 3.44Å; V609-R622 PolarHBondContact O-NH1 3.41Å; A611-R622 HydrophobicContact CB-CG 4.22Å; E614-R622 WeakPolarHBondContact OE1-CD 3.21Å; E614-R622 IonicContact OE1-CZ 2.93Å; E614-R622 IonicContact OE1-NE 2.85Å; E614-R622 IonicContact OE1-NH1 2.93Å; E614-R622 PolarHBondContact OE1-NH1 3.49Å; L618-R622 PolarHBondContact O-N 3.26Å; R622-L625 PolarHBondContact O-N 3.24Å; R622-L626 PolarHBondContact O-N 3.29Å; R622-E652 WeakPolarHBondContact CG-OE1 3.16Å; R622-E652 IonicContact CZ-OE1 2.87Å; R622-E652 IonicContact NE-OE1 2.74Å; R622-E652 PolarHBondContact NE-OE1 3.02Å; R622-E652 IonicContact NE-OE2 2.73Å; R622-E652 IonicContact NH2-OE1 2.64Å; R622-E652 IonicContact NH2-OE2 3.87Å
623	N	71.9	Confident	69.6	Low	79 Å²	79	71.6 Å²	71.6	42%	0.422	38%	0.375	S	S	.	.	H	α-helix	trans	-64.9	-38.6	174	-78	-27.1	0	0	0	112.9	G612 G619 E620 L626 S627	G612-N623 WeakPolarHBondContact CA-OD1 3.44Å; G619-N623 WeakPolarHBondContact O-CB 3.36Å; G619-N623 VanDerWaalsContact O-CG 3.27Å; G619-N623 PolarHBondContact O-N 3.26Å; G619-N623 PolarHBondContact O-ND2 2.98Å; E620-N623 PolarHBondContact O-N 3.05Å; N623-L626 PolarHBondContact O-N 3.14Å; N623-S627 WeakPolarHBondContact O-CB 3.33Å; N623-S627 PolarHBondContact O-N 2.74Å; N623-S627 PolarHBondContact O-OG 3.4Å
624	K	72.4	Confident	69.3	Low	112 Å²	112	70 Å²	70	49%	0.487	38%	0.379	S	S	.	.	H	α-helix	trans	-65.8	-38.2	173.6	-76.8	171.7	-177.4	164	0	112	E620 F621 S627 F628	E620-K624 WeakPolarHBondContact O-CB 3.27Å; E620-K624 WeakPolarHBondContact O-CG 3.29Å; E620-K624 PolarHBondContact O-N 3.14Å; F621-K624 PolarHBondContact O-N 3.26Å; K624-S627 PolarHBondContact O-OG 3.39Å; K624-S627 VanDerWaalsContact O-OG 3.07Å; K624-F628 VanDerWaalsContact O-CB 3.3Å; K624-F628 WeakPolarHBondContact O-CB 3.31Å; K624-F628 PolarHBondContact O-N 3.37Å
625	L	73.6	Confident	69.3	Low	12 Å²	12	70 Å²	70	6%	0.063	38%	0.378	C	S	.	.	H	α-helix	trans	-64.9	-46.9	175.1	-179.9	61.9	0	0	0	111	F621 R622 F628 L629 E652	F621-L625 WeakPolarHBondContact O-CB 3.4Å; F621-L625 PolarHBondContact O-N 2.81Å; R622-L625 PolarHBondContact O-N 3.24Å; L625-F628 PolarHBondContact O-N 3.13Å; L625-L629 HydrophobicContact CD1-CD1 4.13Å; L625-L629 HydrophobicContact CD1-CG 4.2Å; L625-L629 HydrophobicContact CG-CD1 4.1Å; L625-L629 WeakPolarHBondContact O-CB 3.49Å; L625-L629 VanDerWaalsContact O-CG 3.28Å; L625-L629 WeakPolarHBondContact O-CG 3.21Å; L625-L629 PolarHBondContact O-N 2.91Å; L625-E652 HydrophobicContact CD2-CG 4.2Å; L625-E652 HydrophobicContact CG-CG 4.41Å
626	L	74.5	Confident	69.9	Low	26 Å²	26	66 Å²	66	14%	0.136	36%	0.359	C	S	.	.	H	α-helix	trans	-60.2	-48	176.3	-80.2	172.5	0	0	0	112.4	A611 R622 N623 F628 L629 D630 E651 E652 L655	A611-L626 HydrophobicContact CB-CD1 3.32Å; R622-L626 PolarHBondContact O-N 3.29Å; N623-L626 PolarHBondContact O-N 3.14Å; L626-F628 VanDerWaalsContact C-N 3.32Å; L626-F628 PolarHBondContact O-N 3.45Å; L626-L629 PolarHBondContact O-N 3.28Å; L626-D630 VanDerWaalsContact O-CB 3.32Å; L626-D630 WeakPolarHBondContact O-CB 3.41Å; L626-D630 PolarHBondContact O-N 3.29Å; L626-E651 HydrophobicContact CD2-CB 4.17Å; L626-E652 HydrophobicContact CD2-CB 4.37Å; L626-E652 HydrophobicContact CD2-CG 3.6Å; L626-E652 HydrophobicContact CG-CG 4.03Å; L626-L655 HydrophobicContact CD2-CD1 3.67Å
627	S	74.1	Confident	70.1	Confident	56 Å²	56	64.3 Å²	64.3	39%	0.392	34%	0.337	S	S	.	.	H	α-helix	trans	-64.1	-38.4	179.6	68.2	0	0	0	0	112	N623 K624 D630 I631	N623-S627 WeakPolarHBondContact O-CB 3.33Å; N623-S627 PolarHBondContact O-N 2.74Å; N623-S627 PolarHBondContact O-OG 3.4Å; K624-S627 PolarHBondContact O-OG 3.39Å; K624-S627 VanDerWaalsContact O-OG 3.07Å; S627-D630 PolarHBondContact O-N 3.17Å; S627-I631 VanDerWaalsContact O-CB 3.31Å; S627-I631 WeakPolarHBondContact O-CB 3.49Å; S627-I631 VanDerWaalsContact O-CG1 3.24Å; S627-I631 WeakPolarHBondContact O-CG1 3.43Å; S627-I631 PolarHBondContact O-N 3.1Å
628	F	73.9	Confident	70.5	Confident	71 Å²	71	60.6 Å²	60.6	31%	0.311	33%	0.33	S	S	.	.	H	α-helix	trans	-64.5	-47.6	174	-179.2	-86.4	0	0	0	111.8	V591 K624 L625 L626 D630 I631 S632 Y635	V591-F628 HydrophobicContact CB-CE1 4.39Å; V591-F628 HydrophobicContact CG1-CD1 4.49Å; V591-F628 HydrophobicContact CG1-CE1 4.28Å; V591-F628 HydrophobicContact CG2-CD1 4Å; V591-F628 HydrophobicContact CG2-CE1 3.19Å; V591-F628 HydrophobicContact CG2-CE2 4.33Å; V591-F628 HydrophobicContact CG2-CZ 3.38Å; K624-F628 VanDerWaalsContact O-CB 3.3Å; K624-F628 WeakPolarHBondContact O-CB 3.31Å; K624-F628 PolarHBondContact O-N 3.37Å; L625-F628 PolarHBondContact O-N 3.13Å; L626-F628 VanDerWaalsContact C-N 3.32Å; L626-F628 PolarHBondContact O-N 3.45Å; F628-D630 VanDerWaalsContact C-N 3.26Å; F628-D630 PolarHBondContact O-N 3.39Å; F628-I631 PolarHBondContact O-N 3.21Å; F628-S632 WeakPolarHBondContact CE2-OG 3.4Å; F628-S632 VanDerWaalsContact CZ-OG 3.26Å; F628-S632 WeakPolarHBondContact CZ-OG 3.48Å; F628-S632 WeakPolarHBondContact O-CB 3.42Å; F628-S632 PolarHBondContact O-N 3.47Å; F628-Y635 HydrophobicContact CD1-CD1 4.48Å; F628-Y635 AromaticContact CE1-CD1 3.76Å; F628-Y635 HydrophobicContact CE1-CD1 3.76Å; F628-Y635 HydrophobicContact CE1-CE1 4.34Å
629	L	75.7	Confident	70.8	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-63.7	-33.6	179.6	-70.8	178.3	0	0	0	112.1	L625 L626 Y635 L640 F644 E652 L655 L656 R659	L625-L629 HydrophobicContact CD1-CD1 4.13Å; L625-L629 HydrophobicContact CD1-CG 4.2Å; L625-L629 HydrophobicContact CG-CD1 4.1Å; L625-L629 WeakPolarHBondContact O-CB 3.49Å; L625-L629 VanDerWaalsContact O-CG 3.28Å; L625-L629 WeakPolarHBondContact O-CG 3.21Å; L625-L629 PolarHBondContact O-N 2.91Å; L626-L629 PolarHBondContact O-N 3.28Å; L629-Y635 HydrophobicContact CD2-CE1 3.99Å; L629-Y635 HydrophobicContact CD2-CE2 4.06Å; L629-Y635 PolarHBondContact O-OH 3.49Å; L629-L640 HydrophobicContact CD2-CD2 3.73Å; L629-F644 HydrophobicContact CD1-CZ 4.31Å; L629-E652 HydrophobicContact CD1-CB 3.83Å; L629-E652 HydrophobicContact CD1-CG 4.14Å; L629-L655 HydrophobicContact CB-CD1 4.36Å; L629-L656 HydrophobicContact CD2-CD2 3.93Å; L629-R659 VanDerWaalsContact O-CZ 3.31Å; L629-R659 PolarHBondContact O-NE 3.3Å; L629-R659 PolarHBondContact O-NH2 2.93Å; L629-R659 VanDerWaalsContact O-NH2 3.09Å
630	D	73.5	Confident	71	Confident	69 Å²	69	67.1 Å²	67.1	37%	0.369	35%	0.352	S	S	.	.	H	α-helix	trans	-74.7	-45	177.9	-159.8	29.9	0	0	0	111.8	L626 S627 F628 L655 R659 R686	L626-D630 VanDerWaalsContact O-CB 3.32Å; L626-D630 WeakPolarHBondContact O-CB 3.41Å; L626-D630 PolarHBondContact O-N 3.29Å; S627-D630 PolarHBondContact O-N 3.17Å; F628-D630 VanDerWaalsContact C-N 3.26Å; F628-D630 PolarHBondContact O-N 3.39Å; D630-L655 HydrophobicContact CB-CD1 4.44Å; D630-R659 PolarHBondContact O-NH2 3.29Å; D630-R686 IonicContact OD1-NH1 3.08Å; D630-R686 PolarHBondContact OD1-NH1 3.22Å; D630-R686 IonicContact OD2-NH1 3.55Å; D630-R686 PolarHBondContact OD2-NH1 3.05Å
631	I	71.7	Confident	71.2	Confident	134 Å²	134	62.4 Å²	62.4	69%	0.687	33%	0.33	S	S	*	.	H	α-helix	trans	-89.9	-47.2	-171.7	-59.8	167.5	0	0	0	113.1	S627 F628	S627-I631 VanDerWaalsContact O-CB 3.31Å; S627-I631 WeakPolarHBondContact O-CB 3.49Å; S627-I631 VanDerWaalsContact O-CG1 3.24Å; S627-I631 WeakPolarHBondContact O-CG1 3.43Å; S627-I631 PolarHBondContact O-N 3.1Å; F628-I631 PolarHBondContact O-N 3.21Å
632	S	70.5	Confident	71.5	Confident	22 Å²	22	62.9 Å²	62.9	15%	0.154	34%	0.342	C	S	.	.			trans	-75.1	134	-169	178.7	0	0	0	0	111.3	F628 S634 Y635 R659	F628-S632 WeakPolarHBondContact CE2-OG 3.4Å; F628-S632 VanDerWaalsContact CZ-OG 3.26Å; F628-S632 WeakPolarHBondContact CZ-OG 3.48Å; F628-S632 WeakPolarHBondContact O-CB 3.42Å; F628-S632 PolarHBondContact O-N 3.47Å; S632-S634 PolarHBondContact OG-N 3.43Å; S632-Y635 WeakPolarHBondContact O-CE1 3.31Å; S632-R659 PolarHBondContact O-NH1 3.13Å; S632-R659 PolarHBondContact O-NH2 2.82Å
633	T	66.1	Low	71.3	Confident	118 Å²	118	65.8 Å²	65.8	72%	0.724	36%	0.359	S	S	*	.			trans	-94.9	-2.6	174.2	47.1	0	0	0	0	113.4	Y635	T633-Y635 VanDerWaalsContact C-N 3.31Å; T633-Y635 PolarHBondContact O-N 3.05Å; T633-Y635 VanDerWaalsContact O-N 3.14Å
634	S	57.7	Low	71.1	Confident	105 Å²	105	62.3 Å²	62.3	73%	0.734	34%	0.34	S	S	*	.			trans	-91.1	39.2	-165.7	-39.9	0	0	0	0	113.7	S632	S632-S634 PolarHBondContact OG-N 3.43Å
635	Y	70.5	Confident	70.9	Confident	29 Å²	29	58.4 Å²	58.4	11%	0.114	33%	0.326	C	S	.	.	S	Bend	trans	-144.8	151.9	177.6	66.7	-97.1	0	0	0	111.4	F628 L629 S632 T633 P637 L640 L656 R659	F628-Y635 HydrophobicContact CD1-CD1 4.48Å; F628-Y635 AromaticContact CE1-CD1 3.76Å; F628-Y635 HydrophobicContact CE1-CD1 3.76Å; F628-Y635 HydrophobicContact CE1-CE1 4.34Å; L629-Y635 HydrophobicContact CD2-CE1 3.99Å; L629-Y635 HydrophobicContact CD2-CE2 4.06Å; L629-Y635 PolarHBondContact O-OH 3.49Å; S632-Y635 WeakPolarHBondContact O-CE1 3.31Å; T633-Y635 VanDerWaalsContact C-N 3.31Å; T633-Y635 PolarHBondContact O-N 3.05Å; T633-Y635 VanDerWaalsContact O-N 3.14Å; Y635-P637 HydrophobicContact CD2-CG 4.17Å; Y635-P637 HydrophobicContact CE2-CB 4.2Å; Y635-P637 HydrophobicContact CE2-CG 3.83Å; Y635-P637 VanDerWaalsContact O-CD 3.28Å; Y635-P637 WeakPolarHBondContact O-CD 3.48Å; Y635-L640 HydrophobicContact CD2-CD2 4.35Å; Y635-L656 HydrophobicContact CD2-CD2 4.26Å; Y635-L656 HydrophobicContact CE2-CD2 3.44Å; Y635-L656 VanDerWaalsContact CE2-CD2 3.44Å; Y635-R659 WeakPolarHBondContact OH-CD 3.26Å; Y635-R659 PolarHBondContact OH-NE 3Å; Y635-R659 PolarHBondContact OH-NH1 3.22Å
636	E	70.4	Confident	70.5	Confident	100 Å²	100	61.6 Å²	61.6	47%	0.467	34%	0.34	S	S	.	.			trans	-90.3	107.1	175.3	-75.5	-177.3	-154.1	0	0	110.7	A638 R639 L640	E636-A638 VanDerWaalsContact C-N 3.28Å; E636-A638 PolarHBondContact O-N 3.11Å; E636-R639 HydrophobicContact CB-CB 4.35Å; E636-R639 HydrophobicContact CB-CG 4.5Å; E636-R639 PolarHBondContact O-N 3.18Å; E636-R639 IonicContact OE1-CZ 2.78Å; E636-R639 IonicContact OE1-NH1 3.36Å; E636-R639 PolarHBondContact OE1-NH1 3.15Å; E636-R639 IonicContact OE1-NH2 3.74Å; E636-R639 WeakPolarHBondContact OE2-CD 3.4Å; E636-R639 WeakPolarHBondContact OE2-CG 3.47Å; E636-R639 IonicContact OE2-CZ 3.88Å; E636-R639 IonicContact OE2-NE 2.66Å; E636-R639 PolarHBondContact OE2-NE 2.86Å; E636-R639 VanDerWaalsContact OE2-NE 3.08Å; E636-R639 IonicContact OE2-NH1 3.34Å; E636-R639 PolarHBondContact OE2-NH1 2.68Å; E636-R639 IonicContact OE2-NH2 3.88Å; E636-L640 PolarHBondContact O-N 3.18Å; E636-L640 VanDerWaalsContact O-N 3.13Å
637	P	72.6	Confident	69.9	Low	28 Å²	28	65.3 Å²	65.3	18%	0.182	36%	0.36	C	S	.	.	H	α-helix	trans	-63.5	-33.5	-173.9	-21.7	33.6	0	0	0	113.2	Y635 R639 L640 I641 L656 R659 M660	Y635-P637 HydrophobicContact CD2-CG 4.17Å; Y635-P637 HydrophobicContact CE2-CB 4.2Å; Y635-P637 HydrophobicContact CE2-CG 3.83Å; Y635-P637 VanDerWaalsContact O-CD 3.28Å; Y635-P637 WeakPolarHBondContact O-CD 3.48Å; P637-R639 PolarHBondContact O-N 3.4Å; P637-L640 PolarHBondContact O-N 2.9Å; P637-I641 WeakPolarHBondContact O-CB 3.28Å; P637-I641 WeakPolarHBondContact O-CG2 3.41Å; P637-I641 PolarHBondContact O-N 3.29Å; P637-L656 HydrophobicContact CB-CD2 4.18Å; P637-R659 HydrophobicContact CB-CB 4.39Å; P637-R659 HydrophobicContact CG-CB 4.01Å; P637-M660 HydrophobicContact CB-CG 3.63Å; P637-M660 HydrophobicContact CB-SD 4.22Å; P637-M660 HydrophobicContact CG-CG 4.49Å
638	A	73.1	Confident	69.7	Low	63 Å²	63	63.4 Å²	63.4	52%	0.521	35%	0.349	S	S	.	.	H	α-helix	trans	-68.9	-31.2	-178.1	0	0	0	0	0	113.7	E636 M660	E636-A638 VanDerWaalsContact C-N 3.28Å; E636-A638 PolarHBondContact O-N 3.11Å; A638-M660 HydrophobicContact CB-CE 3.85Å
639	R	70.5	Confident	69.7	Low	166 Å²	166	60.5 Å²	60.5	63%	0.626	34%	0.337	S	S	*	.	H	α-helix	trans	-83.2	-35.2	174.1	-71.7	-169.2	-178.6	137.9	6.8	111.7	E636 P637 S642	E636-R639 HydrophobicContact CB-CB 4.35Å; E636-R639 HydrophobicContact CB-CG 4.5Å; E636-R639 PolarHBondContact O-N 3.18Å; E636-R639 IonicContact OE1-CZ 2.78Å; E636-R639 IonicContact OE1-NH1 3.36Å; E636-R639 PolarHBondContact OE1-NH1 3.15Å; E636-R639 IonicContact OE1-NH2 3.74Å; E636-R639 WeakPolarHBondContact OE2-CD 3.4Å; E636-R639 WeakPolarHBondContact OE2-CG 3.47Å; E636-R639 IonicContact OE2-CZ 3.88Å; E636-R639 IonicContact OE2-NE 2.66Å; E636-R639 PolarHBondContact OE2-NE 2.86Å; E636-R639 VanDerWaalsContact OE2-NE 3.08Å; E636-R639 IonicContact OE2-NH1 3.34Å; E636-R639 PolarHBondContact OE2-NH1 2.68Å; E636-R639 IonicContact OE2-NH2 3.88Å; P637-R639 PolarHBondContact O-N 3.4Å; R639-S642 PolarHBondContact O-OG 3.34Å
640	L	71.4	Confident	69.7	Low	15 Å²	15	61.5 Å²	61.5	8%	0.079	34%	0.342	C	S	.	.	H	α-helix	trans	-70.2	-39.1	-178.7	-161.4	70.4	0	0	0	111.4	V591 M595 L629 Y635 E636 P637 S642 D643 F644 L656	V591-L640 HydrophobicContact CG1-CD1 4.22Å; V591-L640 HydrophobicContact CG1-CD2 4.12Å; M595-L640 HydrophobicContact SD-CD1 4.38Å; L629-L640 HydrophobicContact CD2-CD2 3.73Å; Y635-L640 HydrophobicContact CD2-CD2 4.35Å; E636-L640 PolarHBondContact O-N 3.18Å; E636-L640 VanDerWaalsContact O-N 3.13Å; P637-L640 PolarHBondContact O-N 2.9Å; L640-S642 VanDerWaalsContact C-N 3.26Å; L640-S642 PolarHBondContact O-N 3.38Å; L640-D643 PolarHBondContact O-N 2.93Å; L640-D643 VanDerWaalsContact O-N 3.14Å; L640-F644 HydrophobicContact CD2-CE2 4.13Å; L640-F644 HydrophobicContact CG-CD2 4.45Å; L640-F644 HydrophobicContact CG-CE2 3.89Å; L640-F644 VanDerWaalsContact O-CD2 3.3Å; L640-F644 WeakPolarHBondContact O-CD2 3.37Å; L640-L656 HydrophobicContact CD2-CD1 4.28Å; L640-L656 HydrophobicContact CD2-CD2 4.07Å; L640-L656 HydrophobicContact CG-CD1 4.49Å
641	I	72.9	Confident	70	Confident	22 Å²	22	59.7 Å²	59.7	11%	0.113	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-66.3	-21.7	-178.2	-158.5	170	0	0	0	114.2	P637 D643 R653 L656 L657 M660	P637-I641 WeakPolarHBondContact O-CB 3.28Å; P637-I641 WeakPolarHBondContact O-CG2 3.41Å; P637-I641 PolarHBondContact O-N 3.29Å; I641-D643 VanDerWaalsContact C-N 3.26Å; I641-D643 PolarHBondContact O-N 3.1Å; I641-R653 HydrophobicContact CD1-CG 4.3Å; I641-R653 HydrophobicContact CG1-CG 4.47Å; I641-L656 HydrophobicContact CB-CD1 4.24Å; I641-L656 HydrophobicContact CD1-CB 4.34Å; I641-L656 HydrophobicContact CG1-CD1 4.45Å; I641-L657 HydrophobicContact CD1-CD2 3.53Å; I641-L657 HydrophobicContact CD1-CG 3.72Å; I641-M660 HydrophobicContact CD1-SD 4.38Å; I641-M660 HydrophobicContact CG2-SD 4.21Å
642	S	72.1	Confident	70.5	Confident	79 Å²	79	53.3 Å²	53.3	55%	0.552	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-71.6	-23.8	175.6	57.7	0	0	0	0	113	R639 L640	R639-S642 PolarHBondContact O-OG 3.34Å; L640-S642 VanDerWaalsContact C-N 3.26Å; L640-S642 PolarHBondContact O-N 3.38Å
643	D	67.8	Low	71	Confident	76 Å²	76	53.7 Å²	53.7	41%	0.406	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-92.3	-5.9	-177.8	-62.1	-9.6	0	0	0	112	Q592 M595 L640 I641	Q592-D643 PolarHBondContact NE2-OD2 3.27Å; M595-D643 HydrophobicContact CE-CB 3.56Å; L640-D643 PolarHBondContact O-N 2.93Å; L640-D643 VanDerWaalsContact O-N 3.14Å; I641-D643 VanDerWaalsContact C-N 3.26Å; I641-D643 PolarHBondContact O-N 3.1Å
644	F	68.7	Low	71.8	Confident	5 Å²	5	48.1 Å²	48.1	2%	0.022	26%	0.262	C	S	.	.	S	Bend	trans	-82.7	141.9	-179.8	-93.3	-113.6	0	0	0	112.3	M595 L629 L640 L649 E652 L656	M595-F644 HydrophobicContact CG-CE2 4.46Å; M595-F644 HydrophobicContact SD-CD2 3.63Å; M595-F644 HydrophobicContact SD-CE2 3.27Å; M595-F644 WeakPolarHBondContact SD-CE2 3.26Å; M595-F644 HydrophobicContact SD-CZ 4.03Å; L629-F644 HydrophobicContact CD1-CZ 4.31Å; L640-F644 HydrophobicContact CD2-CE2 4.13Å; L640-F644 HydrophobicContact CG-CD2 4.45Å; L640-F644 HydrophobicContact CG-CE2 3.89Å; L640-F644 VanDerWaalsContact O-CD2 3.3Å; L640-F644 WeakPolarHBondContact O-CD2 3.37Å; F644-L649 HydrophobicContact CD1-CB 3.88Å; F644-L649 HydrophobicContact CD1-CD1 4Å; F644-L649 HydrophobicContact CE1-CB 3.9Å; F644-L649 HydrophobicContact CE1-CD1 3.82Å; F644-L649 HydrophobicContact CE1-CG 4.46Å; F644-E652 HydrophobicContact CE1-CB 3.59Å; F644-E652 HydrophobicContact CE1-CG 4.39Å; F644-E652 HydrophobicContact CZ-CB 4.2Å; F644-L656 HydrophobicContact CD2-CD1 4.08Å; F644-L656 HydrophobicContact CE1-CD1 4.49Å; F644-L656 HydrophobicContact CE2-CD1 3.85Å; F644-L656 HydrophobicContact CG-CD1 4.48Å; F644-L656 HydrophobicContact CZ-CD1 4.07Å
645	P	67.6	Low	73	Confident	31 Å²	31	43.5 Å²	43.5	20%	0.201	23%	0.229	C	C	.	.			trans	-61.4	155.6	173	26.4	-33.1	0	0	0	112.1	L599 D647 L649	L599-P645 HydrophobicContact CD2-CG 4.08Å; P645-D647 WeakPolarHBondContact CB-OD1 3.36Å; P645-L649 HydrophobicContact CG-CD1 4.13Å; P645-L649 HydrophobicContact CG-CG 4.5Å
646	F	66	Low	73.5	Confident	79 Å²	79	42.1 Å²	42.1	35%	0.346	22%	0.224	S	C	.	.	S	Bend	trans	-97	-5.3	-178.2	-69.7	-69.9	0	0	0	113.5	P717 K719	F646-P717 VanDerWaalsContact CB-O 3.32Å; F646-P717 WeakPolarHBondContact CB-O 3.3Å; F646-P717 HydrophobicContact CD1-CB 4.37Å; F646-P717 HydrophobicContact CD1-CG 3.77Å; F646-P717 WeakPolarHBondContact CD1-O 3.47Å; F646-P717 HydrophobicContact CE1-CB 4.48Å; F646-P717 HydrophobicContact CE1-CG 3.48Å; F646-P717 VanDerWaalsContact CE1-CG 3.48Å; F646-P717 WeakPolarHBondContact CG-O 3.24Å; F646-P717 HydrophobicContact CZ-CG 4.03Å; F646-K719 PolarHBondContact O-N 2.93Å
647	D	61.3	Low	74.1	Confident	104 Å²	104	37.6 Å²	37.6	56%	0.556	20%	0.203	S	C	*	.	S	Bend	trans	-125.1	8.4	-173.7	53.7	-19	0	0	0	112.3	P645	P645-D647 WeakPolarHBondContact CB-OD1 3.36Å
648	G	69.2	Low	74.5	Confident	16 Å²	16	36.5 Å²	36.5	17%	0.165	20%	0.196	C	C	.	.	S	Bend	trans	-156.6	175	178.9	0	0	0	0	0	113.3	L650	G648-L650 PolarHBondContact O-N 2.69Å
649	L	73.7	Confident	74.9	Confident	10 Å²	10	37.2 Å²	37.2	5%	0.052	19%	0.186	C	C	.	.			trans	54.6	44.6	179	-63.4	171	0	0	0	114.1	Y598 L599 F644 P645 E651 E652 R653	Y598-L649 HydrophobicContact CD1-CD1 4.41Å; Y598-L649 HydrophobicContact CD1-CD2 4.34Å; Y598-L649 HydrophobicContact CE1-CD1 4.28Å; Y598-L649 HydrophobicContact CE1-CD2 3.65Å; Y598-L649 HydrophobicContact CE1-CG 4.26Å; L599-L649 HydrophobicContact CD2-CD1 4.29Å; F644-L649 HydrophobicContact CD1-CB 3.88Å; F644-L649 HydrophobicContact CD1-CD1 4Å; F644-L649 HydrophobicContact CE1-CB 3.9Å; F644-L649 HydrophobicContact CE1-CD1 3.82Å; F644-L649 HydrophobicContact CE1-CG 4.46Å; P645-L649 HydrophobicContact CG-CD1 4.13Å; P645-L649 HydrophobicContact CG-CG 4.5Å; L649-E651 PolarHBondContact O-N 3Å; L649-E652 VanDerWaalsContact CA-OE2 3.24Å; L649-E652 WeakPolarHBondContact CA-OE2 3.26Å; L649-E652 HydrophobicContact CB-CB 4.37Å; L649-E652 HydrophobicContact CD2-CG 4.26Å; L649-R653 VanDerWaalsContact O-CB 3.32Å; L649-R653 WeakPolarHBondContact O-CB 3.5Å; L649-R653 PolarHBondContact O-N 3.44Å
650	L	76.4	Confident	75.4	Confident	20 Å²	20	32.2 Å²	32.2	11%	0.105	17%	0.17	C	C	.	.	H	α-helix	trans	-65.9	-35.9	-173.1	-65	173.6	0	0	0	113.1	G648 A654 I669 V673 L674 M720	G648-L650 PolarHBondContact O-N 2.69Å; L650-A654 WeakPolarHBondContact O-CB 3.29Å; L650-A654 PolarHBondContact O-N 2.77Å; L650-I669 HydrophobicContact CB-CG2 3.92Å; L650-V673 HydrophobicContact CD1-CG1 3.63Å; L650-L674 HydrophobicContact CB-CD2 4.36Å; L650-L674 HydrophobicContact CD1-CD2 4.06Å; L650-M720 HydrophobicContact CD1-SD 4.15Å
651	E	79.9	Confident	75.8	Confident	32 Å²	32	33.3 Å²	33.3	15%	0.15	19%	0.185	C	C	.	.	H	α-helix	trans	-69.1	-45.6	179	-66.4	178.3	-126.2	0	0	111.5	A611 L626 L649 R653 A654 L655 L674	A611-E651 VanDerWaalsContact CB-OE1 3.29Å; A611-E651 WeakPolarHBondContact CB-OE1 3.32Å; A611-E651 PolarHBondContact N-OE1 2.95Å; L626-E651 HydrophobicContact CD2-CB 4.17Å; L649-E651 PolarHBondContact O-N 3Å; E651-R653 VanDerWaalsContact C-N 3.32Å; E651-R653 PolarHBondContact O-N 3.4Å; E651-A654 WeakPolarHBondContact O-CB 3.37Å; E651-A654 PolarHBondContact O-N 3.03Å; E651-L655 PolarHBondContact O-N 3.33Å; E651-L674 HydrophobicContact CG-CD1 4Å
652	E	81.5	Confident	76.4	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-62.3	-41.2	175.7	-62.4	78.2	176.9	0	0	110.8	R622 L625 L626 L629 F644 L649 L655 L656	R622-E652 WeakPolarHBondContact CG-OE1 3.16Å; R622-E652 IonicContact CZ-OE1 2.87Å; R622-E652 IonicContact NE-OE1 2.74Å; R622-E652 PolarHBondContact NE-OE1 3.02Å; R622-E652 IonicContact NE-OE2 2.73Å; R622-E652 IonicContact NH2-OE1 2.64Å; R622-E652 IonicContact NH2-OE2 3.87Å; L625-E652 HydrophobicContact CD2-CG 4.2Å; L625-E652 HydrophobicContact CG-CG 4.41Å; L626-E652 HydrophobicContact CD2-CB 4.37Å; L626-E652 HydrophobicContact CD2-CG 3.6Å; L626-E652 HydrophobicContact CG-CG 4.03Å; L629-E652 HydrophobicContact CD1-CB 3.83Å; L629-E652 HydrophobicContact CD1-CG 4.14Å; F644-E652 HydrophobicContact CE1-CB 3.59Å; F644-E652 HydrophobicContact CE1-CG 4.39Å; F644-E652 HydrophobicContact CZ-CB 4.2Å; L649-E652 VanDerWaalsContact CA-OE2 3.24Å; L649-E652 WeakPolarHBondContact CA-OE2 3.26Å; L649-E652 HydrophobicContact CB-CB 4.37Å; L649-E652 HydrophobicContact CD2-CG 4.26Å; E652-L655 PolarHBondContact O-N 3.5Å; E652-L656 WeakPolarHBondContact O-CG 3.28Å; E652-L656 PolarHBondContact O-N 2.91Å
653	R	81.4	Confident	77.1	Confident	30 Å²	30	33.4 Å²	33.4	11%	0.113	18%	0.175	C	C	.	.	H	α-helix	trans	-63.3	-41.1	174.4	-171.7	178.1	-174.5	89.5	7	111.7	I641 L649 E651 L656 L657 I669	I641-R653 HydrophobicContact CD1-CG 4.3Å; I641-R653 HydrophobicContact CG1-CG 4.47Å; L649-R653 VanDerWaalsContact O-CB 3.32Å; L649-R653 WeakPolarHBondContact O-CB 3.5Å; L649-R653 PolarHBondContact O-N 3.44Å; E651-R653 VanDerWaalsContact C-N 3.32Å; E651-R653 PolarHBondContact O-N 3.4Å; R653-L656 PolarHBondContact O-N 3.45Å; R653-L657 HydrophobicContact CG-CD1 4.11Å; R653-L657 WeakPolarHBondContact O-CB 3.34Å; R653-L657 VanDerWaalsContact O-CG 3.25Å; R653-L657 WeakPolarHBondContact O-CG 3.5Å; R653-L657 PolarHBondContact O-N 2.91Å; R653-I669 HydrophobicContact CG-CD1 4.32Å
654	A	82.6	Confident	77.8	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.3	-38.7	176.4	0	0	0	0	0	112.1	L650 E651 L657 G658 A666 I669 Y670	L650-A654 WeakPolarHBondContact O-CB 3.29Å; L650-A654 PolarHBondContact O-N 2.77Å; E651-A654 WeakPolarHBondContact O-CB 3.37Å; E651-A654 PolarHBondContact O-N 3.03Å; A654-L657 PolarHBondContact O-N 3.39Å; A654-G658 PolarHBondContact O-N 2.95Å; A654-A666 HydrophobicContact CB-CB 4.31Å; A654-A666 WeakPolarHBondContact O-CB 3.41Å; A654-I669 HydrophobicContact CB-CB 4.35Å; A654-I669 HydrophobicContact CB-CD1 4.16Å; A654-I669 HydrophobicContact CB-CG2 4.3Å; A654-Y670 HydrophobicContact CB-CD2 4.31Å; A654-Y670 HydrophobicContact CB-CE1 4.38Å; A654-Y670 HydrophobicContact CB-CE2 3.58Å
655	L	82.8	Confident	78.5	Confident	9 Å²	9	35.9 Å²	35.9	5%	0.047	18%	0.184	C	C	.	.	H	α-helix	trans	-62.2	-46.5	172.9	-70	175	0	0	0	112	L626 L629 D630 E651 E652 L657 G658 R659	L626-L655 HydrophobicContact CD2-CD1 3.67Å; L629-L655 HydrophobicContact CB-CD1 4.36Å; D630-L655 HydrophobicContact CB-CD1 4.44Å; E651-L655 PolarHBondContact O-N 3.33Å; E652-L655 PolarHBondContact O-N 3.5Å; L655-L657 PolarHBondContact O-N 3.13Å; L655-G658 PolarHBondContact O-N 3.18Å; L655-R659 WeakPolarHBondContact O-CG 3.36Å; L655-R659 PolarHBondContact O-N 2.9Å
656	L	82	Confident	79.5	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.8	-45	176.7	-70.4	176.9	0	0	0	112.1	L629 Y635 P637 L640 I641 F644 E652 R653 G658 R659 M660	L629-L656 HydrophobicContact CD2-CD2 3.93Å; Y635-L656 HydrophobicContact CD2-CD2 4.26Å; Y635-L656 HydrophobicContact CE2-CD2 3.44Å; Y635-L656 VanDerWaalsContact CE2-CD2 3.44Å; P637-L656 HydrophobicContact CB-CD2 4.18Å; L640-L656 HydrophobicContact CD2-CD1 4.28Å; L640-L656 HydrophobicContact CD2-CD2 4.07Å; L640-L656 HydrophobicContact CG-CD1 4.49Å; I641-L656 HydrophobicContact CB-CD1 4.24Å; I641-L656 HydrophobicContact CD1-CB 4.34Å; I641-L656 HydrophobicContact CG1-CD1 4.45Å; F644-L656 HydrophobicContact CD2-CD1 4.08Å; F644-L656 HydrophobicContact CE1-CD1 4.49Å; F644-L656 HydrophobicContact CE2-CD1 3.85Å; F644-L656 HydrophobicContact CG-CD1 4.48Å; F644-L656 HydrophobicContact CZ-CD1 4.07Å; E652-L656 WeakPolarHBondContact O-CG 3.28Å; E652-L656 PolarHBondContact O-N 2.91Å; R653-L656 PolarHBondContact O-N 3.45Å; L656-G658 VanDerWaalsContact C-N 3.32Å; L656-G658 PolarHBondContact O-N 2.96Å; L656-R659 PolarHBondContact O-N 3.43Å; L656-M660 VanDerWaalsContact O-CG 3.31Å; L656-M660 WeakPolarHBondContact O-CG 3.4Å; L656-M660 PolarHBondContact O-N 2.94Å; L656-M660 VanDerWaalsContact O-N 3.08Å
657	L	82.4	Confident	80.5	Confident	5 Å²	5	30.6 Å²	30.6	3%	0.026	16%	0.158	C	C	.	.	H	α-helix	trans	-62.6	-39.6	176.2	-72.8	168.9	0	0	0	111.9	I641 R653 A654 L655 M660 G661 K662 Q665 A666 I669	I641-L657 HydrophobicContact CD1-CD2 3.53Å; I641-L657 HydrophobicContact CD1-CG 3.72Å; R653-L657 HydrophobicContact CG-CD1 4.11Å; R653-L657 WeakPolarHBondContact O-CB 3.34Å; R653-L657 VanDerWaalsContact O-CG 3.25Å; R653-L657 WeakPolarHBondContact O-CG 3.5Å; R653-L657 PolarHBondContact O-N 2.91Å; A654-L657 PolarHBondContact O-N 3.39Å; L655-L657 PolarHBondContact O-N 3.13Å; L657-M660 PolarHBondContact O-N 2.95Å; L657-G661 PolarHBondContact O-N 3.41Å; L657-K662 HydrophobicContact CB-CB 4.36Å; L657-K662 HydrophobicContact CD2-CB 4.13Å; L657-K662 HydrophobicContact CD2-CD 3.86Å; L657-K662 PolarHBondContact O-N 2.86Å; L657-Q665 HydrophobicContact CD1-CB 3.89Å; L657-Q665 HydrophobicContact CD2-CB 4.34Å; L657-A666 HydrophobicContact CB-CB 4.07Å; L657-I669 HydrophobicContact CD1-CD1 3.78Å
658	G	81.4	Confident	81.6	Confident	4 Å²	4	26 Å²	26	4%	0.041	13%	0.133	C	C	.	.	H	α-helix	trans	-63.9	-39.1	174.9	0	0	0	0	0	113.8	A654 L655 L656 M660 G661 Y683	A654-G658 PolarHBondContact O-N 2.95Å; L655-G658 PolarHBondContact O-N 3.18Å; L656-G658 VanDerWaalsContact C-N 3.32Å; L656-G658 PolarHBondContact O-N 2.96Å; G658-M660 VanDerWaalsContact C-N 3.27Å; G658-M660 PolarHBondContact O-N 3.18Å; G658-G661 PolarHBondContact O-N 3.33Å; G658-G661 VanDerWaalsContact O-N 3.09Å; G658-Y683 WeakPolarHBondContact CA-OH 3.46Å
659	R	82	Confident	82.2	Confident	78 Å²	78	25.3 Å²	25.3	29%	0.294	13%	0.125	S	C	.	.	H	α-helix	trans	-65.4	-29.6	172.8	-70.5	-121.4	-179.3	159.8	-1.4	113.5	L629 D630 S632 Y635 P637 L655 L656 G661	L629-R659 VanDerWaalsContact O-CZ 3.31Å; L629-R659 PolarHBondContact O-NE 3.3Å; L629-R659 PolarHBondContact O-NH2 2.93Å; L629-R659 VanDerWaalsContact O-NH2 3.09Å; D630-R659 PolarHBondContact O-NH2 3.29Å; S632-R659 PolarHBondContact O-NH1 3.13Å; S632-R659 PolarHBondContact O-NH2 2.82Å; Y635-R659 WeakPolarHBondContact OH-CD 3.26Å; Y635-R659 PolarHBondContact OH-NE 3Å; Y635-R659 PolarHBondContact OH-NH1 3.22Å; P637-R659 HydrophobicContact CB-CB 4.39Å; P637-R659 HydrophobicContact CG-CB 4.01Å; L655-R659 WeakPolarHBondContact O-CG 3.36Å; L655-R659 PolarHBondContact O-N 2.9Å; L656-R659 PolarHBondContact O-N 3.43Å; R659-G661 PolarHBondContact O-N 3.2Å
660	M	79.8	Confident	82.7	Confident	62 Å²	62	25 Å²	25	31%	0.305	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	0.5	173.7	-64.6	175.8	70.9	0	0	113.5	P637 A638 I641 L656 L657 G658 K662	P637-M660 HydrophobicContact CB-CG 3.63Å; P637-M660 HydrophobicContact CB-SD 4.22Å; P637-M660 HydrophobicContact CG-CG 4.49Å; A638-M660 HydrophobicContact CB-CE 3.85Å; I641-M660 HydrophobicContact CD1-SD 4.38Å; I641-M660 HydrophobicContact CG2-SD 4.21Å; L656-M660 VanDerWaalsContact O-CG 3.31Å; L656-M660 WeakPolarHBondContact O-CG 3.4Å; L656-M660 PolarHBondContact O-N 2.94Å; L656-M660 VanDerWaalsContact O-N 3.08Å; L657-M660 PolarHBondContact O-N 2.95Å; G658-M660 VanDerWaalsContact C-N 3.27Å; G658-M660 PolarHBondContact O-N 3.18Å; M660-K662 HydrophobicContact CB-CG 4.25Å; M660-K662 PolarHBondContact O-N 3.43Å
661	G	80	Confident	83.1	Confident	38 Å²	38	24.4 Å²	24.4	39%	0.392	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	9.6	-174.8	0	0	0	0	0	114.2	L657 G658 R659 H663	L657-G661 PolarHBondContact O-N 3.41Å; G658-G661 PolarHBondContact O-N 3.33Å; G658-G661 VanDerWaalsContact O-N 3.09Å; R659-G661 PolarHBondContact O-N 3.2Å; G661-H663 PolarHBondContact O-CD2 2.91Å; G661-H663 PolarHBondContact O-N 3.02Å
662	K	85.1	Confident	83.1	Confident	93 Å²	93	24.6 Å²	24.6	40%	0.404	12%	0.122	S	C	.	.			trans	-85.2	58.1	178.6	-64.8	-174.8	175.7	-177.9	0	110.8	L657 M660 E664 Q665 A666	L657-K662 HydrophobicContact CB-CB 4.36Å; L657-K662 HydrophobicContact CD2-CB 4.13Å; L657-K662 HydrophobicContact CD2-CD 3.86Å; L657-K662 PolarHBondContact O-N 2.86Å; M660-K662 HydrophobicContact CB-CG 4.25Å; M660-K662 PolarHBondContact O-N 3.43Å; K662-E664 VanDerWaalsContact C-N 3.34Å; K662-E664 PolarHBondContact O-N 3.16Å; K662-Q665 HydrophobicContact CB-CB 4.44Å; K662-Q665 PolarHBondContact O-N 3.45Å; K662-A666 PolarHBondContact O-N 3.43Å
663	H	87	Confident	82.9	Confident	9 Å²	9	26 Å²	26	4%	0.042	13%	0.13	C	C	.	.	H	α-helix	trans	-61.3	-36.8	-172.1	-60.7	-59.5	0	0	0	113.6	G661 Q665 A666 L667 Y683 G694 N695 V698	G661-H663 PolarHBondContact O-CD2 2.91Å; G661-H663 PolarHBondContact O-N 3.02Å; H663-Q665 VanDerWaalsContact C-N 3.32Å; H663-Q665 PolarHBondContact O-N 3.42Å; H663-A666 PolarHBondContact O-N 2.65Å; H663-L667 VanDerWaalsContact O-CB 3.3Å; H663-L667 WeakPolarHBondContact O-CB 3.38Å; H663-L667 VanDerWaalsContact O-CG 3.22Å; H663-L667 WeakPolarHBondContact O-CG 3.32Å; H663-L667 PolarHBondContact O-N 3.45Å; H663-Y683 HydrophobicContact CB-CE1 4.5Å; H663-Y683 AromaticContact ND1-CE1 3.87Å; H663-Y683 AromaticContact ND1-CZ 3.71Å; H663-Y683 PolarHBondContact ND1-OH 3.18Å; H663-G694 PolarHBondContact CD2-O 3.35Å; H663-N695 PolarHBondContact NE2-OD1 3.21Å; H663-V698 HydrophobicContact CB-CG2 4.42Å
664	E	83.9	Confident	82.8	Confident	78 Å²	78	27.6 Å²	27.6	36%	0.364	14%	0.141	S	C	.	.	H	α-helix	trans	-62.6	-38	177.8	-67.8	-175.6	163.8	0	0	112.1	K662 F668 R704	K662-E664 VanDerWaalsContact C-N 3.34Å; K662-E664 PolarHBondContact O-N 3.16Å; E664-F668 WeakPolarHBondContact O-CB 3.25Å; E664-F668 PolarHBondContact O-N 3.09Å; E664-R704 IonicContact OE1-NH1 3.72Å; E664-R704 PolarHBondContact OE1-NH1 3.29Å
665	Q	83.7	Confident	82.6	Confident	55 Å²	55	34 Å²	34	26%	0.257	18%	0.175	S	C	.	.	H	α-helix	trans	-71.2	-41.1	177.5	-66.5	176.6	12.5	0	0	111.8	L657 K662 H663 F668 I669 L715	L657-Q665 HydrophobicContact CD1-CB 3.89Å; L657-Q665 HydrophobicContact CD2-CB 4.34Å; K662-Q665 HydrophobicContact CB-CB 4.44Å; K662-Q665 PolarHBondContact O-N 3.45Å; H663-Q665 VanDerWaalsContact C-N 3.32Å; H663-Q665 PolarHBondContact O-N 3.42Å; Q665-F668 PolarHBondContact O-N 3.23Å; Q665-I669 WeakPolarHBondContact O-CG1 3.43Å; Q665-I669 PolarHBondContact O-N 3.32Å; Q665-L715 HydrophobicContact CG-CB 4.36Å; Q665-L715 HydrophobicContact CG-CD2 3.76Å
666	A	86.7	Confident	82.6	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-65.2	-43.3	176.3	0	0	0	0	0	111.8	A654 L657 K662 H663 I669 Y670 Y683	A654-A666 HydrophobicContact CB-CB 4.31Å; A654-A666 WeakPolarHBondContact O-CB 3.41Å; L657-A666 HydrophobicContact CB-CB 4.07Å; K662-A666 PolarHBondContact O-N 3.43Å; H663-A666 PolarHBondContact O-N 2.65Å; A666-I669 WeakPolarHBondContact O-CB 3.26Å; A666-I669 PolarHBondContact O-N 3.42Å; A666-Y670 VanDerWaalsContact O-CD2 3.24Å; A666-Y670 WeakPolarHBondContact O-CD2 3.03Å; A666-Y670 PolarHBondContact O-N 2.95Å; A666-Y683 HydrophobicContact CB-CE1 4.28Å; A666-Y683 HydrophobicContact CB-CE2 3.81Å; A666-Y683 VanDerWaalsContact CB-OH 3.28Å; A666-Y683 WeakPolarHBondContact CB-OH 3.47Å
667	L	86.9	Confident	82.6	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-68.4	-34	178	-71.7	173.1	0	0	0	112.5	H663 I669 Y670 V671 A680 Y683 L702 M705	H663-L667 VanDerWaalsContact O-CB 3.3Å; H663-L667 WeakPolarHBondContact O-CB 3.38Å; H663-L667 VanDerWaalsContact O-CG 3.22Å; H663-L667 WeakPolarHBondContact O-CG 3.32Å; H663-L667 PolarHBondContact O-N 3.45Å; L667-I669 VanDerWaalsContact C-N 3.29Å; L667-I669 PolarHBondContact O-N 3.19Å; L667-Y670 PolarHBondContact O-N 2.97Å; L667-V671 WeakPolarHBondContact O-CB 3.43Å; L667-V671 VanDerWaalsContact O-CG2 3.3Å; L667-V671 WeakPolarHBondContact O-CG2 2.95Å; L667-V671 PolarHBondContact O-N 3.28Å; L667-A680 HydrophobicContact CD2-CB 4.36Å; L667-Y683 HydrophobicContact CD2-CD1 3.49Å; L667-Y683 VanDerWaalsContact CD2-CD1 3.49Å; L667-Y683 HydrophobicContact CD2-CE1 3.97Å; L667-Y683 HydrophobicContact CD2-CG 4.35Å; L667-Y683 HydrophobicContact CG-CD1 4.02Å; L667-Y683 HydrophobicContact CG-CE1 3.96Å; L667-L702 HydrophobicContact CD1-CB 4.05Å; L667-L702 HydrophobicContact CD2-CD1 4.09Å; L667-M705 HydrophobicContact CB-CG 3.96Å
668	F	84.6	Confident	82.8	Confident	6 Å²	6	47.1 Å²	47.1	3%	0.026	23%	0.234	C	C	.	.	H	α-helix	trans	-59.2	-41.8	171.9	-175.8	-87.9	0	0	0	111.6	E664 Q665 H672 V673 M705 P710 L715 L722	E664-F668 WeakPolarHBondContact O-CB 3.25Å; E664-F668 PolarHBondContact O-N 3.09Å; Q665-F668 PolarHBondContact O-N 3.23Å; F668-H672 HydrophobicContact CD2-CB 4.23Å; F668-H672 AromaticContact CD2-CD2 3.65Å; F668-H672 HydrophobicContact CE1-CB 4.37Å; F668-H672 HydrophobicContact CE2-CB 4.01Å; F668-H672 AromaticContact CE2-CD2 3.88Å; F668-H672 HydrophobicContact CZ-CB 4.07Å; F668-H672 WeakPolarHBondContact O-CB 3.4Å; F668-H672 PolarHBondContact O-N 3.24Å; F668-V673 HydrophobicContact CD1-CG2 3.99Å; F668-V673 HydrophobicContact CE1-CG2 3.84Å; F668-V673 PolarHBondContact O-N 3.46Å; F668-M705 HydrophobicContact CB-SD 4.39Å; F668-P710 HydrophobicContact CD2-CG 4.12Å; F668-P710 HydrophobicContact CE2-CG 4.46Å; F668-L715 HydrophobicContact CB-CD1 3.95Å; F668-L715 HydrophobicContact CD2-CD1 3.77Å; F668-L715 HydrophobicContact CE2-CD1 4.45Å; F668-L715 HydrophobicContact CG-CD1 3.86Å; F668-L722 HydrophobicContact CE1-CD1 4.41Å
669	I	82	Confident	82.9	Confident	2 Å²	2	48.9 Å²	48.9	1%	0.01	24%	0.242	C	C	.	.	I	π-helix	trans	-60.8	-49.5	176.1	-64.9	168.2	0	0	0	110.3	L650 R653 A654 L657 Q665 A666 L667 V673 L674	L650-I669 HydrophobicContact CB-CG2 3.92Å; R653-I669 HydrophobicContact CG-CD1 4.32Å; A654-I669 HydrophobicContact CB-CB 4.35Å; A654-I669 HydrophobicContact CB-CD1 4.16Å; A654-I669 HydrophobicContact CB-CG2 4.3Å; L657-I669 HydrophobicContact CD1-CD1 3.78Å; Q665-I669 WeakPolarHBondContact O-CG1 3.43Å; Q665-I669 PolarHBondContact O-N 3.32Å; A666-I669 WeakPolarHBondContact O-CB 3.26Å; A666-I669 PolarHBondContact O-N 3.42Å; L667-I669 VanDerWaalsContact C-N 3.29Å; L667-I669 PolarHBondContact O-N 3.19Å; I669-V673 WeakPolarHBondContact O-CB 3.34Å; I669-V673 PolarHBondContact O-N 2.91Å; I669-L674 HydrophobicContact CG2-CD1 4.05Å; I669-L674 HydrophobicContact CG2-CG 4.18Å; I669-L674 PolarHBondContact O-N 3.08Å
670	Y	85.6	Confident	83.1	Confident	3 Å²	3	45.2 Å²	45.2	1%	0.012	23%	0.228	C	C	.	.	I	π-helix	trans	-66.3	-43.3	-179.5	-68.8	-60.8	0	0	0	113.4	A654 A666 L667 L674 N675 D676 M679 Y683	A654-Y670 HydrophobicContact CB-CD2 4.31Å; A654-Y670 HydrophobicContact CB-CE1 4.38Å; A654-Y670 HydrophobicContact CB-CE2 3.58Å; A666-Y670 VanDerWaalsContact O-CD2 3.24Å; A666-Y670 WeakPolarHBondContact O-CD2 3.03Å; A666-Y670 PolarHBondContact O-N 2.95Å; L667-Y670 PolarHBondContact O-N 2.97Å; Y670-L674 HydrophobicContact CD1-CD1 3.8Å; Y670-L674 HydrophobicContact CE1-CD1 4.12Å; Y670-N675 PolarHBondContact O-N 3.5Å; Y670-D676 PolarHBondContact O-N 2.93Å; Y670-M679 HydrophobicContact CD1-CB 3.72Å; Y670-M679 HydrophobicContact CE1-CB 4.1Å; Y670-M679 HydrophobicContact CE1-CE 3.97Å; Y670-M679 HydrophobicContact CG-CB 4.43Å; Y670-Y683 HydrophobicContact CD2-CD2 4.33Å; Y670-Y683 HydrophobicContact CD2-CG 4.2Å; Y670-Y683 AromaticContact CE2-CD2 3.58Å; Y670-Y683 HydrophobicContact CE2-CD2 3.58Å; Y670-Y683 HydrophobicContact CE2-CE2 4.3Å; Y670-Y683 AromaticContact CE2-CG 3.86Å; Y670-Y683 HydrophobicContact CE2-CG 3.86Å
671	V	83.3	Confident	83.5	Confident	8 Å²	8	44.2 Å²	44.2	5%	0.048	22%	0.223	C	C	.	.	I	π-helix	trans	-81.7	-44.7	-172.5	175.6	0	0	0	0	112.9	L667 N675 A680 L702 M705 Y706	L667-V671 WeakPolarHBondContact O-CB 3.43Å; L667-V671 VanDerWaalsContact O-CG2 3.3Å; L667-V671 WeakPolarHBondContact O-CG2 2.95Å; L667-V671 PolarHBondContact O-N 3.28Å; V671-N675 WeakPolarHBondContact O-CA 3.37Å; V671-A680 HydrophobicContact CG2-CB 3.73Å; V671-L702 HydrophobicContact CG2-CD1 3.77Å; V671-M705 HydrophobicContact CG2-CB 4.45Å; V671-Y706 HydrophobicContact CB-CE1 4.41Å; V671-Y706 HydrophobicContact CG1-CD1 3.79Å; V671-Y706 HydrophobicContact CG1-CE1 3.58Å; V671-Y706 HydrophobicContact CG2-CE1 3.92Å
672	H	80.9	Confident	83.8	Confident	37 Å²	37	45.8 Å²	45.8	17%	0.171	22%	0.22	C	C	.	.	I	π-helix	trans	-108	-24.6	-169	-66.1	-62.5	0	0	0	113.7	F668 M705 P725	F668-H672 HydrophobicContact CD2-CB 4.23Å; F668-H672 AromaticContact CD2-CD2 3.65Å; F668-H672 HydrophobicContact CE1-CB 4.37Å; F668-H672 HydrophobicContact CE2-CB 4.01Å; F668-H672 AromaticContact CE2-CD2 3.88Å; F668-H672 HydrophobicContact CZ-CB 4.07Å; F668-H672 WeakPolarHBondContact O-CB 3.4Å; F668-H672 PolarHBondContact O-N 3.24Å; H672-M705 PolarHBondContact NE2-O 2.93Å; H672-P725 HydrophobicContact CB-CB 4.4Å; H672-P725 VanDerWaalsContact ND1-CB 3.3Å; H672-P725 WeakPolarHBondContact ND1-CB 3.23Å
673	V	77.5	Confident	83.9	Confident	28 Å²	28	41.4 Å²	41.4	17%	0.17	20%	0.201	C	C	.	.	I	π-helix	trans	-95.7	-49.2	178.7	-172.2	0	0	0	0	111.5	L650 F668 I669 I718 M720 L722	L650-V673 HydrophobicContact CD1-CG1 3.63Å; F668-V673 HydrophobicContact CD1-CG2 3.99Å; F668-V673 HydrophobicContact CE1-CG2 3.84Å; F668-V673 PolarHBondContact O-N 3.46Å; I669-V673 WeakPolarHBondContact O-CB 3.34Å; I669-V673 PolarHBondContact O-N 2.91Å; V673-I718 HydrophobicContact CG2-CD1 4.5Å; V673-M720 HydrophobicContact CG1-SD 4.41Å; V673-L722 HydrophobicContact CG1-CD2 4.27Å; V673-L722 HydrophobicContact CG2-CD2 4.16Å
674	L	78.4	Confident	84	Confident	65 Å²	65	41 Å²	41	34%	0.34	20%	0.199	S	C	.	.	S	Bend	trans	-87.2	-16.6	178.6	-61.6	177.2	0	0	0	112.7	L650 E651 I669 Y670 D676	L650-L674 HydrophobicContact CB-CD2 4.36Å; L650-L674 HydrophobicContact CD1-CD2 4.06Å; E651-L674 HydrophobicContact CG-CD1 4Å; I669-L674 HydrophobicContact CG2-CD1 4.05Å; I669-L674 HydrophobicContact CG2-CG 4.18Å; I669-L674 PolarHBondContact O-N 3.08Å; Y670-L674 HydrophobicContact CD1-CD1 3.8Å; Y670-L674 HydrophobicContact CE1-CD1 4.12Å; L674-D676 PolarHBondContact O-N 3.48Å
675	N	78.8	Confident	84.2	Confident	135 Å²	135	43 Å²	43	72%	0.722	21%	0.208	S	C	*	.			trans	51.4	36.3	-177.1	-159.1	21.3	0	0	0	113.3	Y670 V671	Y670-N675 PolarHBondContact O-N 3.5Å; V671-N675 WeakPolarHBondContact O-CA 3.37Å
676	D	82.2	Confident	84.2	Confident	63 Å²	63	45.1 Å²	45.1	34%	0.337	21%	0.214	S	C	.	.			trans	-114.9	95.4	-177.7	-169.3	-27.4	0	0	0	110.3	Y670 L674 R678 M679 A680	Y670-D676 PolarHBondContact O-N 2.93Å; L674-D676 PolarHBondContact O-N 3.48Å; D676-R678 PolarHBondContact O-N 3.31Å; D676-R678 WeakPolarHBondContact OD1-CA 3.27Å; D676-R678 VanDerWaalsContact OD1-CB 3.32Å; D676-R678 WeakPolarHBondContact OD1-CB 3.3Å; D676-R678 PolarHBondContact OD1-N 2.68Å; D676-M679 HydrophobicContact CB-CB 4.11Å; D676-M679 HydrophobicContact CB-CG 4.29Å; D676-M679 PolarHBondContact O-N 3.47Å; D676-M679 PolarHBondContact OD1-N 3.4Å; D676-M679 VanDerWaalsContact OD2-CG 3.26Å; D676-M679 WeakPolarHBondContact OD2-CG 3.26Å; D676-A680 PolarHBondContact O-N 2.63Å
677	T	83.3	Confident	84.1	Confident	56 Å²	56	46.5 Å²	46.5	34%	0.344	22%	0.22	S	C	.	.	H	α-helix	trans	-64.9	-28.2	179.2	58.1	0	0	0	0	112.3	E681 Y706	T677-E681 PolarHBondContact O-N 3.34Å; T677-Y706 WeakPolarHBondContact CB-OH 3.4Å; T677-Y706 HydrophobicContact CG2-CE1 4.08Å; T677-Y706 WeakPolarHBondContact CG2-OH 3.18Å
678	R	85.2	Confident	84.1	Confident	169 Å²	169	49.3 Å²	49.3	64%	0.638	23%	0.231	S	C	*	.	H	α-helix	trans	-72.5	-46.9	-179.8	178.7	-173.4	167.4	175.7	-1.7	110.5	D676 A680 E681 E682	D676-R678 PolarHBondContact O-N 3.31Å; D676-R678 WeakPolarHBondContact OD1-CA 3.27Å; D676-R678 VanDerWaalsContact OD1-CB 3.32Å; D676-R678 WeakPolarHBondContact OD1-CB 3.3Å; D676-R678 PolarHBondContact OD1-N 2.68Å; R678-A680 VanDerWaalsContact C-N 3.25Å; R678-A680 PolarHBondContact O-N 2.82Å; R678-E681 PolarHBondContact O-N 3.1Å; R678-E682 IonicContact CZ-OE1 3.31Å; R678-E682 IonicContact NE-OE1 3.53Å; R678-E682 PolarHBondContact NE-OE1 3.34Å; R678-E682 IonicContact NH2-OE1 2.93Å; R678-E682 PolarHBondContact NH2-OE1 3.09Å; R678-E682 WeakPolarHBondContact O-CG 3.08Å; R678-E682 PolarHBondContact O-N 2.81Å
679	M	83.9	Confident	84	Confident	42 Å²	42	51.6 Å²	51.6	21%	0.207	24%	0.243	C	C	.	.	H	α-helix	trans	-62.4	-34.5	176.5	-75.1	-68.2	-74.2	0	0	112	Y670 D676 E682 Y683	Y670-M679 HydrophobicContact CD1-CB 3.72Å; Y670-M679 HydrophobicContact CE1-CB 4.1Å; Y670-M679 HydrophobicContact CE1-CE 3.97Å; Y670-M679 HydrophobicContact CG-CB 4.43Å; D676-M679 HydrophobicContact CB-CB 4.11Å; D676-M679 HydrophobicContact CB-CG 4.29Å; D676-M679 PolarHBondContact O-N 3.47Å; D676-M679 PolarHBondContact OD1-N 3.4Å; D676-M679 VanDerWaalsContact OD2-CG 3.26Å; D676-M679 WeakPolarHBondContact OD2-CG 3.26Å; M679-E682 PolarHBondContact O-N 3.08Å; M679-Y683 WeakPolarHBondContact O-CB 3.48Å; M679-Y683 PolarHBondContact O-N 3.47Å
680	A	87.2	Confident	83.8	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-64.2	-40.2	174.1	0	0	0	0	0	112.8	L667 V671 D676 R678 C684 L702	L667-A680 HydrophobicContact CD2-CB 4.36Å; V671-A680 HydrophobicContact CG2-CB 3.73Å; D676-A680 PolarHBondContact O-N 2.63Å; R678-A680 VanDerWaalsContact C-N 3.25Å; R678-A680 PolarHBondContact O-N 2.82Å; A680-C684 PolarHBondContact O-N 2.75Å; A680-C684 VanDerWaalsContact O-N 3.12Å; A680-C684 PolarHBondContact O-SG 3.29Å; A680-L702 HydrophobicContact CB-CD1 3.79Å
681	E	87.5	Confident	83.4	Confident	41 Å²	41	60.3 Å²	60.3	19%	0.192	31%	0.305	C	S	.	.	H	α-helix	trans	-70.1	-41.9	174.7	-74.7	-179.6	-159.2	0	0	112.5	T677 R678 Y683 C684 H685 L702 H734	T677-E681 PolarHBondContact O-N 3.34Å; R678-E681 PolarHBondContact O-N 3.1Å; E681-Y683 VanDerWaalsContact C-N 3.29Å; E681-Y683 PolarHBondContact O-N 3.3Å; E681-C684 WeakPolarHBondContact O-CB 3.4Å; E681-C684 PolarHBondContact O-N 3.09Å; E681-C684 VanDerWaalsContact O-N 3.15Å; E681-H685 PolarHBondContact O-N 3.38Å; E681-L702 HydrophobicContact CG-CD2 4.08Å; E681-H734 IonicContact OE1-CD2 3.57Å
682	E	86.3	Confident	83.2	Confident	72 Å²	72	65 Å²	65	34%	0.336	33%	0.328	S	S	.	.	H	α-helix	trans	-62	-37.6	175.1	-73.8	-178.1	-168	0	0	111.5	R678 M679 H685 R686	R678-E682 IonicContact CZ-OE1 3.31Å; R678-E682 IonicContact NE-OE1 3.53Å; R678-E682 PolarHBondContact NE-OE1 3.34Å; R678-E682 IonicContact NH2-OE1 2.93Å; R678-E682 PolarHBondContact NH2-OE1 3.09Å; R678-E682 WeakPolarHBondContact O-CG 3.08Å; R678-E682 PolarHBondContact O-N 2.81Å; M679-E682 PolarHBondContact O-N 3.08Å; E682-H685 PolarHBondContact O-N 2.8Å; E682-R686 WeakPolarHBondContact O-CG 3.48Å; E682-R686 PolarHBondContact O-N 3.13Å; E682-R686 VanDerWaalsContact O-N 3.09Å
683	Y	87.9	Confident	82.7	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-61.4	-47.2	171.2	174.6	-88.8	0	0	0	111.8	G658 H663 A666 L667 Y670 M679 E681 H685 R686 H687 V698	G658-Y683 WeakPolarHBondContact CA-OH 3.46Å; H663-Y683 HydrophobicContact CB-CE1 4.5Å; H663-Y683 AromaticContact ND1-CE1 3.87Å; H663-Y683 AromaticContact ND1-CZ 3.71Å; H663-Y683 PolarHBondContact ND1-OH 3.18Å; A666-Y683 HydrophobicContact CB-CE1 4.28Å; A666-Y683 HydrophobicContact CB-CE2 3.81Å; A666-Y683 VanDerWaalsContact CB-OH 3.28Å; A666-Y683 WeakPolarHBondContact CB-OH 3.47Å; L667-Y683 HydrophobicContact CD2-CD1 3.49Å; L667-Y683 VanDerWaalsContact CD2-CD1 3.49Å; L667-Y683 HydrophobicContact CD2-CE1 3.97Å; L667-Y683 HydrophobicContact CD2-CG 4.35Å; L667-Y683 HydrophobicContact CG-CD1 4.02Å; L667-Y683 HydrophobicContact CG-CE1 3.96Å; Y670-Y683 HydrophobicContact CD2-CD2 4.33Å; Y670-Y683 HydrophobicContact CD2-CG 4.2Å; Y670-Y683 AromaticContact CE2-CD2 3.58Å; Y670-Y683 HydrophobicContact CE2-CD2 3.58Å; Y670-Y683 HydrophobicContact CE2-CE2 4.3Å; Y670-Y683 AromaticContact CE2-CG 3.86Å; Y670-Y683 HydrophobicContact CE2-CG 3.86Å; M679-Y683 WeakPolarHBondContact O-CB 3.48Å; M679-Y683 PolarHBondContact O-N 3.47Å; E681-Y683 VanDerWaalsContact C-N 3.29Å; E681-Y683 PolarHBondContact O-N 3.3Å; Y683-H685 VanDerWaalsContact C-N 3.27Å; Y683-H685 PolarHBondContact O-N 3.13Å; Y683-R686 PolarHBondContact O-N 3.24Å; Y683-H687 AromaticContact CD2-CD2 3.5Å; Y683-H687 AromaticContact CD2-NE2 3.84Å; Y683-H687 AromaticContact CE2-CD2 3.31Å; Y683-H687 WeakPolarHBondContact CE2-CD2 3.43Å; Y683-H687 AromaticContact CE2-NE2 3.47Å; Y683-H687 WeakPolarHBondContact CE2-NE2 3.12Å; Y683-H687 AromaticContact CZ-CD2 3.64Å; Y683-H687 PolarHBondContact O-CD2 3.35Å; Y683-H687 PolarHBondContact O-N 3.18Å; Y683-V698 HydrophobicContact CD1-CG1 4.38Å; Y683-V698 HydrophobicContact CE1-CG1 4.14Å
684	C	88.7	Confident	82.3	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-60.8	-39	177.2	-66.4	0	0	0	0	111.8	A680 E681 H687 Y688 V698 Y699	A680-C684 PolarHBondContact O-N 2.75Å; A680-C684 VanDerWaalsContact O-N 3.12Å; A680-C684 PolarHBondContact O-SG 3.29Å; E681-C684 WeakPolarHBondContact O-CB 3.4Å; E681-C684 PolarHBondContact O-N 3.09Å; E681-C684 VanDerWaalsContact O-N 3.15Å; C684-H687 PolarHBondContact O-N 3.04Å; C684-Y688 WeakPolarHBondContact O-CB 3.26Å; C684-Y688 PolarHBondContact O-N 3.24Å; C684-V698 HydrophobicContact CB-CG1 4.04Å; C684-Y699 HydrophobicContact CB-CD1 3.65Å; C684-Y699 HydrophobicContact CB-CD2 4.18Å; C684-Y699 HydrophobicContact CB-CE1 3.39Å; C684-Y699 HydrophobicContact CB-CE2 3.95Å; C684-Y699 HydrophobicContact CB-CG 4.05Å
685	H	87.8	Confident	82.4	Confident	121 Å²	121	70 Å²	70	56%	0.56	36%	0.362	S	S	*	.	H	α-helix	trans	-61.8	-44	176.8	-169.9	94.9	0	0	0	112.2	E681 E682 Y683 Y699	E681-H685 PolarHBondContact O-N 3.38Å; E682-H685 PolarHBondContact O-N 2.8Å; Y683-H685 VanDerWaalsContact C-N 3.27Å; Y683-H685 PolarHBondContact O-N 3.13Å; H685-Y699 WeakPolarHBondContact CA-OH 3.44Å; H685-Y699 PolarHBondContact N-OH 2.9Å
686	R	83.7	Confident	82.5	Confident	100 Å²	100	66.9 Å²	66.9	38%	0.377	34%	0.342	S	S	.	.	H	α-helix	trans	-68.3	-37.4	-179.9	-76.5	-173.8	-85.1	173.7	-9.2	113.1	D630 E682 Y683	D630-R686 IonicContact OD1-NH1 3.08Å; D630-R686 PolarHBondContact OD1-NH1 3.22Å; D630-R686 IonicContact OD2-NH1 3.55Å; D630-R686 PolarHBondContact OD2-NH1 3.05Å; E682-R686 WeakPolarHBondContact O-CG 3.48Å; E682-R686 PolarHBondContact O-N 3.13Å; E682-R686 VanDerWaalsContact O-N 3.09Å; Y683-R686 PolarHBondContact O-N 3.24Å
687	H	84.8	Confident	82.7	Confident	29 Å²	29	65.7 Å²	65.7	13%	0.134	34%	0.336	C	S	.	.	H	α-helix	trans	-97.4	-12.1	-173.7	-72.3	-77.8	0	0	0	114.7	Y683 C684 N689 N695 V698	Y683-H687 AromaticContact CD2-CD2 3.5Å; Y683-H687 AromaticContact CD2-NE2 3.84Å; Y683-H687 AromaticContact CE2-CD2 3.31Å; Y683-H687 WeakPolarHBondContact CE2-CD2 3.43Å; Y683-H687 AromaticContact CE2-NE2 3.47Å; Y683-H687 WeakPolarHBondContact CE2-NE2 3.12Å; Y683-H687 AromaticContact CZ-CD2 3.64Å; Y683-H687 PolarHBondContact O-CD2 3.35Å; Y683-H687 PolarHBondContact O-N 3.18Å; C684-H687 PolarHBondContact O-N 3.04Å; H687-N689 PolarHBondContact O-N 3.49Å; H687-N695 VanDerWaalsContact O-CB 3.26Å; H687-N695 WeakPolarHBondContact O-CB 3.34Å; H687-N695 PolarHBondContact O-ND2 3.09Å; H687-N695 VanDerWaalsContact O-ND2 3.16Å; H687-V698 HydrophobicContact CB-CG2 4.44Å
688	Y	86.3	Confident	82.9	Confident	59 Å²	59	63 Å²	63	23%	0.231	32%	0.319	C	S	.	.			trans	-66.8	123.9	179.4	176	-100.2	0	0	0	112.4	C684 Y699 K742	C684-Y688 WeakPolarHBondContact O-CB 3.26Å; C684-Y688 PolarHBondContact O-N 3.24Å; Y688-Y699 AromaticContact CD2-CD2 3.79Å; Y688-Y699 HydrophobicContact CD2-CD2 3.79Å; Y688-Y699 HydrophobicContact CD2-CE2 4.16Å; Y688-Y699 HydrophobicContact CG-CD2 4.03Å; Y688-Y699 AromaticContact CG-CE2 3.9Å; Y688-Y699 HydrophobicContact CG-CE2 3.9Å; Y688-K742 HydrophobicContact CD1-CB 4.33Å; Y688-K742 HydrophobicContact CD1-CD 3.76Å; Y688-K742 HydrophobicContact CD1-CG 4.07Å; Y688-K742 HydrophobicContact CD2-CB 4.25Å; Y688-K742 HydrophobicContact CE1-CB 3.88Å; Y688-K742 HydrophobicContact CE1-CD 3.87Å; Y688-K742 HydrophobicContact CE1-CG 3.63Å; Y688-K742 HydrophobicContact CE2-CB 3.8Å; Y688-K742 HydrophobicContact CE2-CG 4.48Å; Y688-K742 WeakPolarHBondContact CE2-O 3.31Å; Y688-K742 HydrophobicContact CG-CB 4.49Å; Y688-K742 HydrophobicContact CG-CD 4.22Å; Y688-K742 WeakPolarHBondContact OH-CA 3.35Å
689	N	83.1	Confident	83.1	Confident	53 Å²	53	55 Å²	55	28%	0.283	29%	0.289	S	S	.	.			trans	-143.4	120	173	-175.1	-17.6	0	0	0	109.9	H687 S691 M692 N695 K696	H687-N689 PolarHBondContact O-N 3.49Å; N689-S691 PolarHBondContact ND2-OG 3.29Å; N689-S691 PolarHBondContact O-N 3.29Å; N689-S691 PolarHBondContact OD1-N 3.06Å; N689-S691 PolarHBondContact OD1-OG 3.46Å; N689-M692 HydrophobicContact CB-CB 4.45Å; N689-M692 PolarHBondContact O-N 2.91Å; N689-N695 HydrophobicContact CB-CB 4.03Å; N689-N695 PolarHBondContact N-O 3.21Å; N689-K696 WeakPolarHBondContact O-CA 3.3Å; N689-K696 PolarHBondContact O-N 3.35Å
690	S	77	Confident	83.3	Confident	93 Å²	93	53.1 Å²	53.1	65%	0.65	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-18	-178.2	59.5	0	0	0	0	114.1
691	S	77.6	Confident	83.4	Confident	96 Å²	96	53.7 Å²	53.7	67%	0.671	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-19	-177.8	65.8	0	0	0	0	114.6	N689	N689-S691 PolarHBondContact ND2-OG 3.29Å; N689-S691 PolarHBondContact O-N 3.29Å; N689-S691 PolarHBondContact OD1-N 3.06Å; N689-S691 PolarHBondContact OD1-OG 3.46Å
692	M	79.3	Confident	83.4	Confident	106 Å²	106	51.7 Å²	51.7	52%	0.522	28%	0.275	S	S	.	.	S	Bend	trans	-104.6	127.3	-177.1	-75.9	-176	176.6	0	0	111.3	N689 G694 N695 K696	N689-M692 HydrophobicContact CB-CB 4.45Å; N689-M692 PolarHBondContact O-N 2.91Å; M692-G694 PolarHBondContact O-N 3.17Å; M692-N695 HydrophobicContact CB-CB 4Å; M692-N695 PolarHBondContact O-N 3.3Å; M692-N695 VanDerWaalsContact O-N 3.13Å; M692-K696 PolarHBondContact O-N 2.85Å
693	E	70.8	Confident	83.5	Confident	152 Å²	152	48.3 Å²	48.3	71%	0.71	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-30.7	-171	-65.4	-147.1	114.1	0	0	115.6	K696	E693-K696 VanDerWaalsContact O-CE 3.26Å; E693-K696 WeakPolarHBondContact O-CE 3.39Å; E693-K696 WeakPolarHBondContact O-CG 3.4Å; E693-K696 IonicContact OE1-NZ 2.68Å; E693-K696 PolarHBondContact OE1-NZ 3.19Å
694	G	68.4	Low	83.4	Confident	49 Å²	49	52.5 Å²	52.5	51%	0.505	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-28.9	174.7	0	0	0	0	0	113.6	H663 M692	H663-G694 PolarHBondContact CD2-O 3.35Å; M692-G694 PolarHBondContact O-N 3.17Å
695	N	80.9	Confident	83.4	Confident	35 Å²	35	52.8 Å²	52.8	19%	0.187	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-18.3	-170.4	-69.8	29.5	0	0	0	113.1	H663 H687 N689 M692 D697 V698	H663-N695 PolarHBondContact NE2-OD1 3.21Å; H687-N695 VanDerWaalsContact O-CB 3.26Å; H687-N695 WeakPolarHBondContact O-CB 3.34Å; H687-N695 PolarHBondContact O-ND2 3.09Å; H687-N695 VanDerWaalsContact O-ND2 3.16Å; N689-N695 HydrophobicContact CB-CB 4.03Å; N689-N695 PolarHBondContact N-O 3.21Å; M692-N695 HydrophobicContact CB-CB 4Å; M692-N695 PolarHBondContact O-N 3.3Å; M692-N695 VanDerWaalsContact O-N 3.13Å; N695-D697 VanDerWaalsContact C-N 3.28Å; N695-D697 PolarHBondContact O-N 3.21Å; N695-V698 HydrophobicContact CB-CG2 4.5Å; N695-V698 VanDerWaalsContact O-CG2 3.23Å; N695-V698 WeakPolarHBondContact O-CG2 3.49Å
696	K	81.6	Confident	83.4	Confident	69 Å²	69	47 Å²	47	30%	0.3	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-26.9	178	69.1	-172.6	174.6	-168.7	0	113.5	N689 M692 E693	N689-K696 WeakPolarHBondContact O-CA 3.3Å; N689-K696 PolarHBondContact O-N 3.35Å; M692-K696 PolarHBondContact O-N 2.85Å; E693-K696 VanDerWaalsContact O-CE 3.26Å; E693-K696 WeakPolarHBondContact O-CE 3.39Å; E693-K696 WeakPolarHBondContact O-CG 3.4Å; E693-K696 IonicContact OE1-NZ 2.68Å; E693-K696 PolarHBondContact OE1-NZ 3.19Å
697	D	85.1	Confident	83.4	Confident	37 Å²	37	43.3 Å²	43.3	20%	0.198	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103	11.7	-175.5	-71.8	-44.6	0	0	0	112.2	N695 Y699 L700 S701 K747	N695-D697 VanDerWaalsContact C-N 3.28Å; N695-D697 PolarHBondContact O-N 3.21Å; D697-Y699 PolarHBondContact O-N 3.05Å; D697-L700 HydrophobicContact CB-CB 4.23Å; D697-L700 HydrophobicContact CB-CD2 4.36Å; D697-L700 CarbonylContact O-C 3.42Å; D697-L700 WeakPolarHBondContact O-CA 3.46Å; D697-L700 WeakPolarHBondContact O-CB 3.45Å; D697-L700 PolarHBondContact O-N 3.49Å; D697-S701 PolarHBondContact O-N 3.03Å; D697-S701 PolarHBondContact O-OG 3.42Å; D697-K747 VanDerWaalsContact CG-NZ 3.25Å; D697-K747 IonicContact OD1-NZ 2.99Å; D697-K747 PolarHBondContact OD1-NZ 3.43Å; D697-K747 IonicContact OD2-NZ 3.98Å; D697-K747 PolarHBondContact OD2-NZ 2.98Å
698	V	88.6	Confident	83.2	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-59.7	-43.8	-176	176.9	0	0	0	0	112.6	H663 Y683 C684 H687 N695 L700 S701 L702	H663-V698 HydrophobicContact CB-CG2 4.42Å; Y683-V698 HydrophobicContact CD1-CG1 4.38Å; Y683-V698 HydrophobicContact CE1-CG1 4.14Å; C684-V698 HydrophobicContact CB-CG1 4.04Å; H687-V698 HydrophobicContact CB-CG2 4.44Å; N695-V698 HydrophobicContact CB-CG2 4.5Å; N695-V698 VanDerWaalsContact O-CG2 3.23Å; N695-V698 WeakPolarHBondContact O-CG2 3.49Å; V698-L700 VanDerWaalsContact C-N 3.26Å; V698-L700 PolarHBondContact O-N 3.34Å; V698-S701 WeakPolarHBondContact O-CB 3.45Å; V698-S701 PolarHBondContact O-N 3Å; V698-L702 PolarHBondContact O-N 3.2Å
699	Y	89.1	Confident	82.7	Confident	1 Å²	1	43.8 Å²	43.8	0%	0.004	25%	0.251	C	S	.	.	H	α-helix	trans	-66.2	-28.5	173.6	-77.8	-78.7	0	0	0	112.7	C684 H685 Y688 D697 L702 L703 V735 H739 K742	C684-Y699 HydrophobicContact CB-CD1 3.65Å; C684-Y699 HydrophobicContact CB-CD2 4.18Å; C684-Y699 HydrophobicContact CB-CE1 3.39Å; C684-Y699 HydrophobicContact CB-CE2 3.95Å; C684-Y699 HydrophobicContact CB-CG 4.05Å; H685-Y699 WeakPolarHBondContact CA-OH 3.44Å; H685-Y699 PolarHBondContact N-OH 2.9Å; Y688-Y699 AromaticContact CD2-CD2 3.79Å; Y688-Y699 HydrophobicContact CD2-CD2 3.79Å; Y688-Y699 HydrophobicContact CD2-CE2 4.16Å; Y688-Y699 HydrophobicContact CG-CD2 4.03Å; Y688-Y699 AromaticContact CG-CE2 3.9Å; Y688-Y699 HydrophobicContact CG-CE2 3.9Å; D697-Y699 PolarHBondContact O-N 3.05Å; Y699-L702 PolarHBondContact O-N 3.1Å; Y699-L703 PolarHBondContact O-N 2.97Å; Y699-V735 HydrophobicContact CD1-CG1 4.26Å; Y699-H739 HydrophobicContact CD1-CB 4.08Å; Y699-H739 AromaticContact CD1-CD2 3.73Å; Y699-H739 HydrophobicContact CE1-CB 4.08Å; Y699-H739 AromaticContact CE1-CD2 3.19Å; Y699-H739 WeakPolarHBondContact CE1-CD2 3.41Å; Y699-H739 AromaticContact CE1-CG 3.6Å; Y699-H739 AromaticContact CE1-NE2 3.65Å; Y699-K742 HydrophobicContact CD2-CB 3.94Å; Y699-K742 HydrophobicContact CD2-CD 4.21Å; Y699-K742 HydrophobicContact CE2-CB 4.13Å; Y699-K742 HydrophobicContact CE2-CD 3.52Å; Y699-K742 HydrophobicContact CE2-CG 4.5Å
700	L	87.9	Confident	82.2	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-71.4	-38	173.9	-170.5	77.4	0	0	0	110.6	D697 V698 L702 L703 R704 L743 K747 A748 L751	D697-L700 HydrophobicContact CB-CB 4.23Å; D697-L700 HydrophobicContact CB-CD2 4.36Å; D697-L700 CarbonylContact O-C 3.42Å; D697-L700 WeakPolarHBondContact O-CA 3.46Å; D697-L700 WeakPolarHBondContact O-CB 3.45Å; D697-L700 PolarHBondContact O-N 3.49Å; V698-L700 VanDerWaalsContact C-N 3.26Å; V698-L700 PolarHBondContact O-N 3.34Å; L700-L702 VanDerWaalsContact C-N 3.34Å; L700-L703 WeakPolarHBondContact O-CB 3.46Å; L700-L703 PolarHBondContact O-N 3.38Å; L700-R704 WeakPolarHBondContact O-CG 3.48Å; L700-R704 PolarHBondContact O-N 3.34Å; L700-L743 HydrophobicContact CB-CD2 4.26Å; L700-K747 HydrophobicContact CD1-CB 3.78Å; L700-K747 HydrophobicContact CD2-CB 3.77Å; L700-K747 HydrophobicContact CD2-CD 3.47Å; L700-K747 VanDerWaalsContact CD2-CD 3.47Å; L700-K747 HydrophobicContact CD2-CG 4.29Å; L700-K747 HydrophobicContact CG-CB 4.45Å; L700-A748 HydrophobicContact CD1-CB 4.36Å; L700-L751 HydrophobicContact CD1-CD1 3.47Å; L700-L751 VanDerWaalsContact CD1-CD1 3.47Å; L700-L751 HydrophobicContact CG-CD1 3.84Å
701	S	88.3	Confident	81.7	Confident	12 Å²	12	44 Å²	44	8%	0.084	25%	0.247	C	C	.	.	H	α-helix	trans	-62.7	-40.6	172.4	-58.6	0	0	0	0	111.4	D697 V698 R704 M705	D697-S701 PolarHBondContact O-N 3.03Å; D697-S701 PolarHBondContact O-OG 3.42Å; V698-S701 WeakPolarHBondContact O-CB 3.45Å; V698-S701 PolarHBondContact O-N 3Å; S701-R704 WeakPolarHBondContact O-CB 3.2Å; S701-R704 PolarHBondContact O-N 3.3Å; S701-M705 WeakPolarHBondContact O-CG 3.48Å; S701-M705 PolarHBondContact O-N 3.35Å
702	L	89.1	Confident	80.9	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.2	-44.4	173	179.6	64	0	0	0	111.5	L667 V671 A680 E681 V698 Y699 L700 R704 M705 Y706 V735	L667-L702 HydrophobicContact CD1-CB 4.05Å; L667-L702 HydrophobicContact CD2-CD1 4.09Å; V671-L702 HydrophobicContact CG2-CD1 3.77Å; A680-L702 HydrophobicContact CB-CD1 3.79Å; E681-L702 HydrophobicContact CG-CD2 4.08Å; V698-L702 PolarHBondContact O-N 3.2Å; Y699-L702 PolarHBondContact O-N 3.1Å; L700-L702 VanDerWaalsContact C-N 3.34Å; L702-R704 VanDerWaalsContact C-N 3.29Å; L702-R704 PolarHBondContact O-N 2.86Å; L702-M705 PolarHBondContact O-N 2.9Å; L702-M705 VanDerWaalsContact O-N 3.1Å; L702-Y706 HydrophobicContact CD1-CD2 4.27Å; L702-Y706 HydrophobicContact CD1-CE2 3.63Å; L702-Y706 HydrophobicContact CD2-CE2 4.08Å; L702-Y706 HydrophobicContact CG-CD2 4.13Å; L702-Y706 HydrophobicContact CG-CE2 3.64Å; L702-Y706 PolarHBondContact O-N 3.26Å; L702-Y706 VanDerWaalsContact O-N 3.14Å; L702-V735 HydrophobicContact CD2-CG2 3.85Å
703	L	87.5	Confident	80	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.9	-40	176.4	-167.6	71.1	0	0	0	111.9	Y699 L700 Y706 L707 A732 L736 A748 L751	Y699-L703 PolarHBondContact O-N 2.97Å; L700-L703 WeakPolarHBondContact O-CB 3.46Å; L700-L703 PolarHBondContact O-N 3.38Å; L703-Y706 PolarHBondContact O-N 2.91Å; L703-L707 HydrophobicContact CD1-CD1 4.07Å; L703-L707 HydrophobicContact CD2-CD1 4.39Å; L703-L707 HydrophobicContact CG-CD1 3.83Å; L703-L707 WeakPolarHBondContact O-CB 3.44Å; L703-L707 WeakPolarHBondContact O-CG 3.35Å; L703-L707 PolarHBondContact O-N 3Å; L703-A732 HydrophobicContact CD1-CB 3.71Å; L703-A732 WeakPolarHBondContact CD1-O 3.36Å; L703-L736 HydrophobicContact CD1-CD1 4.46Å; L703-L736 HydrophobicContact CD1-CD2 4.28Å; L703-L736 HydrophobicContact CD1-CG 4.03Å; L703-L736 HydrophobicContact CD2-CD2 3.94Å; L703-A748 HydrophobicContact CD2-CB 4.05Å; L703-L751 HydrophobicContact CD2-CB 4.4Å; L703-L751 HydrophobicContact CD2-CD1 4.16Å
704	R	86.9	Confident	79.1	Confident	88 Å²	88	41.9 Å²	41.9	33%	0.332	24%	0.24	S	C	.	.	H	α-helix	trans	-63.7	-41.9	172.8	-71.5	179.7	-174.9	160.7	-0.1	112.4	E664 L700 S701 L702 Y706 L707 S708 L751	E664-R704 IonicContact OE1-NH1 3.72Å; E664-R704 PolarHBondContact OE1-NH1 3.29Å; L700-R704 WeakPolarHBondContact O-CG 3.48Å; L700-R704 PolarHBondContact O-N 3.34Å; S701-R704 WeakPolarHBondContact O-CB 3.2Å; S701-R704 PolarHBondContact O-N 3.3Å; L702-R704 VanDerWaalsContact C-N 3.29Å; L702-R704 PolarHBondContact O-N 2.86Å; R704-Y706 PolarHBondContact O-N 3.37Å; R704-L707 PolarHBondContact O-N 3.26Å; R704-S708 CarbonylContact O-C 3.53Å; R704-S708 WeakPolarHBondContact O-CA 3.46Å; R704-S708 PolarHBondContact O-N 2.97Å; R704-S708 VanDerWaalsContact O-O 3.1Å; R704-S708 PolarHBondContact O-OG 3.47Å; R704-L751 HydrophobicContact CG-CD1 3.55Å; R704-L751 HydrophobicContact CG-CD2 3.8Å; R704-L751 HydrophobicContact CG-CG 4.33Å
705	M	87.5	Confident	78.6	Confident	6 Å²	6	41.3 Å²	41.3	3%	0.03	23%	0.225	C	C	.	.	H	α-helix	trans	-61.5	-32	178.7	-67.9	-55.3	96	0	0	112.4	L667 F668 V671 H672 S701 L702 P710	L667-M705 HydrophobicContact CB-CG 3.96Å; F668-M705 HydrophobicContact CB-SD 4.39Å; V671-M705 HydrophobicContact CG2-CB 4.45Å; H672-M705 PolarHBondContact NE2-O 2.93Å; S701-M705 WeakPolarHBondContact O-CG 3.48Å; S701-M705 PolarHBondContact O-N 3.35Å; L702-M705 PolarHBondContact O-N 2.9Å; L702-M705 VanDerWaalsContact O-N 3.1Å; M705-P710 HydrophobicContact CE-CG 3.94Å; M705-P710 HydrophobicContact SD-CG 4.05Å
706	Y	87.3	Confident	77.6	Confident	1 Å²	1	41.8 Å²	41.8	0%	0.004	24%	0.238	C	C	.	.	H	α-helix	trans	-81.5	-37.7	175.8	-69	-42	0	0	0	114.2	V671 T677 L702 L703 R704 A727 N728 A731 V735	V671-Y706 HydrophobicContact CB-CE1 4.41Å; V671-Y706 HydrophobicContact CG1-CD1 3.79Å; V671-Y706 HydrophobicContact CG1-CE1 3.58Å; V671-Y706 HydrophobicContact CG2-CE1 3.92Å; T677-Y706 WeakPolarHBondContact CB-OH 3.4Å; T677-Y706 HydrophobicContact CG2-CE1 4.08Å; T677-Y706 WeakPolarHBondContact CG2-OH 3.18Å; L702-Y706 HydrophobicContact CD1-CD2 4.27Å; L702-Y706 HydrophobicContact CD1-CE2 3.63Å; L702-Y706 HydrophobicContact CD2-CE2 4.08Å; L702-Y706 HydrophobicContact CG-CD2 4.13Å; L702-Y706 HydrophobicContact CG-CE2 3.64Å; L702-Y706 PolarHBondContact O-N 3.26Å; L702-Y706 VanDerWaalsContact O-N 3.14Å; L703-Y706 PolarHBondContact O-N 2.91Å; R704-Y706 PolarHBondContact O-N 3.37Å; Y706-A727 CarbonylContact O-C 3.53Å; Y706-A727 WeakPolarHBondContact O-CA 3.38Å; Y706-N728 HydrophobicContact CD1-CB 4.06Å; Y706-N728 PolarHBondContact O-N 3.46Å; Y706-A731 HydrophobicContact CD1-CB 3.99Å; Y706-A731 HydrophobicContact CD2-CB 3.93Å; Y706-A731 HydrophobicContact CE1-CB 3.83Å; Y706-A731 HydrophobicContact CE2-CB 3.75Å; Y706-A731 HydrophobicContact CG-CB 4.05Å; Y706-V735 HydrophobicContact CE2-CG2 4.01Å
707	L	84.9	Confident	76.3	Confident	21 Å²	21	42.2 Å²	42.2	11%	0.11	25%	0.248	C	C	.	.	H	α-helix	trans	-92.6	-32.4	-173	-66.1	176.2	0	0	0	113.9	L703 R704 L729 A732 L751 L752 P753	L703-L707 HydrophobicContact CD1-CD1 4.07Å; L703-L707 HydrophobicContact CD2-CD1 4.39Å; L703-L707 HydrophobicContact CG-CD1 3.83Å; L703-L707 WeakPolarHBondContact O-CB 3.44Å; L703-L707 WeakPolarHBondContact O-CG 3.35Å; L703-L707 PolarHBondContact O-N 3Å; R704-L707 PolarHBondContact O-N 3.26Å; L707-L729 HydrophobicContact CD2-CD1 3.74Å; L707-A732 HydrophobicContact CD1-CB 4.23Å; L707-A732 HydrophobicContact CD2-CB 3.47Å; L707-A732 VanDerWaalsContact CD2-CB 3.47Å; L707-A732 HydrophobicContact CG-CB 3.69Å; L707-L751 HydrophobicContact CD1-CB 4.3Å; L707-L751 WeakPolarHBondContact CD1-O 3.3Å; L707-L752 HydrophobicContact CD1-CD2 4.1Å; L707-P753 HydrophobicContact CD2-CG 4.46Å
708	S	80.4	Confident	75.1	Confident	67 Å²	67	42.3 Å²	42.3	47%	0.469	25%	0.248	S	C	.	.	S	Bend	trans	-142.5	71.5	-175	58.5	0	0	0	0	109.2	R704	R704-S708 CarbonylContact O-C 3.53Å; R704-S708 WeakPolarHBondContact O-CA 3.46Å; R704-S708 PolarHBondContact O-N 2.97Å; R704-S708 VanDerWaalsContact O-O 3.1Å; R704-S708 PolarHBondContact O-OG 3.47Å
709	P	76.5	Confident	73.4	Confident	32 Å²	32	50.4 Å²	50.4	21%	0.208	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-62	132.4	-178	24.9	-32.7	0	0	0	110.5	P725	P709-P725 HydrophobicContact CB-CB 3.73Å; P709-P725 HydrophobicContact CB-CG 4.02Å; P709-P725 HydrophobicContact CG-CB 4.24Å; P709-P725 HydrophobicContact CG-CG 4.48Å
710	P	71.4	Confident	72.1	Confident	34 Å²	34	54.5 Å²	54.5	22%	0.221	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-69.5	149.5	174.6	27.2	-31.6	0	0	0	110.9	F668 M705 A712 L715	F668-P710 HydrophobicContact CD2-CG 4.12Å; F668-P710 HydrophobicContact CE2-CG 4.46Å; M705-P710 HydrophobicContact CE-CG 3.94Å; M705-P710 HydrophobicContact SD-CG 4.05Å; P710-A712 PolarHBondContact O-N 3.3Å; P710-L715 HydrophobicContact CB-CD1 4.28Å; P710-L715 HydrophobicContact CG-CD1 3.59Å
711	D	66.2	Low	70.5	Confident	117 Å²	117	64.2 Å²	64.2	63%	0.626	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-54.2	138.3	175.4	-69.4	-30.8	0	0	0	110.8	H713 C714	D711-H713 PolarHBondContact O-N 3.2Å; D711-C714 WeakPolarHBondContact O-CB 3.22Å; D711-C714 PolarHBondContact O-N 2.87Å
712	A	61.4	Low	69.3	Low	37 Å²	37	66.4 Å²	66.4	31%	0.306	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-56.2	-23.1	-177.3	0	0	0	0	0	113.4	P710 L722	P710-A712 PolarHBondContact O-N 3.3Å; A712-L722 HydrophobicContact CB-CD1 4.39Å
713	H	59.7	Low	68.1	Low	186 Å²	186	72.8 Å²	72.8	86%	0.861	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-81	-9	178	-62.6	-54.7	0	0	0	114.8	D711	D711-H713 PolarHBondContact O-N 3.2Å
714	C	53.4	Low	67	Low	86 Å²	86	81.1 Å²	81.1	58%	0.581	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-90.8	-4.2	-169.7	-71.1	0	0	0	0	115.3	D711	D711-C714 WeakPolarHBondContact O-CB 3.22Å; D711-C714 PolarHBondContact O-N 2.87Å
715	L	56.8	Low	66.3	Low	36 Å²	36	78.5 Å²	78.5	19%	0.188	43%	0.432	C	S	.	.	S	Bend	trans	-125.4	20	-168.3	-68.3	170.9	0	0	0	116.3	Q665 F668 P710	Q665-L715 HydrophobicContact CG-CB 4.36Å; Q665-L715 HydrophobicContact CG-CD2 3.76Å; F668-L715 HydrophobicContact CB-CD1 3.95Å; F668-L715 HydrophobicContact CD2-CD1 3.77Å; F668-L715 HydrophobicContact CE2-CD1 4.45Å; F668-L715 HydrophobicContact CG-CD1 3.86Å; P710-L715 HydrophobicContact CB-CD1 4.28Å; P710-L715 HydrophobicContact CG-CD1 3.59Å
716	G	59.3	Low	65.6	Low	45 Å²	45	86.1 Å²	86.1	46%	0.464	47%	0.467	S	S	.	.			trans	109.1	178.4	171.1	0	0	0	0	0	113.9	I718	G716-I718 PolarHBondContact O-N 3.39Å
717	P	55.1	Low	65.2	Low	78 Å²	78	89.3 Å²	89.3	51%	0.506	49%	0.494	S	S	.	.			trans	-81.3	78.6	-170.2	31.9	-33.1	0	0	0	111	F646	F646-P717 VanDerWaalsContact CB-O 3.32Å; F646-P717 WeakPolarHBondContact CB-O 3.3Å; F646-P717 HydrophobicContact CD1-CB 4.37Å; F646-P717 HydrophobicContact CD1-CG 3.77Å; F646-P717 WeakPolarHBondContact CD1-O 3.47Å; F646-P717 HydrophobicContact CE1-CB 4.48Å; F646-P717 HydrophobicContact CE1-CG 3.48Å; F646-P717 VanDerWaalsContact CE1-CG 3.48Å; F646-P717 WeakPolarHBondContact CG-O 3.24Å; F646-P717 HydrophobicContact CZ-CG 4.03Å
718	I	59.6	Low	65.2	Low	40 Å²	40	91.1 Å²	91.1	21%	0.205	50%	0.504	C	S	.	.			trans	-88.6	116.5	164.5	-60.1	174.5	0	0	0	106.7	V673 G716 M720	V673-I718 HydrophobicContact CG2-CD1 4.5Å; G716-I718 PolarHBondContact O-N 3.39Å; I718-M720 HydrophobicContact CG2-CB 4.23Å; I718-M720 HydrophobicContact CG2-CG 4.23Å; I718-M720 PolarHBondContact O-N 3.36Å
719	K	53.7	Low	65.4	Low	169 Å²	169	91.1 Å²	91.1	74%	0.735	50%	0.498	S	S	*	.			trans	-93.8	65.7	179.6	-76.6	-175.3	176.1	179.9	0	110.3	F646	F646-K719 PolarHBondContact O-N 2.93Å
720	M	60.8	Low	65.7	Low	87 Å²	87	97.5 Å²	97.5	43%	0.429	53%	0.525	S	S	.	.	S	Bend	trans	-132.6	147.2	173.6	-67.2	-177.8	71.3	0	0	110	L650 V673 I718 L722	L650-M720 HydrophobicContact CD1-SD 4.15Å; V673-M720 HydrophobicContact CG1-SD 4.41Å; I718-M720 HydrophobicContact CG2-CB 4.23Å; I718-M720 HydrophobicContact CG2-CG 4.23Å; I718-M720 PolarHBondContact O-N 3.36Å; M720-L722 HydrophobicContact CB-CD2 4.34Å; M720-L722 HydrophobicContact CB-CG 4.46Å; M720-L722 PolarHBondContact O-N 3.29Å; M720-L722 VanDerWaalsContact O-N 3.12Å
721	E	55.3	Low	66.4	Low	206 Å²	206	96.5 Å²	96.5	96%	0.963	52%	0.52	S	S	*	.			trans	-69.2	103	167.5	-71.1	-176.6	172	0	0	108.1
722	L	62.9	Low	67.3	Low	58 Å²	58	90.9 Å²	90.9	30%	0.304	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-99.4	133.9	-178.8	-65.9	172.6	0	0	0	110.3	F668 V673 A712 M720	F668-L722 HydrophobicContact CE1-CD1 4.41Å; V673-L722 HydrophobicContact CG1-CD2 4.27Å; V673-L722 HydrophobicContact CG2-CD2 4.16Å; A712-L722 HydrophobicContact CB-CD1 4.39Å; M720-L722 HydrophobicContact CB-CD2 4.34Å; M720-L722 HydrophobicContact CB-CG 4.46Å; M720-L722 PolarHBondContact O-N 3.29Å; M720-L722 VanDerWaalsContact O-N 3.12Å
723	T	63.1	Low	68.5	Low	134 Å²	134	91 Å²	91	82%	0.822	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-63.2	142.1	163.8	-3.6	0	0	0	0	109.9
724	E	65.1	Low	69.8	Low	175 Å²	175	86.4 Å²	86.4	82%	0.818	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-58	128.5	177.3	-74.4	-176.6	172.1	0	0	110.8	Q726	E724-Q726 PolarHBondContact O-N 3.44Å
725	P	71.4	Confident	71.5	Confident	34 Å²	34	82.3 Å²	82.3	22%	0.221	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-69	126.8	-174.4	27	-33.3	0	0	0	110.7	H672 P709	H672-P725 HydrophobicContact CB-CB 4.4Å; H672-P725 VanDerWaalsContact ND1-CB 3.3Å; H672-P725 WeakPolarHBondContact ND1-CB 3.23Å; P709-P725 HydrophobicContact CB-CB 3.73Å; P709-P725 HydrophobicContact CB-CG 4.02Å; P709-P725 HydrophobicContact CG-CB 4.24Å; P709-P725 HydrophobicContact CG-CG 4.48Å
726	Q	72.9	Confident	72.9	Confident	166 Å²	166	80.6 Å²	80.6	78%	0.776	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-101.1	145.5	-179.1	-65	-172.5	-13.4	0	0	111.4	E724	E724-Q726 PolarHBondContact O-N 3.44Å
727	A	80.2	Confident	74.2	Confident	68 Å²	68	83 Å²	83	56%	0.562	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-68.6	132.3	175.1	0	0	0	0	0	111	Y706	Y706-A727 CarbonylContact O-C 3.53Å; Y706-A727 WeakPolarHBondContact O-CA 3.38Å
728	N	84.5	Confident	75.7	Confident	59 Å²	59	83.6 Å²	83.6	32%	0.316	43%	0.425	S	S	.	.			trans	-114.3	83.6	179.1	-170.3	-18.4	0	0	0	110.7	Y706 Q730 A731 A732	Y706-N728 HydrophobicContact CD1-CB 4.06Å; Y706-N728 PolarHBondContact O-N 3.46Å; N728-Q730 VanDerWaalsContact C-N 3.27Å; N728-Q730 PolarHBondContact O-N 3.25Å; N728-Q730 PolarHBondContact OD1-N 3.23Å; N728-A731 HydrophobicContact CB-CB 4.23Å; N728-A731 VanDerWaalsContact CG-CB 3.5Å; N728-A731 PolarHBondContact O-N 3.48Å; N728-A731 WeakPolarHBondContact OD1-CB 3.42Å; N728-A731 PolarHBondContact OD1-N 3.47Å; N728-A732 PolarHBondContact O-N 3.33Å; N728-A732 VanDerWaalsContact O-N 3.17Å
729	L	83.3	Confident	77.1	Confident	67 Å²	67	83.2 Å²	83.2	35%	0.351	42%	0.422	S	S	.	.	H	α-helix	trans	-62.3	-33.9	-179.2	-177.6	61.8	0	0	0	112.5	L707 A732 L733	L707-L729 HydrophobicContact CD2-CD1 3.74Å; L729-A732 PolarHBondContact O-N 2.96Å; L729-L733 HydrophobicContact CD1-CG 4.36Å; L729-L733 HydrophobicContact CG-CD1 4.22Å; L729-L733 HydrophobicContact CG-CG 4.46Å; L729-L733 WeakPolarHBondContact O-CG 3.15Å; L729-L733 PolarHBondContact O-N 2.88Å
730	Q	84.4	Confident	78.6	Confident	165 Å²	165	77.1 Å²	77.1	77%	0.771	40%	0.396	S	S	*	.	H	α-helix	trans	-67.5	-45	-178.9	-69.4	-175.8	-18.6	0	0	111.8	N728 A732 L733 H734	N728-Q730 VanDerWaalsContact C-N 3.27Å; N728-Q730 PolarHBondContact O-N 3.25Å; N728-Q730 PolarHBondContact OD1-N 3.23Å; Q730-A732 VanDerWaalsContact C-N 3.32Å; Q730-A732 PolarHBondContact O-N 3.33Å; Q730-L733 PolarHBondContact O-N 3.38Å; Q730-H734 PolarHBondContact O-N 3.35Å
731	A	85	Confident	79.6	Confident	13 Å²	13	76 Å²	76	11%	0.107	40%	0.396	C	S	.	.	H	α-helix	trans	-64.5	-38.1	175.2	0	0	0	0	0	111.8	Y706 N728 H734 V735	Y706-A731 HydrophobicContact CD1-CB 3.99Å; Y706-A731 HydrophobicContact CD2-CB 3.93Å; Y706-A731 HydrophobicContact CE1-CB 3.83Å; Y706-A731 HydrophobicContact CE2-CB 3.75Å; Y706-A731 HydrophobicContact CG-CB 4.05Å; N728-A731 HydrophobicContact CB-CB 4.23Å; N728-A731 VanDerWaalsContact CG-CB 3.5Å; N728-A731 PolarHBondContact O-N 3.48Å; N728-A731 WeakPolarHBondContact OD1-CB 3.42Å; N728-A731 PolarHBondContact OD1-N 3.47Å; A731-H734 WeakPolarHBondContact O-CB 3.28Å; A731-H734 PolarHBondContact O-N 2.93Å; A731-V735 WeakPolarHBondContact O-CG2 3.49Å; A731-V735 PolarHBondContact O-N 2.95Å; A731-V735 VanDerWaalsContact O-N 3.07Å
732	A	86.4	Confident	81.1	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-61.6	-44.5	175.4	0	0	0	0	0	112.8	L703 L707 N728 L729 Q730 H734 V735 L736	L703-A732 HydrophobicContact CD1-CB 3.71Å; L703-A732 WeakPolarHBondContact CD1-O 3.36Å; L707-A732 HydrophobicContact CD1-CB 4.23Å; L707-A732 HydrophobicContact CD2-CB 3.47Å; L707-A732 VanDerWaalsContact CD2-CB 3.47Å; L707-A732 HydrophobicContact CG-CB 3.69Å; N728-A732 PolarHBondContact O-N 3.33Å; N728-A732 VanDerWaalsContact O-N 3.17Å; L729-A732 PolarHBondContact O-N 2.96Å; Q730-A732 VanDerWaalsContact C-N 3.32Å; Q730-A732 PolarHBondContact O-N 3.33Å; A732-H734 VanDerWaalsContact C-N 3.32Å; A732-H734 PolarHBondContact O-N 3.43Å; A732-V735 PolarHBondContact O-N 3.46Å; A732-L736 WeakPolarHBondContact O-CG 3.28Å; A732-L736 PolarHBondContact O-N 3.46Å; A732-L736 VanDerWaalsContact O-N 3.14Å
733	L	85.9	Confident	82.1	Confident	39 Å²	39	66.4 Å²	66.4	20%	0.204	35%	0.35	C	S	.	.	H	α-helix	trans	-64.5	-37.4	176.2	-69.7	173.4	0	0	0	111.8	L729 Q730 L736 E737 E760 I761	L729-L733 HydrophobicContact CD1-CG 4.36Å; L729-L733 HydrophobicContact CG-CD1 4.22Å; L729-L733 HydrophobicContact CG-CG 4.46Å; L729-L733 WeakPolarHBondContact O-CG 3.15Å; L729-L733 PolarHBondContact O-N 2.88Å; Q730-L733 PolarHBondContact O-N 3.38Å; L733-L736 HydrophobicContact CD2-CD1 4.39Å; L733-L736 WeakPolarHBondContact O-CB 3.32Å; L733-L736 PolarHBondContact O-N 3.02Å; L733-E737 PolarHBondContact O-N 3.38Å; L733-E760 HydrophobicContact CD1-CB 4.21Å; L733-E760 HydrophobicContact CD2-CB 4.4Å; L733-I761 HydrophobicContact CD2-CG2 3.8Å
734	H	87.6	Confident	83.2	Confident	89 Å²	89	63.3 Å²	63.3	41%	0.412	33%	0.328	S	S	.	.	H	α-helix	trans	-62.9	-43.5	176.8	-164.8	56.4	0	0	0	112.6	E681 Q730 A731 A732 L736 E737 L738	E681-H734 IonicContact OE1-CD2 3.57Å; Q730-H734 PolarHBondContact O-N 3.35Å; A731-H734 WeakPolarHBondContact O-CB 3.28Å; A731-H734 PolarHBondContact O-N 2.93Å; A732-H734 VanDerWaalsContact C-N 3.32Å; A732-H734 PolarHBondContact O-N 3.43Å; H734-L736 VanDerWaalsContact C-N 3.34Å; H734-L736 PolarHBondContact O-N 2.98Å; H734-E737 PolarHBondContact O-N 3.03Å; H734-L738 WeakPolarHBondContact CE1-CD1 3.43Å; H734-L738 WeakPolarHBondContact NE2-CD1 3.47Å; H734-L738 PolarHBondContact O-N 3.33Å
735	V	87.8	Confident	84.2	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63.1	-39.4	175.3	171.8	0	0	0	0	111.5	Y699 L702 Y706 A731 A732 H739 L743	Y699-V735 HydrophobicContact CD1-CG1 4.26Å; L702-V735 HydrophobicContact CD2-CG2 3.85Å; Y706-V735 HydrophobicContact CE2-CG2 4.01Å; A731-V735 WeakPolarHBondContact O-CG2 3.49Å; A731-V735 PolarHBondContact O-N 2.95Å; A731-V735 VanDerWaalsContact O-N 3.07Å; A732-V735 PolarHBondContact O-N 3.46Å; V735-H739 WeakPolarHBondContact O-CB 3.31Å; V735-H739 PolarHBondContact O-N 3.02Å; V735-L743 HydrophobicContact CG1-CD1 4.31Å
736	L	87.6	Confident	84.9	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-62.1	-44.5	175.4	-71	174.1	0	0	0	111.5	L703 A732 L733 H734 H740 L743 A748 L752 I761 F764	L703-L736 HydrophobicContact CD1-CD1 4.46Å; L703-L736 HydrophobicContact CD1-CD2 4.28Å; L703-L736 HydrophobicContact CD1-CG 4.03Å; L703-L736 HydrophobicContact CD2-CD2 3.94Å; A732-L736 WeakPolarHBondContact O-CG 3.28Å; A732-L736 PolarHBondContact O-N 3.46Å; A732-L736 VanDerWaalsContact O-N 3.14Å; L733-L736 HydrophobicContact CD2-CD1 4.39Å; L733-L736 WeakPolarHBondContact O-CB 3.32Å; L733-L736 PolarHBondContact O-N 3.02Å; H734-L736 VanDerWaalsContact C-N 3.34Å; H734-L736 PolarHBondContact O-N 2.98Å; L736-H740 WeakPolarHBondContact O-CB 3.48Å; L736-H740 PolarHBondContact O-N 3.35Å; L736-L743 HydrophobicContact CD2-CD1 4.01Å; L736-A748 HydrophobicContact CD2-CB 3.87Å; L736-L752 HydrophobicContact CD1-CD1 4.39Å; L736-L752 HydrophobicContact CD1-CD2 3.88Å; L736-L752 HydrophobicContact CD1-CG 4.5Å; L736-I761 HydrophobicContact CD1-CG2 4.49Å; L736-F764 HydrophobicContact CB-CB 4.33Å; L736-F764 HydrophobicContact CB-CD2 4.06Å; L736-F764 HydrophobicContact CB-CG 4.15Å; L736-F764 HydrophobicContact CD2-CD2 4.42Å; L736-F764 HydrophobicContact CD2-CE1 4.44Å; L736-F764 HydrophobicContact CD2-CE2 4.13Å; L736-F764 HydrophobicContact CD2-CZ 4.13Å; L736-F764 WeakPolarHBondContact O-CD2 3.47Å
737	E	85.8	Confident	85.5	Confident	95 Å²	95	54.9 Å²	54.9	44%	0.444	29%	0.294	S	S	.	.	H	α-helix	trans	-67.9	-45.7	-178.8	-172	174.3	-173.1	0	0	112.7	L733 H734 H740 V763	L733-E737 PolarHBondContact O-N 3.38Å; H734-E737 PolarHBondContact O-N 3.03Å; E737-H740 PolarHBondContact O-CD2 3.2Å; E737-V763 HydrophobicContact CG-CB 4.42Å; E737-V763 HydrophobicContact CG-CG1 3.87Å
738	L	86.6	Confident	85.8	Confident	91 Å²	91	51.6 Å²	51.6	48%	0.476	27%	0.267	S	S	.	.	H	α-helix	trans	-83.6	-25.8	-174.6	-70.1	-178.3	0	0	0	114.6	H734	H734-L738 WeakPolarHBondContact CE1-CD1 3.43Å; H734-L738 WeakPolarHBondContact NE2-CD1 3.47Å; H734-L738 PolarHBondContact O-N 3.33Å
739	H	88.8	Confident	85.9	Confident	31 Å²	31	52 Å²	52	14%	0.144	27%	0.268	C	S	.	.			trans	-123.7	24.2	-169.5	-57.5	-40.4	0	0	0	113.6	Y699 V735 S741 K742 L743	Y699-H739 HydrophobicContact CD1-CB 4.08Å; Y699-H739 AromaticContact CD1-CD2 3.73Å; Y699-H739 HydrophobicContact CE1-CB 4.08Å; Y699-H739 AromaticContact CE1-CD2 3.19Å; Y699-H739 WeakPolarHBondContact CE1-CD2 3.41Å; Y699-H739 AromaticContact CE1-CG 3.6Å; Y699-H739 AromaticContact CE1-NE2 3.65Å; V735-H739 WeakPolarHBondContact O-CB 3.31Å; V735-H739 PolarHBondContact O-N 3.02Å; H739-S741 PolarHBondContact O-N 3.47Å; H739-S741 VanDerWaalsContact O-N 3.15Å; H739-K742 PolarHBondContact O-N 2.9Å; H739-L743 PolarHBondContact O-N 3.37Å
740	H	85	Confident	86.1	Confident	41 Å²	41	55.3 Å²	55.3	19%	0.19	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-51.9	-37.5	-179.7	65.7	82.6	0	0	0	114.5	L736 E737 K742 L743 F764 V768 E771	L736-H740 WeakPolarHBondContact O-CB 3.48Å; L736-H740 PolarHBondContact O-N 3.35Å; E737-H740 PolarHBondContact O-CD2 3.2Å; H740-K742 VanDerWaalsContact C-N 3.27Å; H740-K742 PolarHBondContact O-N 3.48Å; H740-L743 PolarHBondContact O-N 3.09Å; H740-F764 HydrophobicContact CB-CD2 3.64Å; H740-F764 HydrophobicContact CB-CE2 3.7Å; H740-V768 HydrophobicContact CB-CG2 3.89Å; H740-E771 IonicContact CE1-OE2 3.79Å; H740-E771 PolarHBondContact CE1-OE2 3.4Å; H740-E771 IonicContact ND1-OE2 2.94Å; H740-E771 PolarHBondContact ND1-OE2 3.41Å
741	S	82.7	Confident	86.2	Confident	63 Å²	63	49.6 Å²	49.6	44%	0.441	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-72.4	-19.1	-179.4	58.5	0	0	0	0	113.6	H739 E771	H739-S741 PolarHBondContact O-N 3.47Å; H739-S741 VanDerWaalsContact O-N 3.15Å; S741-E771 WeakPolarHBondContact CA-OE2 3.45Å; S741-E771 VanDerWaalsContact CB-OE1 3.26Å; S741-E771 WeakPolarHBondContact CB-OE1 3.34Å; S741-E771 WeakPolarHBondContact CB-OE2 3.26Å
742	K	85.4	Confident	86.2	Confident	48 Å²	48	50.2 Å²	50.2	21%	0.209	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-101.2	2.7	179.7	-59.3	-175.3	-178.1	-179.8	0	113.1	Y688 Y699 H739 H740	Y688-K742 HydrophobicContact CD1-CB 4.33Å; Y688-K742 HydrophobicContact CD1-CD 3.76Å; Y688-K742 HydrophobicContact CD1-CG 4.07Å; Y688-K742 HydrophobicContact CD2-CB 4.25Å; Y688-K742 HydrophobicContact CE1-CB 3.88Å; Y688-K742 HydrophobicContact CE1-CD 3.87Å; Y688-K742 HydrophobicContact CE1-CG 3.63Å; Y688-K742 HydrophobicContact CE2-CB 3.8Å; Y688-K742 HydrophobicContact CE2-CG 4.48Å; Y688-K742 WeakPolarHBondContact CE2-O 3.31Å; Y688-K742 HydrophobicContact CG-CB 4.49Å; Y688-K742 HydrophobicContact CG-CD 4.22Å; Y688-K742 WeakPolarHBondContact OH-CA 3.35Å; Y699-K742 HydrophobicContact CD2-CB 3.94Å; Y699-K742 HydrophobicContact CD2-CD 4.21Å; Y699-K742 HydrophobicContact CE2-CB 4.13Å; Y699-K742 HydrophobicContact CE2-CD 3.52Å; Y699-K742 HydrophobicContact CE2-CG 4.5Å; H739-K742 PolarHBondContact O-N 2.9Å; H740-K742 VanDerWaalsContact C-N 3.27Å; H740-K742 PolarHBondContact O-N 3.48Å
743	L	85.3	Confident	86.1	Confident	16 Å²	16	52.5 Å²	52.5	8%	0.084	28%	0.277	C	S	.	.	S	Bend	trans	-113.3	144.6	-177.2	-78.3	167.2	0	0	0	111.6	L700 V735 L736 H739 H740 T745	L700-L743 HydrophobicContact CB-CD2 4.26Å; V735-L743 HydrophobicContact CG1-CD1 4.31Å; L736-L743 HydrophobicContact CD2-CD1 4.01Å; H739-L743 PolarHBondContact O-N 3.37Å; H740-L743 PolarHBondContact O-N 3.09Å; L743-T745 PolarHBondContact O-N 3.28Å
744	N	85.7	Confident	85.9	Confident	69 Å²	69	56.2 Å²	56.2	37%	0.369	31%	0.313	S	S	.	.			trans	-76	108.1	166.3	-174	-49.5	0	0	0	109.4	T746 K747 A748	N744-T746 VanDerWaalsContact C-N 3.29Å; N744-T746 PolarHBondContact O-N 2.9Å; N744-T746 PolarHBondContact OD1-N 2.77Å; N744-T746 VanDerWaalsContact OD1-N 3.09Å; N744-T746 PolarHBondContact OD1-OG1 2.86Å; N744-K747 HydrophobicContact CB-CB 4.18Å; N744-K747 HydrophobicContact CB-CD 4.08Å; N744-K747 HydrophobicContact CB-CG 4.12Å; N744-K747 PolarHBondContact O-N 3.43Å; N744-K747 VanDerWaalsContact O-N 3.17Å; N744-K747 PolarHBondContact OD1-N 2.93Å; N744-A748 WeakPolarHBondContact O-CB 3.15Å; N744-A748 PolarHBondContact O-N 3.38Å
745	T	86	Confident	85.7	Confident	32 Å²	32	58.5 Å²	58.5	20%	0.196	33%	0.328	C	S	.	.	H	α-helix	trans	-51	-44.5	-177.1	-44	0	0	0	0	113.1	L743 A748 I749 F764 V768	L743-T745 PolarHBondContact O-N 3.28Å; T745-A748 PolarHBondContact O-N 3.24Å; T745-I749 HydrophobicContact CG2-CD1 3.89Å; T745-I749 VanDerWaalsContact O-CG1 3.28Å; T745-I749 WeakPolarHBondContact O-CG1 3.38Å; T745-I749 PolarHBondContact O-N 3.02Å; T745-F764 HydrophobicContact CG2-CE1 4.29Å; T745-F764 HydrophobicContact CG2-CZ 4.07Å; T745-V768 HydrophobicContact CG2-CG1 3.88Å; T745-V768 HydrophobicContact CG2-CG2 4.39Å
746	T	86.4	Confident	85.5	Confident	93 Å²	93	59.7 Å²	59.7	57%	0.571	34%	0.336	S	S	*	.	H	α-helix	trans	-67.9	-43	-177	60.6	0	0	0	0	112.1	N744 N750	N744-T746 VanDerWaalsContact C-N 3.29Å; N744-T746 PolarHBondContact O-N 2.9Å; N744-T746 PolarHBondContact OD1-N 2.77Å; N744-T746 VanDerWaalsContact OD1-N 3.09Å; N744-T746 PolarHBondContact OD1-OG1 2.86Å; T746-N750 PolarHBondContact O-N 3.39Å; T746-N750 PolarHBondContact O-ND2 3.1Å
747	K	85.8	Confident	85.5	Confident	72 Å²	72	65.4 Å²	65.4	31%	0.313	36%	0.362	S	S	.	.	H	α-helix	trans	-68.2	-40.4	177.7	-62.6	-176.1	-174.6	175.3	0	111.3	D697 L700 N744 N750 L751	D697-K747 VanDerWaalsContact CG-NZ 3.25Å; D697-K747 IonicContact OD1-NZ 2.99Å; D697-K747 PolarHBondContact OD1-NZ 3.43Å; D697-K747 IonicContact OD2-NZ 3.98Å; D697-K747 PolarHBondContact OD2-NZ 2.98Å; L700-K747 HydrophobicContact CD1-CB 3.78Å; L700-K747 HydrophobicContact CD2-CB 3.77Å; L700-K747 HydrophobicContact CD2-CD 3.47Å; L700-K747 VanDerWaalsContact CD2-CD 3.47Å; L700-K747 HydrophobicContact CD2-CG 4.29Å; L700-K747 HydrophobicContact CG-CB 4.45Å; N744-K747 HydrophobicContact CB-CB 4.18Å; N744-K747 HydrophobicContact CB-CD 4.08Å; N744-K747 HydrophobicContact CB-CG 4.12Å; N744-K747 PolarHBondContact O-N 3.43Å; N744-K747 VanDerWaalsContact O-N 3.17Å; N744-K747 PolarHBondContact OD1-N 2.93Å; K747-N750 PolarHBondContact O-N 2.76Å; K747-L751 WeakPolarHBondContact O-CG 3.26Å; K747-L751 PolarHBondContact O-N 3.39Å
748	A	86.7	Confident	85.4	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-63.7	-43.2	-179.9	0	0	0	0	0	112.1	L700 L703 L736 N744 T745 N750 L751 F764	L700-A748 HydrophobicContact CD1-CB 4.36Å; L703-A748 HydrophobicContact CD2-CB 4.05Å; L736-A748 HydrophobicContact CD2-CB 3.87Å; N744-A748 WeakPolarHBondContact O-CB 3.15Å; N744-A748 PolarHBondContact O-N 3.38Å; T745-A748 PolarHBondContact O-N 3.24Å; A748-N750 PolarHBondContact O-N 3.48Å; A748-L751 PolarHBondContact O-N 3.09Å; A748-F764 HydrophobicContact CB-CZ 4.46Å
749	I	86.2	Confident	85.5	Confident	68 Å²	68	73.1 Å²	73.1	35%	0.349	39%	0.39	S	S	.	.	H	α-helix	trans	-64.1	-40.5	176.2	-67.9	168.6	0	0	0	111.3	T745 L751 L752 F764 L765	T745-I749 HydrophobicContact CG2-CD1 3.89Å; T745-I749 VanDerWaalsContact O-CG1 3.28Å; T745-I749 WeakPolarHBondContact O-CG1 3.38Å; T745-I749 PolarHBondContact O-N 3.02Å; I749-L751 PolarHBondContact O-N 3.33Å; I749-L752 WeakPolarHBondContact O-CB 3.5Å; I749-L752 PolarHBondContact O-N 3Å; I749-F764 HydrophobicContact CG1-CE1 4.16Å; I749-L765 HydrophobicContact CD1-CD2 4.15Å
750	N	87.3	Confident	85.3	Confident	135 Å²	135	75.8 Å²	75.8	72%	0.722	40%	0.402	S	S	*	.	H	α-helix	trans	-67.5	-18.1	179.7	-70.7	-17	0	0	0	114	T746 K747 A748	T746-N750 PolarHBondContact O-N 3.39Å; T746-N750 PolarHBondContact O-ND2 3.1Å; K747-N750 PolarHBondContact O-N 2.76Å; A748-N750 PolarHBondContact O-N 3.48Å
751	L	86.2	Confident	85.5	Confident	46 Å²	46	74.7 Å²	74.7	24%	0.241	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-13.8	177.2	-71.4	174.6	0	0	0	113.2	L700 L703 R704 L707 K747 A748 I749	L700-L751 HydrophobicContact CD1-CD1 3.47Å; L700-L751 VanDerWaalsContact CD1-CD1 3.47Å; L700-L751 HydrophobicContact CG-CD1 3.84Å; L703-L751 HydrophobicContact CD2-CB 4.4Å; L703-L751 HydrophobicContact CD2-CD1 4.16Å; R704-L751 HydrophobicContact CG-CD1 3.55Å; R704-L751 HydrophobicContact CG-CD2 3.8Å; R704-L751 HydrophobicContact CG-CG 4.33Å; L707-L751 HydrophobicContact CD1-CB 4.3Å; L707-L751 WeakPolarHBondContact CD1-O 3.3Å; K747-L751 WeakPolarHBondContact O-CG 3.26Å; K747-L751 PolarHBondContact O-N 3.39Å; A748-L751 PolarHBondContact O-N 3.09Å; I749-L751 PolarHBondContact O-N 3.33Å
752	L	85.6	Confident	85.7	Confident	25 Å²	25	77.1 Å²	77.1	13%	0.131	40%	0.4	C	S	.	.	S	Bend	trans	-70.1	138.3	179.5	-70.2	170.7	0	0	0	110.8	L707 L736 I749 T756 I761	L707-L752 HydrophobicContact CD1-CD2 4.1Å; L736-L752 HydrophobicContact CD1-CD1 4.39Å; L736-L752 HydrophobicContact CD1-CD2 3.88Å; L736-L752 HydrophobicContact CD1-CG 4.5Å; I749-L752 WeakPolarHBondContact O-CB 3.5Å; I749-L752 PolarHBondContact O-N 3Å; L752-T756 HydrophobicContact CD2-CG2 4.44Å; L752-I761 HydrophobicContact CD1-CD1 4.13Å; L752-I761 HydrophobicContact CD1-CG2 3.81Å
753	P	84.4	Confident	85.8	Confident	48 Å²	48	77.9 Å²	77.9	31%	0.312	41%	0.409	S	S	.	.			trans	-53.7	142.4	170.7	-28.4	36.7	0	0	0	112.5	L707 N755 T756	L707-P753 HydrophobicContact CD2-CG 4.46Å; P753-N755 WeakPolarHBondContact CB-OD1 3.29Å; P753-N755 PolarHBondContact O-N 3.21Å; P753-T756 WeakPolarHBondContact O-CB 3.37Å; P753-T756 PolarHBondContact O-N 3.25Å; P753-T756 PolarHBondContact O-OG1 3.06Å; P753-T756 VanDerWaalsContact O-OG1 3.06Å
754	A	81.3	Confident	85.9	Confident	117 Å²	117	77.4 Å²	77.4	97%	0.967	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-15.3	-177.6	0	0	0	0	0	114.2
755	N	82.6	Confident	86.1	Confident	137 Å²	137	76.7 Å²	76.7	73%	0.733	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-0.6	176.9	62.3	-27	0	0	0	114	P753 Q757	P753-N755 WeakPolarHBondContact CB-OD1 3.29Å; P753-N755 PolarHBondContact O-N 3.21Å; N755-Q757 PolarHBondContact O-N 2.94Å
756	T	84.9	Confident	86.3	Confident	25 Å²	25	79.6 Å²	79.6	15%	0.153	41%	0.413	C	S	.	.			trans	-64.1	124.5	176.4	-59.8	0	0	0	0	110.6	L752 P753 E760 I761	L752-T756 HydrophobicContact CD2-CG2 4.44Å; P753-T756 WeakPolarHBondContact O-CB 3.37Å; P753-T756 PolarHBondContact O-N 3.25Å; P753-T756 PolarHBondContact O-OG1 3.06Å; P753-T756 VanDerWaalsContact O-OG1 3.06Å; T756-E760 HydrophobicContact CG2-CB 4.49Å; T756-I761 HydrophobicContact CG2-CG2 4.14Å
757	Q	87.1	Confident	86.3	Confident	121 Å²	121	76.6 Å²	76.6	57%	0.565	40%	0.396	S	S	*	.			trans	-75.7	137.4	-179.5	-61.4	-175.9	20.7	0	0	110.2	N755 R759 E760	N755-Q757 PolarHBondContact O-N 2.94Å; Q757-R759 PolarHBondContact O-N 3.43Å; Q757-E760 HydrophobicContact CB-CG 4.19Å; Q757-E760 PolarHBondContact N-OE2 3.23Å; Q757-E760 WeakPolarHBondContact O-CB 2.99Å; Q757-E760 PolarHBondContact O-N 3.46Å
758	I	84.6	Confident	86.5	Confident	134 Å²	134	73.7 Å²	73.7	69%	0.687	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-55.1	-30.7	178	-63.4	175.2	0	0	0	111.8	E760 I761 K762	I758-E760 PolarHBondContact O-N 2.98Å; I758-I761 WeakPolarHBondContact O-CG1 3.49Å; I758-I761 PolarHBondContact O-N 2.86Å; I758-K762 PolarHBondContact O-N 3.02Å; I758-K762 VanDerWaalsContact O-N 3.17Å
759	R	87.4	Confident	86.6	Confident	215 Å²	215	79.7 Å²	79.7	81%	0.811	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-58.2	-34.4	175.4	-175	-179.7	177.4	-171.6	-1	112.8	Q757 I761 K762	Q757-R759 PolarHBondContact O-N 3.43Å; R759-I761 VanDerWaalsContact C-N 3.33Å; R759-K762 WeakPolarHBondContact O-CB 3.42Å
760	E	84.8	Confident	86.8	Confident	86 Å²	86	83 Å²	83	40%	0.402	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-73.4	-25.2	-177.4	-64.1	169.6	178.5	0	0	112.3	L733 T756 Q757 I758	L733-E760 HydrophobicContact CD1-CB 4.21Å; L733-E760 HydrophobicContact CD2-CB 4.4Å; T756-E760 HydrophobicContact CG2-CB 4.49Å; Q757-E760 HydrophobicContact CB-CG 4.19Å; Q757-E760 PolarHBondContact N-OE2 3.23Å; Q757-E760 WeakPolarHBondContact O-CB 2.99Å; Q757-E760 PolarHBondContact O-N 3.46Å; I758-E760 PolarHBondContact O-N 2.98Å
761	I	88.3	Confident	86.9	Confident	18 Å²	18	79.3 Å²	79.3	9%	0.092	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-107.7	9.8	179	60.8	170.1	0	0	0	113.3	L733 L736 L752 T756 I758 R759 V763 F764 L765	L733-I761 HydrophobicContact CD2-CG2 3.8Å; L736-I761 HydrophobicContact CD1-CG2 4.49Å; L752-I761 HydrophobicContact CD1-CD1 4.13Å; L752-I761 HydrophobicContact CD1-CG2 3.81Å; T756-I761 HydrophobicContact CG2-CG2 4.14Å; I758-I761 WeakPolarHBondContact O-CG1 3.49Å; I758-I761 PolarHBondContact O-N 2.86Å; R759-I761 VanDerWaalsContact C-N 3.33Å; I761-V763 PolarHBondContact O-N 3.48Å; I761-F764 WeakPolarHBondContact O-CB 3.28Å; I761-F764 PolarHBondContact O-N 3.26Å; I761-L765 HydrophobicContact CD1-CD1 4.05Å; I761-L765 HydrophobicContact CD1-CG 4.46Å; I761-L765 HydrophobicContact CG1-CD1 4.14Å; I761-L765 WeakPolarHBondContact O-CG 3.48Å; I761-L765 PolarHBondContact O-N 3.49Å
762	K	88.6	Confident	86.9	Confident	114 Å²	114	82.6 Å²	82.6	50%	0.496	42%	0.421	S	S	.	.	H	α-helix	trans	-55.2	-49.9	-176.8	-178	-171.3	168	-167.2	0	111.8	I758 R759 F764 L765 E766	I758-K762 PolarHBondContact O-N 3.02Å; I758-K762 VanDerWaalsContact O-N 3.17Å; R759-K762 WeakPolarHBondContact O-CB 3.42Å; K762-F764 VanDerWaalsContact C-N 3.34Å; K762-F764 PolarHBondContact O-N 2.93Å; K762-L765 PolarHBondContact O-N 3.44Å; K762-E766 VanDerWaalsContact CE-CD 3.42Å; K762-E766 WeakPolarHBondContact CE-OE1 3.4Å; K762-E766 WeakPolarHBondContact CE-OE2 3.41Å; K762-E766 IonicContact NZ-OE1 3.44Å; K762-E766 WeakPolarHBondContact O-CG 3.47Å; K762-E766 PolarHBondContact O-N 3.05Å
763	V	87.3	Confident	87.2	Confident	65 Å²	65	83.6 Å²	83.6	39%	0.394	43%	0.432	S	S	.	.	H	α-helix	trans	-61.9	-43.6	-177.3	-176.3	0	0	0	0	110.8	E737 I761 L765 E766 S767	E737-V763 HydrophobicContact CG-CB 4.42Å; E737-V763 HydrophobicContact CG-CG1 3.87Å; I761-V763 PolarHBondContact O-N 3.48Å; V763-L765 PolarHBondContact O-N 2.91Å; V763-E766 PolarHBondContact O-N 3.2Å; V763-S767 WeakPolarHBondContact O-CB 3.19Å; V763-S767 PolarHBondContact O-N 3.12Å; V763-S767 PolarHBondContact O-OG 3.36Å
764	F	87.8	Confident	87.6	Confident	5 Å²	5	86.9 Å²	86.9	2%	0.022	44%	0.443	C	S	.	.	H	α-helix	trans	-57.8	-47.4	174.9	167.8	-111.5	0	0	0	112.4	L736 H740 T745 A748 I749 I761 K762 S767 V768	L736-F764 HydrophobicContact CB-CB 4.33Å; L736-F764 HydrophobicContact CB-CD2 4.06Å; L736-F764 HydrophobicContact CB-CG 4.15Å; L736-F764 HydrophobicContact CD2-CD2 4.42Å; L736-F764 HydrophobicContact CD2-CE1 4.44Å; L736-F764 HydrophobicContact CD2-CE2 4.13Å; L736-F764 HydrophobicContact CD2-CZ 4.13Å; L736-F764 WeakPolarHBondContact O-CD2 3.47Å; H740-F764 HydrophobicContact CB-CD2 3.64Å; H740-F764 HydrophobicContact CB-CE2 3.7Å; T745-F764 HydrophobicContact CG2-CE1 4.29Å; T745-F764 HydrophobicContact CG2-CZ 4.07Å; A748-F764 HydrophobicContact CB-CZ 4.46Å; I749-F764 HydrophobicContact CG1-CE1 4.16Å; I761-F764 WeakPolarHBondContact O-CB 3.28Å; I761-F764 PolarHBondContact O-N 3.26Å; K762-F764 VanDerWaalsContact C-N 3.34Å; K762-F764 PolarHBondContact O-N 2.93Å; F764-S767 PolarHBondContact O-N 3.2Å; F764-V768 HydrophobicContact CD2-CG2 3.99Å; F764-V768 HydrophobicContact CE2-CG2 3.62Å; F764-V768 HydrophobicContact CZ-CG2 3.95Å; F764-V768 VanDerWaalsContact O-CG2 3.3Å; F764-V768 WeakPolarHBondContact O-CG2 3.43Å; F764-V768 PolarHBondContact O-N 3.48Å
765	L	88.6	Confident	88	Confident	55 Å²	55	86.1 Å²	86.1	29%	0.288	42%	0.421	S	S	.	.	H	α-helix	trans	-66	-40.8	-179.7	-67.9	175.5	0	0	0	112.3	I749 I761 K762 V763 L769	I749-L765 HydrophobicContact CD1-CD2 4.15Å; I761-L765 HydrophobicContact CD1-CD1 4.05Å; I761-L765 HydrophobicContact CD1-CG 4.46Å; I761-L765 HydrophobicContact CG1-CD1 4.14Å; I761-L765 WeakPolarHBondContact O-CG 3.48Å; I761-L765 PolarHBondContact O-N 3.49Å; K762-L765 PolarHBondContact O-N 3.44Å; V763-L765 PolarHBondContact O-N 2.91Å; L765-L769 WeakPolarHBondContact O-CB 3.3Å; L765-L769 VanDerWaalsContact O-CG 3.25Å; L765-L769 WeakPolarHBondContact O-CG 3.24Å; L765-L769 PolarHBondContact O-N 3.49Å
766	E	90.1	Very high	88.4	Confident	93 Å²	93	86.7 Å²	86.7	44%	0.435	42%	0.417	S	S	.	.	H	α-helix	trans	-60.3	-51.1	175.3	-74.1	176.3	156.3	0	0	110.6	K762 V763 V768 L769 E770	K762-E766 VanDerWaalsContact CE-CD 3.42Å; K762-E766 WeakPolarHBondContact CE-OE1 3.4Å; K762-E766 WeakPolarHBondContact CE-OE2 3.41Å; K762-E766 IonicContact NZ-OE1 3.44Å; K762-E766 WeakPolarHBondContact O-CG 3.47Å; K762-E766 PolarHBondContact O-N 3.05Å; V763-E766 PolarHBondContact O-N 3.2Å; E766-V768 PolarHBondContact O-N 3.32Å; E766-L769 PolarHBondContact O-N 3.02Å; E766-E770 WeakPolarHBondContact O-CG 3.36Å; E766-E770 PolarHBondContact O-N 3.14Å
767	S	87.8	Confident	88.9	Confident	30 Å²	30	93.4 Å²	93.4	21%	0.21	44%	0.44	C	S	.	.	H	α-helix	trans	-60.4	-42.3	179.7	-60.6	0	0	0	0	113.2	V763 F764 E771	V763-S767 WeakPolarHBondContact O-CB 3.19Å; V763-S767 PolarHBondContact O-N 3.12Å; V763-S767 PolarHBondContact O-OG 3.36Å; F764-S767 PolarHBondContact O-N 3.2Å; S767-E771 WeakPolarHBondContact O-CB 3.42Å; S767-E771 PolarHBondContact O-N 3.02Å
768	V	89.6	Confident	89.2	Confident	11 Å²	11	91 Å²	91	7%	0.067	44%	0.435	C	S	.	.	H	α-helix	trans	-65.1	-43.9	177.2	171.7	0	0	0	0	111.5	H740 T745 F764 E766 E771 K772	H740-V768 HydrophobicContact CB-CG2 3.89Å; T745-V768 HydrophobicContact CG2-CG1 3.88Å; T745-V768 HydrophobicContact CG2-CG2 4.39Å; F764-V768 HydrophobicContact CD2-CG2 3.99Å; F764-V768 HydrophobicContact CE2-CG2 3.62Å; F764-V768 HydrophobicContact CZ-CG2 3.95Å; F764-V768 VanDerWaalsContact O-CG2 3.3Å; F764-V768 WeakPolarHBondContact O-CG2 3.43Å; F764-V768 PolarHBondContact O-N 3.48Å; E766-V768 PolarHBondContact O-N 3.32Å; V768-E771 PolarHBondContact O-N 2.79Å; V768-K772 HydrophobicContact CG1-CG 4.3Å; V768-K772 WeakPolarHBondContact O-CB 3.3Å; V768-K772 VanDerWaalsContact O-CG 3.24Å; V768-K772 WeakPolarHBondContact O-CG 3.33Å; V768-K772 PolarHBondContact O-N 2.98Å
769	L	89.4	Confident	89.6	Confident	125 Å²	125	88.5 Å²	88.5	65%	0.654	42%	0.424	S	S	*	.	H	α-helix	trans	-65.7	-41.7	-179	-73.6	172.2	0	0	0	111.6	L765 E766 K772 A773	L765-L769 WeakPolarHBondContact O-CB 3.3Å; L765-L769 VanDerWaalsContact O-CG 3.25Å; L765-L769 WeakPolarHBondContact O-CG 3.24Å; L765-L769 PolarHBondContact O-N 3.49Å; E766-L769 PolarHBondContact O-N 3.02Å; L769-K772 PolarHBondContact O-N 3.39Å; L769-A773 WeakPolarHBondContact O-CB 3.3Å; L769-A773 PolarHBondContact O-N 3.37Å
770	E	90.1	Very high	89.9	Confident	137 Å²	137	84 Å²	84	64%	0.64	41%	0.412	S	S	*	.	H	α-helix	trans	-61.4	-47.3	175.6	-74.5	-176	-180	0	0	111.9	E766 K772 A773 Q774	E766-E770 WeakPolarHBondContact O-CG 3.36Å; E766-E770 PolarHBondContact O-N 3.14Å; E770-K772 PolarHBondContact O-N 2.96Å; E770-A773 PolarHBondContact O-N 3.04Å; E770-Q774 WeakPolarHBondContact O-CB 3.19Å; E770-Q774 PolarHBondContact O-N 3.36Å
771	E	87.6	Confident	90.5	Very high	59 Å²	59	84.2 Å²	84.2	28%	0.276	42%	0.418	S	S	.	.	H	α-helix	trans	-60.6	-46.2	177.9	-174.3	-176.6	175	0	0	111.4	H740 S741 S767 V768 A773 Q774 M775	H740-E771 IonicContact CE1-OE2 3.79Å; H740-E771 PolarHBondContact CE1-OE2 3.4Å; H740-E771 IonicContact ND1-OE2 2.94Å; H740-E771 PolarHBondContact ND1-OE2 3.41Å; S741-E771 WeakPolarHBondContact CA-OE2 3.45Å; S741-E771 VanDerWaalsContact CB-OE1 3.26Å; S741-E771 WeakPolarHBondContact CB-OE1 3.34Å; S741-E771 WeakPolarHBondContact CB-OE2 3.26Å; S767-E771 WeakPolarHBondContact O-CB 3.42Å; S767-E771 PolarHBondContact O-N 3.02Å; V768-E771 PolarHBondContact O-N 2.79Å; E771-A773 VanDerWaalsContact C-N 3.33Å; E771-A773 PolarHBondContact O-N 3.12Å; E771-Q774 PolarHBondContact O-N 3.4Å; E771-M775 WeakPolarHBondContact O-CB 3.5Å; E771-M775 PolarHBondContact O-N 3.25Å
772	K	87.8	Confident	90.8	Very high	115 Å²	115	87.9 Å²	87.9	50%	0.5	44%	0.438	S	S	.	.	H	α-helix	trans	-63.8	-38.4	177.2	-67.4	-64.3	175.9	-164.8	0	111.9	V768 L769 E770 K776	V768-K772 HydrophobicContact CG1-CG 4.3Å; V768-K772 WeakPolarHBondContact O-CB 3.3Å; V768-K772 VanDerWaalsContact O-CG 3.24Å; V768-K772 WeakPolarHBondContact O-CG 3.33Å; V768-K772 PolarHBondContact O-N 2.98Å; L769-K772 PolarHBondContact O-N 3.39Å; E770-K772 PolarHBondContact O-N 2.96Å; K772-K776 WeakPolarHBondContact O-CB 3.42Å; K772-K776 PolarHBondContact O-N 3.15Å
773	A	91.9	Very high	91.1	Very high	45 Å²	45	89.8 Å²	89.8	37%	0.372	45%	0.446	S	S	.	.	H	α-helix	trans	-67	-39.5	175.5	0	0	0	0	0	112.2	L769 E770 E771 R777	L769-A773 WeakPolarHBondContact O-CB 3.3Å; L769-A773 PolarHBondContact O-N 3.37Å; E770-A773 PolarHBondContact O-N 3.04Å; E771-A773 VanDerWaalsContact C-N 3.33Å; E771-A773 PolarHBondContact O-N 3.12Å; A773-R777 WeakPolarHBondContact O-CG 3.35Å; A773-R777 PolarHBondContact O-N 2.86Å; A773-R777 PolarHBondContact O-NE 3.12Å
774	Q	92.1	Very high	91.5	Very high	117 Å²	117	90.2 Å²	90.2	55%	0.547	45%	0.452	S	S	.	.	H	α-helix	trans	-64.9	-49.6	174.4	-176.6	177.5	-1.1	0	0	111.5	E770 E771 K776 R777 C778	E770-Q774 WeakPolarHBondContact O-CB 3.19Å; E770-Q774 PolarHBondContact O-N 3.36Å; E771-Q774 PolarHBondContact O-N 3.4Å; Q774-K776 VanDerWaalsContact C-N 3.29Å; Q774-K776 PolarHBondContact O-N 2.89Å; Q774-R777 WeakPolarHBondContact O-CB 3.48Å; Q774-R777 PolarHBondContact O-N 3.3Å; Q774-C778 PolarHBondContact O-N 3.15Å
775	M	89.1	Confident	91.8	Very high	101 Å²	101	95.2 Å²	95.2	50%	0.498	48%	0.479	S	S	.	.	H	α-helix	trans	-58.2	-40.8	178.5	-177.4	176.4	155.9	0	0	111.8	E771 R777 C778 N779	E771-M775 WeakPolarHBondContact O-CB 3.5Å; E771-M775 PolarHBondContact O-N 3.25Å; M775-R777 PolarHBondContact O-N 3.2Å; M775-C778 PolarHBondContact O-N 3.42Å; M775-N779 WeakPolarHBondContact O-CB 3.34Å; M775-N779 VanDerWaalsContact O-CG 3.25Å; M775-N779 PolarHBondContact O-N 2.91Å; M775-N779 PolarHBondContact O-ND2 2.91Å
776	K	92.3	Very high	92.1	Very high	150 Å²	150	97.2 Å²	97.2	65%	0.652	49%	0.489	S	S	*	.	H	α-helix	trans	-58.7	-47	173.2	-176.9	-179.2	177.1	-178	0	111.9	K772 Q774 N779 Q780	K772-K776 WeakPolarHBondContact O-CB 3.42Å; K772-K776 PolarHBondContact O-N 3.15Å; Q774-K776 VanDerWaalsContact C-N 3.29Å; Q774-K776 PolarHBondContact O-N 2.89Å; K776-N779 PolarHBondContact O-N 3.36Å; K776-Q780 WeakPolarHBondContact O-CB 3.48Å; K776-Q780 PolarHBondContact O-N 3.22Å
777	R	94.4	Very high	92.3	Very high	165 Å²	165	97.7 Å²	97.7	62%	0.623	49%	0.491	S	S	*	.	H	α-helix	trans	-62.5	-47.4	178.2	-73.7	-178.6	-75.5	-178.3	-1.1	111.7	A773 Q774 M775 N779 Q780 V781	A773-R777 WeakPolarHBondContact O-CG 3.35Å; A773-R777 PolarHBondContact O-N 2.86Å; A773-R777 PolarHBondContact O-NE 3.12Å; Q774-R777 WeakPolarHBondContact O-CB 3.48Å; Q774-R777 PolarHBondContact O-N 3.3Å; M775-R777 PolarHBondContact O-N 3.2Å; R777-N779 PolarHBondContact O-N 3.38Å; R777-Q780 WeakPolarHBondContact O-CB 3.24Å; R777-Q780 PolarHBondContact O-N 3.09Å; R777-V781 PolarHBondContact O-N 2.92Å; R777-V781 VanDerWaalsContact O-N 3.12Å
778	C	92.8	Very high	92.7	Very high	70 Å²	70	99 Å²	99	47%	0.473	50%	0.504	S	S	.	.	H	α-helix	trans	-59.9	-46.1	177.4	-69.6	0	0	0	0	112.1	Q774 M775 Q780 V781 L782	Q774-C778 PolarHBondContact O-N 3.15Å; M775-C778 PolarHBondContact O-N 3.42Å; C778-Q780 VanDerWaalsContact C-N 3.27Å; C778-Q780 PolarHBondContact O-N 3.34Å; C778-V781 PolarHBondContact O-N 3.49Å; C778-L782 PolarHBondContact O-N 2.94Å
779	N	93.1	Very high	92.9	Very high	83 Å²	83	103.5 Å²	103.5	44%	0.444	52%	0.524	S	S	.	.	H	α-helix	trans	-63.3	-33.5	178	-74	-19.1	0	0	0	112.4	M775 K776 R777 L782 K783	M775-N779 WeakPolarHBondContact O-CB 3.34Å; M775-N779 VanDerWaalsContact O-CG 3.25Å; M775-N779 PolarHBondContact O-N 2.91Å; M775-N779 PolarHBondContact O-ND2 2.91Å; K776-N779 PolarHBondContact O-N 3.36Å; R777-N779 PolarHBondContact O-N 3.38Å; N779-L782 PolarHBondContact O-N 3.49Å; N779-K783 VanDerWaalsContact O-CB 3.3Å; N779-K783 WeakPolarHBondContact O-CB 3.43Å; N779-K783 PolarHBondContact O-N 2.83Å
780	Q	95.4	Very high	93.2	Very high	121 Å²	121	103.2 Å²	103.2	57%	0.565	52%	0.518	S	S	*	.	H	α-helix	trans	-69.6	-35.8	177	-159.7	170.9	2.8	0	0	112.3	K776 R777 C778 S784	K776-Q780 WeakPolarHBondContact O-CB 3.48Å; K776-Q780 PolarHBondContact O-N 3.22Å; R777-Q780 WeakPolarHBondContact O-CB 3.24Å; R777-Q780 PolarHBondContact O-N 3.09Å; C778-Q780 VanDerWaalsContact C-N 3.27Å; C778-Q780 PolarHBondContact O-N 3.34Å; Q780-S784 PolarHBondContact O-N 3.36Å; Q780-S784 PolarHBondContact O-OG 2.94Å
781	V	96.5	Very high	93.4	Very high	89 Å²	89	101.1 Å²	101.1	54%	0.539	51%	0.51	S	S	.	.	H	α-helix	trans	-67.3	-49.5	171.3	174.7	0	0	0	0	110.5	R777 C778 K783 S784 L785	R777-V781 PolarHBondContact O-N 2.92Å; R777-V781 VanDerWaalsContact O-N 3.12Å; C778-V781 PolarHBondContact O-N 3.49Å; V781-K783 VanDerWaalsContact C-N 3.31Å; V781-K783 PolarHBondContact O-N 3.43Å; V781-S784 WeakPolarHBondContact O-CB 3.32Å; V781-S784 PolarHBondContact O-N 3.21Å; V781-L785 HydrophobicContact CG1-CD1 3.99Å; V781-L785 HydrophobicContact CG1-CG 4.32Å; V781-L785 WeakPolarHBondContact O-CG 3.18Å; V781-L785 PolarHBondContact O-N 2.94Å
782	L	94.6	Very high	93.8	Very high	95 Å²	95	105 Å²	105	50%	0.497	52%	0.523	S	S	.	.	H	α-helix	trans	-56.9	-45.6	179	-177.8	65.3	0	0	0	111.4	C778 N779 S784 L785 L786	C778-L782 PolarHBondContact O-N 2.94Å; N779-L782 PolarHBondContact O-N 3.49Å; L782-S784 VanDerWaalsContact C-N 3.3Å; L782-S784 PolarHBondContact O-N 2.64Å; L782-L785 PolarHBondContact O-N 3.32Å; L782-L786 HydrophobicContact CD1-CD1 4.35Å; L782-L786 HydrophobicContact CD1-CG 4.39Å; L782-L786 HydrophobicContact CG-CD1 4.04Å; L782-L786 HydrophobicContact CG-CG 4.49Å; L782-L786 WeakPolarHBondContact O-CB 3.24Å; L782-L786 WeakPolarHBondContact O-CG 3.31Å; L782-L786 PolarHBondContact O-N 3Å
783	K	95.3	Very high	94.1	Very high	154 Å²	154	103.1 Å²	103.1	67%	0.67	52%	0.521	S	S	*	.	H	α-helix	trans	-56.8	-44.4	174.8	-177.9	-179.3	178.1	-179.2	0	111.9	N779 V781 Q787	N779-K783 VanDerWaalsContact O-CB 3.3Å; N779-K783 WeakPolarHBondContact O-CB 3.43Å; N779-K783 PolarHBondContact O-N 2.83Å; V781-K783 VanDerWaalsContact C-N 3.31Å; V781-K783 PolarHBondContact O-N 3.43Å; K783-Q787 WeakPolarHBondContact O-CB 3.17Å; K783-Q787 PolarHBondContact O-N 3.32Å
784	S	94.6	Very high	94.2	Very high	75 Å²	75	104.4 Å²	104.4	52%	0.524	52%	0.519	S	S	.	.	H	α-helix	trans	-66.5	-39.7	179.3	-56.6	0	0	0	0	112.2	Q780 V781 L782 Q787 A788	Q780-S784 PolarHBondContact O-N 3.36Å; Q780-S784 PolarHBondContact O-OG 2.94Å; V781-S784 WeakPolarHBondContact O-CB 3.32Å; V781-S784 PolarHBondContact O-N 3.21Å; L782-S784 VanDerWaalsContact C-N 3.3Å; L782-S784 PolarHBondContact O-N 2.64Å; S784-Q787 PolarHBondContact O-N 3.27Å; S784-A788 PolarHBondContact O-N 2.92Å
785	L	95.6	Very high	94.3	Very high	110 Å²	110	105.3 Å²	105.3	58%	0.576	52%	0.523	S	S	*	.	H	α-helix	trans	-65.9	-46.3	176.6	-70.2	173.8	0	0	0	112	V781 L782 Q787 A788 E789	V781-L785 HydrophobicContact CG1-CD1 3.99Å; V781-L785 HydrophobicContact CG1-CG 4.32Å; V781-L785 WeakPolarHBondContact O-CG 3.18Å; V781-L785 PolarHBondContact O-N 2.94Å; L782-L785 PolarHBondContact O-N 3.32Å; L785-Q787 VanDerWaalsContact C-N 3.28Å; L785-Q787 PolarHBondContact O-N 3.07Å; L785-A788 WeakPolarHBondContact O-CB 3.49Å; L785-A788 PolarHBondContact O-N 3.24Å; L785-A788 VanDerWaalsContact O-N 3.13Å; L785-E789 PolarHBondContact O-N 2.96Å
786	L	93.5	Very high	94.4	Very high	97 Å²	97	104.9 Å²	104.9	51%	0.508	52%	0.52	S	S	.	.	H	α-helix	trans	-61.5	-38.5	176	-70.3	171.9	0	0	0	111.6	L782 E789 F790	L782-L786 HydrophobicContact CD1-CD1 4.35Å; L782-L786 HydrophobicContact CD1-CG 4.39Å; L782-L786 HydrophobicContact CG-CD1 4.04Å; L782-L786 HydrophobicContact CG-CG 4.49Å; L782-L786 WeakPolarHBondContact O-CB 3.24Å; L782-L786 WeakPolarHBondContact O-CG 3.31Å; L782-L786 PolarHBondContact O-N 3Å; L786-E789 PolarHBondContact O-N 2.97Å; L786-F790 WeakPolarHBondContact O-CB 3.24Å; L786-F790 PolarHBondContact O-N 3.37Å
787	Q	95.4	Very high	94.3	Very high	103 Å²	103	104.7 Å²	104.7	48%	0.481	52%	0.515	S	S	.	.	H	α-helix	trans	-64.3	-40.3	174.6	-172.3	65.1	38.6	0	0	111.8	K783 S784 L785 F790 L791	K783-Q787 WeakPolarHBondContact O-CB 3.17Å; K783-Q787 PolarHBondContact O-N 3.32Å; S784-Q787 PolarHBondContact O-N 3.27Å; L785-Q787 VanDerWaalsContact C-N 3.28Å; L785-Q787 PolarHBondContact O-N 3.07Å; Q787-F790 PolarHBondContact O-N 3.42Å; Q787-L791 HydrophobicContact CG-CD1 4.46Å; Q787-L791 VanDerWaalsContact O-CG 3.28Å; Q787-L791 WeakPolarHBondContact O-CG 2.99Å; Q787-L791 PolarHBondContact O-N 3.02Å
788	A	95.9	Very high	94.2	Very high	58 Å²	58	101.4 Å²	101.4	48%	0.479	51%	0.509	S	S	.	.	H	α-helix	trans	-66.5	-42.3	176.8	0	0	0	0	0	112	S784 L785 L791 R792	S784-A788 PolarHBondContact O-N 2.92Å; L785-A788 WeakPolarHBondContact O-CB 3.49Å; L785-A788 PolarHBondContact O-N 3.24Å; L785-A788 VanDerWaalsContact O-N 3.13Å; A788-L791 PolarHBondContact O-N 2.87Å; A788-R792 PolarHBondContact O-N 3.3Å
789	E	94.4	Very high	94	Very high	105 Å²	105	103.8 Å²	103.8	49%	0.491	51%	0.511	S	S	.	.	H	α-helix	trans	-62.9	-44.8	175.1	-174.3	176	-169.5	0	0	111.5	L785 L786 L791 R792 V793	L785-E789 PolarHBondContact O-N 2.96Å; L786-E789 PolarHBondContact O-N 2.97Å; E789-L791 VanDerWaalsContact C-N 3.32Å; E789-L791 PolarHBondContact O-N 3.39Å; E789-R792 PolarHBondContact O-N 3.06Å; E789-V793 WeakPolarHBondContact O-CG2 3.43Å; E789-V793 PolarHBondContact O-N 3.15Å
790	F	94.2	Very high	93.6	Very high	119 Å²	119	106 Å²	106	52%	0.522	52%	0.519	S	S	.	.	H	α-helix	trans	-55.9	-46.5	174.6	173.3	-97	0	0	0	111.8	L786 Q787 V793 Q794	L786-F790 WeakPolarHBondContact O-CB 3.24Å; L786-F790 PolarHBondContact O-N 3.37Å; Q787-F790 PolarHBondContact O-N 3.42Å; F790-V793 PolarHBondContact O-N 2.98Å; F790-Q794 VanDerWaalsContact O-CB 3.31Å; F790-Q794 WeakPolarHBondContact O-CB 3.46Å; F790-Q794 PolarHBondContact O-N 3.07Å
791	L	95.9	Very high	93.1	Very high	92 Å²	92	106.3 Å²	106.3	48%	0.482	52%	0.52	S	S	.	.	H	α-helix	trans	-64.3	-40.2	177.7	-71.4	172.2	0	0	0	112.1	Q787 A788 E789 Q794 E795	Q787-L791 HydrophobicContact CG-CD1 4.46Å; Q787-L791 VanDerWaalsContact O-CG 3.28Å; Q787-L791 WeakPolarHBondContact O-CG 2.99Å; Q787-L791 PolarHBondContact O-N 3.02Å; A788-L791 PolarHBondContact O-N 2.87Å; E789-L791 VanDerWaalsContact C-N 3.32Å; E789-L791 PolarHBondContact O-N 3.39Å; L791-Q794 PolarHBondContact O-N 3.21Å; L791-E795 PolarHBondContact O-N 3.24Å
792	R	95.3	Very high	92.4	Very high	142 Å²	142	107.7 Å²	107.7	54%	0.536	52%	0.521	S	S	.	.	H	α-helix	trans	-61.9	-47.2	176.4	-168.6	-175.2	75.4	-175.5	-3	111.8	A788 E789 Q794 E795 E796	A788-R792 PolarHBondContact O-N 3.3Å; E789-R792 PolarHBondContact O-N 3.06Å; R792-Q794 VanDerWaalsContact C-N 3.27Å; R792-Q794 PolarHBondContact O-N 3.45Å; R792-E795 WeakPolarHBondContact O-CB 3.47Å; R792-E795 PolarHBondContact O-N 3.39Å; R792-E796 IonicContact NE-OE1 3.93Å; R792-E796 WeakPolarHBondContact O-CG 3.34Å; R792-E796 PolarHBondContact O-N 3.39Å
793	V	93.5	Very high	91.7	Very high	75 Å²	75	106.4 Å²	106.4	46%	0.455	52%	0.517	S	S	.	.	H	α-helix	trans	-64.9	-35.8	177.2	174.9	0	0	0	0	110.9	E789 F790 E796 R797	E789-V793 WeakPolarHBondContact O-CG2 3.43Å; E789-V793 PolarHBondContact O-N 3.15Å; F790-V793 PolarHBondContact O-N 2.98Å; V793-E796 PolarHBondContact O-N 2.97Å; V793-R797 WeakPolarHBondContact O-CB 3.43Å; V793-R797 PolarHBondContact O-N 3.38Å
794	Q	93.6	Very high	90.9	Very high	71 Å²	71	107.3 Å²	107.3	33%	0.332	52%	0.521	S	S	.	.	H	α-helix	trans	-66.1	-40.5	175.1	-171.2	172.1	6.9	0	0	112	F790 L791 R792 R797 I798	F790-Q794 VanDerWaalsContact O-CB 3.31Å; F790-Q794 WeakPolarHBondContact O-CB 3.46Å; F790-Q794 PolarHBondContact O-N 3.07Å; L791-Q794 PolarHBondContact O-N 3.21Å; R792-Q794 VanDerWaalsContact C-N 3.27Å; R792-Q794 PolarHBondContact O-N 3.45Å; Q794-R797 WeakPolarHBondContact O-CB 3.34Å; Q794-R797 PolarHBondContact O-N 2.98Å; Q794-I798 HydrophobicContact CG-CD1 4.34Å; Q794-I798 VanDerWaalsContact O-CG1 3.3Å; Q794-I798 WeakPolarHBondContact O-CG1 3.41Å; Q794-I798 PolarHBondContact O-N 2.86Å
795	E	95	Very high	90.2	Very high	137 Å²	137	105.8 Å²	105.8	64%	0.64	51%	0.51	S	S	*	.	H	α-helix	trans	-61.8	-49	172.9	-177.3	-179.3	-163.9	0	0	111.4	L791 R792 R797 I798 F799	L791-E795 PolarHBondContact O-N 3.24Å; R792-E795 WeakPolarHBondContact O-CB 3.47Å; R792-E795 PolarHBondContact O-N 3.39Å; E795-R797 VanDerWaalsContact C-N 3.27Å; E795-R797 PolarHBondContact O-N 3.46Å; E795-I798 PolarHBondContact O-N 3.17Å; E795-I798 VanDerWaalsContact O-N 3.12Å; E795-F799 WeakPolarHBondContact O-CB 3.49Å; E795-F799 PolarHBondContact O-N 3.4Å
796	E	92	Very high	89.6	Confident	92 Å²	92	104.9 Å²	104.9	43%	0.43	51%	0.508	S	S	.	.	H	α-helix	trans	-56.7	-42	175.2	-73.8	173.9	-166.4	0	0	111.5	R792 V793 I798 F799 H800	R792-E796 IonicContact NE-OE1 3.93Å; R792-E796 WeakPolarHBondContact O-CG 3.34Å; R792-E796 PolarHBondContact O-N 3.39Å; V793-E796 PolarHBondContact O-N 2.97Å; E796-I798 PolarHBondContact O-N 3.48Å; E796-F799 WeakPolarHBondContact O-CB 3.25Å; E796-F799 PolarHBondContact O-N 2.99Å; E796-H800 PolarHBondContact O-CD2 2.98Å; E796-H800 PolarHBondContact O-N 3.47Å
797	R	89.6	Confident	89.1	Confident	146 Å²	146	102.8 Å²	102.8	55%	0.551	50%	0.497	S	S	*	.	H	α-helix	trans	-60.6	-47.2	175.9	-167.1	-173.6	94	-174.5	4.2	111.4	V793 Q794 E795 F799 H800 Q801	V793-R797 WeakPolarHBondContact O-CB 3.43Å; V793-R797 PolarHBondContact O-N 3.38Å; Q794-R797 WeakPolarHBondContact O-CB 3.34Å; Q794-R797 PolarHBondContact O-N 2.98Å; E795-R797 VanDerWaalsContact C-N 3.27Å; E795-R797 PolarHBondContact O-N 3.46Å; R797-F799 VanDerWaalsContact C-N 3.32Å; R797-H800 PolarHBondContact O-N 3.02Å; R797-Q801 HydrophobicContact CG-CG 4.42Å; R797-Q801 VanDerWaalsContact O-CB 3.31Å; R797-Q801 WeakPolarHBondContact O-CB 3.45Å; R797-Q801 VanDerWaalsContact O-CG 3.24Å; R797-Q801 WeakPolarHBondContact O-CG 3.33Å; R797-Q801 PolarHBondContact O-N 3.05Å
798	I	91.8	Very high	88.5	Confident	96 Å²	96	101.6 Å²	101.6	49%	0.492	50%	0.497	S	S	.	.	H	α-helix	trans	-62.1	-43.8	177.1	-68.2	164.6	0	0	0	109.9	Q794 E795 E796 H800 Q801 Q802	Q794-I798 HydrophobicContact CG-CD1 4.34Å; Q794-I798 VanDerWaalsContact O-CG1 3.3Å; Q794-I798 WeakPolarHBondContact O-CG1 3.41Å; Q794-I798 PolarHBondContact O-N 2.86Å; E795-I798 PolarHBondContact O-N 3.17Å; E795-I798 VanDerWaalsContact O-N 3.12Å; E796-I798 PolarHBondContact O-N 3.48Å; I798-H800 VanDerWaalsContact C-N 3.3Å; I798-H800 PolarHBondContact O-N 3.45Å; I798-Q801 PolarHBondContact O-N 3.35Å; I798-Q802 PolarHBondContact O-N 3.42Å
799	F	89	Confident	87.7	Confident	119 Å²	119	106.9 Å²	106.9	52%	0.522	51%	0.512	S	S	.	.	H	α-helix	trans	-59.7	-37.9	178.5	179	-90.2	0	0	0	112.5	E795 E796 R797 Q802 V803	E795-F799 WeakPolarHBondContact O-CB 3.49Å; E795-F799 PolarHBondContact O-N 3.4Å; E796-F799 WeakPolarHBondContact O-CB 3.25Å; E796-F799 PolarHBondContact O-N 2.99Å; R797-F799 VanDerWaalsContact C-N 3.32Å; F799-Q802 VanDerWaalsContact O-CG 3.24Å; F799-Q802 WeakPolarHBondContact O-CG 3.16Å; F799-Q802 PolarHBondContact O-NE2 3.37Å; F799-V803 WeakPolarHBondContact O-CG2 3.43Å
800	H	84.1	Confident	87.2	Confident	129 Å²	129	109.5 Å²	109.5	60%	0.597	52%	0.524	S	S	*	.	H	α-helix	trans	-79.9	-34.6	175.3	-70.6	-56.8	0	0	0	112.9	E796 R797 I798 Q802 V803	E796-H800 PolarHBondContact O-CD2 2.98Å; E796-H800 PolarHBondContact O-N 3.47Å; R797-H800 PolarHBondContact O-N 3.02Å; I798-H800 VanDerWaalsContact C-N 3.3Å; I798-H800 PolarHBondContact O-N 3.45Å; H800-Q802 VanDerWaalsContact C-N 3.34Å; H800-Q802 PolarHBondContact O-N 3.28Å; H800-V803 WeakPolarHBondContact O-CB 3.33Å; H800-V803 PolarHBondContact O-N 3.07Å
801	Q	85.3	Confident	86.7	Confident	129 Å²	129	106.9 Å²	106.9	60%	0.603	51%	0.513	S	S	*	.	H	α-helix	trans	-69.1	-27.4	177.5	-76.5	-179.9	-29	0	0	113.5	R797 I798 V803	R797-Q801 HydrophobicContact CG-CG 4.42Å; R797-Q801 VanDerWaalsContact O-CB 3.31Å; R797-Q801 WeakPolarHBondContact O-CB 3.45Å; R797-Q801 VanDerWaalsContact O-CG 3.24Å; R797-Q801 WeakPolarHBondContact O-CG 3.33Å; R797-Q801 PolarHBondContact O-N 3.05Å; I798-Q801 PolarHBondContact O-N 3.35Å; Q801-V803 PolarHBondContact O-N 3.03Å
802	Q	82.4	Confident	86.4	Confident	117 Å²	117	105.7 Å²	105.7	55%	0.547	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-19.3	176.5	83.3	-165.8	-35.2	0	0	112.8	I798 F799 H800 K804	I798-Q802 PolarHBondContact O-N 3.42Å; F799-Q802 VanDerWaalsContact O-CG 3.24Å; F799-Q802 WeakPolarHBondContact O-CG 3.16Å; F799-Q802 PolarHBondContact O-NE2 3.37Å; H800-Q802 VanDerWaalsContact C-N 3.34Å; H800-Q802 PolarHBondContact O-N 3.28Å; Q802-K804 PolarHBondContact O-N 3.49Å
803	V	79.2	Confident	86	Confident	68 Å²	68	98.9 Å²	98.9	41%	0.412	48%	0.483	S	S	.	.			trans	-75.3	93.6	-175.8	-174.1	0	0	0	0	109.9	F799 H800 Q801	F799-V803 WeakPolarHBondContact O-CG2 3.43Å; H800-V803 WeakPolarHBondContact O-CB 3.33Å; H800-V803 PolarHBondContact O-N 3.07Å; Q801-V803 PolarHBondContact O-N 3.03Å
804	K	78.5	Confident	85.5	Confident	174 Å²	174	102.6 Å²	102.6	76%	0.757	49%	0.489	S	S	*	.			trans	-114.6	148.5	175.5	64.9	-176.6	176.8	-175.6	0	112.1	Q802	Q802-K804 PolarHBondContact O-N 3.49Å
805	C	80.1	Confident	85.2	Confident	43 Å²	43	102.3 Å²	102.3	29%	0.291	49%	0.492	S	S	.	.			trans	-120.4	111.4	172.6	177.9	0	0	0	0	110	V833	C805-V833 WeakPolarHBondContact SG-CG2 3.5Å
806	V	82.6	Confident	84.7	Confident	91 Å²	91	98 Å²	98	55%	0.552	48%	0.477	S	S	*	.			trans	-85.4	127.6	174.2	-174.4	0	0	0	0	108.9	T808 K811	V806-T808 HydrophobicContact CG1-CG2 4.02Å; V806-K811 VanDerWaalsContact O-CD 3.22Å; V806-K811 WeakPolarHBondContact O-CD 3.47Å; V806-K811 PolarHBondContact O-NZ 3.14Å
807	I	83.1	Confident	84.4	Confident	53 Å²	53	100.5 Å²	100.5	27%	0.272	49%	0.486	S	S	.	.			trans	-100.5	107.7	171.9	-55.1	-59.3	0	0	0	107.7	K811 I820 F825 V833	I807-K811 HydrophobicContact CD1-CD 4.13Å; I807-I820 HydrophobicContact CG2-CB 4.31Å; I807-I820 HydrophobicContact CG2-CG2 3.88Å; I807-F825 HydrophobicContact CD1-CD2 4.27Å; I807-F825 HydrophobicContact CD1-CE1 4.29Å; I807-F825 HydrophobicContact CD1-CE2 3.99Å; I807-F825 HydrophobicContact CD1-CZ 4.01Å; I807-F825 HydrophobicContact CG1-CD1 4.4Å; I807-F825 HydrophobicContact CG1-CE1 3.8Å; I807-F825 HydrophobicContact CG1-CE2 4.2Å; I807-F825 HydrophobicContact CG1-CZ 3.69Å; I807-V833 HydrophobicContact CD1-CG1 3.97Å; I807-V833 HydrophobicContact CD1-CG2 4.28Å
808	T	82.3	Confident	84.2	Confident	78 Å²	78	100.7 Å²	100.7	48%	0.479	49%	0.491	S	S	.	.			trans	-96.8	161.3	173.6	58	0	0	0	0	109.9	V806 E810 K811	V806-T808 HydrophobicContact CG1-CG2 4.02Å; T808-E810 PolarHBondContact O-N 3.29Å; T808-E810 VanDerWaalsContact O-N 3.09Å; T808-K811 WeakPolarHBondContact O-CB 3.47Å; T808-K811 PolarHBondContact O-N 3.01Å
809	E	79.4	Confident	84.1	Confident	169 Å²	169	102.7 Å²	102.7	79%	0.79	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-20.8	178.3	-64	-173.4	172.7	0	0	113.4	K819	E809-K819 WeakPolarHBondContact O-CD 3.37Å
810	E	84	Confident	84.1	Confident	160 Å²	160	97 Å²	97	75%	0.748	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-10.1	178	-57.7	-168.5	174.5	0	0	113.6	T808 T812	T808-E810 PolarHBondContact O-N 3.29Å; T808-E810 VanDerWaalsContact O-N 3.09Å; E810-T812 PolarHBondContact O-N 2.99Å
811	K	84.4	Confident	83.9	Confident	64 Å²	64	92.6 Å²	92.6	28%	0.278	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-70.1	120.5	-174.4	-162.8	153.2	-179.2	168.6	0	110.4	V806 I807 T808 I820	V806-K811 VanDerWaalsContact O-CD 3.22Å; V806-K811 WeakPolarHBondContact O-CD 3.47Å; V806-K811 PolarHBondContact O-NZ 3.14Å; I807-K811 HydrophobicContact CD1-CD 4.13Å; T808-K811 WeakPolarHBondContact O-CB 3.47Å; T808-K811 PolarHBondContact O-N 3.01Å; K811-I820 WeakPolarHBondContact O-CG1 3.37Å; K811-I820 PolarHBondContact O-N 3.34Å
812	T	88.6	Confident	83.8	Confident	66 Å²	66	95 Å²	95	41%	0.405	48%	0.477	S	S	.	.	B	Isolated β-bridge	trans	-103.3	147.8	-176.6	54.3	0	0	0	0	112.3	E810 R814 K818 K819	E810-T812 PolarHBondContact O-N 2.99Å; T812-R814 PolarHBondContact O-N 3.28Å; T812-K818 CarbonylContact C-O 3.59Å; T812-K818 WeakPolarHBondContact CA-O 3.44Å; T812-K819 HydrophobicContact CG2-CG 4.2Å
813	C	87.7	Confident	83.8	Confident	0 Å²	0	92.3 Å²	92.3	0%	0	47%	0.471	C	S	.	.	P	Polyproline II helix	trans	-66.3	128.4	169.8	171.8	0	0	0	0	109.6	V815 C816 K817 K818 I820 H835	C813-V815 PolarHBondContact O-N 3.46Å; C813-C816 VanDerWaalsContact CB-SG 3.52Å; C813-K817 WeakPolarHBondContact O-CA 3.49Å; C813-K817 PolarHBondContact O-N 3.44Å; C813-K818 PolarHBondContact N-O 3.22Å; C813-I820 HydrophobicContact CB-CD1 3.94Å; C813-H835 WeakPolarHBondContact CB-ND1 3.2Å; C813-H835 PolarHBondContact SG-N 3.25Å
814	R	83.7	Confident	84.1	Confident	152 Å²	152	92.4 Å²	92.4	57%	0.574	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-22	-178	-76	-97.9	-179.6	154.1	-0.8	114.2	T812 K817 V832 V833 T847	T812-R814 PolarHBondContact O-N 3.28Å; R814-K817 WeakPolarHBondContact O-CE 3.49Å; R814-K817 PolarHBondContact O-NZ 3.41Å; R814-V832 HydrophobicContact CB-CG1 3.96Å; R814-V832 HydrophobicContact CG-CG1 3.91Å; R814-V833 PolarHBondContact N-O 3.4Å; R814-T847 HydrophobicContact CB-CG2 3.68Å; R814-T847 HydrophobicContact CG-CG2 4.49Å
815	V	86.1	Confident	84.6	Confident	66 Å²	66	88.5 Å²	88.5	40%	0.4	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-61.7	-179.7	-179.4	0	0	0	0	111.4	C813 V834 C838 P846	C813-V815 PolarHBondContact O-N 3.46Å; V815-V834 HydrophobicContact CG2-CB 4.48Å; V815-V834 HydrophobicContact CG2-CG1 3.81Å; V815-C838 HydrophobicContact CB-CB 3.84Å; V815-C838 HydrophobicContact CG1-CB 4.05Å; V815-C838 HydrophobicContact CG2-CB 4.16Å; V815-P846 HydrophobicContact CG2-CB 3.85Å; V815-P846 HydrophobicContact CG2-CG 3.45Å; V815-P846 VanDerWaalsContact CG2-CG 3.45Å
816	C	84.9	Confident	85	Confident	47 Å²	47	87.5 Å²	87.5	32%	0.318	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-3.8	-174.6	73	0	0	0	0	114.1	C813 K818 H835	C813-C816 VanDerWaalsContact CB-SG 3.52Å; C816-K818 PolarHBondContact O-N 2.96Å; C816-H835 PolarHBondContact SG-ND1 3.49Å
817	K	86.4	Confident	85.2	Confident	143 Å²	143	88 Å²	88	62%	0.622	45%	0.449	S	S	*	.			trans	59.8	7.3	-179.8	-52.2	-64.8	-178.3	179.8	0	115.5	C813 R814	C813-K817 WeakPolarHBondContact O-CA 3.49Å; C813-K817 PolarHBondContact O-N 3.44Å; R814-K817 WeakPolarHBondContact O-CE 3.49Å; R814-K817 PolarHBondContact O-NZ 3.41Å
818	K	85.5	Confident	85.3	Confident	150 Å²	150	86 Å²	86	65%	0.652	44%	0.438	S	S	*	.			trans	-82.7	152.6	174.3	-65.3	-178.2	179.9	-178.7	0	111.3	T812 C813 C816 H835	T812-K818 CarbonylContact C-O 3.59Å; T812-K818 WeakPolarHBondContact CA-O 3.44Å; C813-K818 PolarHBondContact N-O 3.22Å; C816-K818 PolarHBondContact O-N 2.96Å; K818-H835 PolarHBondContact O-CE1 3.24Å
819	K	88.9	Confident	85.2	Confident	138 Å²	138	88.4 Å²	88.4	60%	0.6	46%	0.455	S	S	*	.	B	Isolated β-bridge	trans	-59.8	138.3	174.4	-67.2	179.2	171.7	-167.3	0	110.7	E809 T812 H835	E809-K819 WeakPolarHBondContact O-CD 3.37Å; T812-K819 HydrophobicContact CG2-CG 4.2Å; K819-H835 PolarHBondContact O-CE1 3.23Å; K819-H835 VanDerWaalsContact O-CE1 3.29Å; K819-H835 PolarHBondContact O-NE2 3.36Å
820	I	87.9	Confident	85.3	Confident	1 Å²	1	83.9 Å²	83.9	1%	0.005	44%	0.436	C	S	.	.			trans	-69.3	-52.7	176.4	-64	-77.4	0	0	0	109.1	I807 K811 C813 N822 S823 F825 V833	I807-I820 HydrophobicContact CG2-CB 4.31Å; I807-I820 HydrophobicContact CG2-CG2 3.88Å; K811-I820 WeakPolarHBondContact O-CG1 3.37Å; K811-I820 PolarHBondContact O-N 3.34Å; C813-I820 HydrophobicContact CB-CD1 3.94Å; I820-N822 PolarHBondContact O-N 3.47Å; I820-S823 WeakPolarHBondContact O-CB 3.49Å; I820-S823 PolarHBondContact O-N 2.92Å; I820-S823 PolarHBondContact O-OG 2.96Å; I820-S823 VanDerWaalsContact O-OG 3.07Å; I820-F825 HydrophobicContact CD1-CB 4.08Å; I820-F825 HydrophobicContact CG2-CB 3.93Å; I820-F825 HydrophobicContact CG2-CD1 4.07Å; I820-F825 HydrophobicContact CG2-CG 4.22Å; I820-V833 HydrophobicContact CD1-CG1 3.85Å; I820-V833 HydrophobicContact CG1-CG1 4.15Å
821	G	81.1	Confident	85.1	Confident	35 Å²	35	77.7 Å²	77.7	36%	0.361	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	-130.7	-178.4	0	0	0	0	0	111.9	S823	G821-S823 VanDerWaalsContact C-N 3.27Å; G821-S823 PolarHBondContact O-N 3.46Å
822	N	82.1	Confident	85.2	Confident	181 Å²	181	75.5 Å²	75.5	97%	0.968	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	11.6	177.6	-64.2	-16.5	0	0	0	113.8	I820	I820-N822 PolarHBondContact O-N 3.47Å
823	S	82.6	Confident	85.2	Confident	59 Å²	59	72.6 Å²	72.6	41%	0.413	39%	0.39	S	S	.	.	S	Bend	trans	-80.7	145.7	-177.6	-54.1	0	0	0	0	110.8	I820 G821 F825	I820-S823 WeakPolarHBondContact O-CB 3.49Å; I820-S823 PolarHBondContact O-N 2.92Å; I820-S823 PolarHBondContact O-OG 2.96Å; I820-S823 VanDerWaalsContact O-OG 3.07Å; G821-S823 VanDerWaalsContact C-N 3.27Å; G821-S823 PolarHBondContact O-N 3.46Å; S823-F825 PolarHBondContact O-N 3.17Å
824	A	85.8	Confident	85.3	Confident	71 Å²	71	72.6 Å²	72.6	59%	0.587	39%	0.39	S	S	*	.			trans	-55.9	132.6	171.6	0	0	0	0	0	110.4	Y836	A824-Y836 WeakPolarHBondContact O-CB 3.48Å; A824-Y836 PolarHBondContact O-N 3.16Å
825	F	89.1	Confident	85.5	Confident	92 Å²	92	66.5 Å²	66.5	40%	0.404	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	158.5	-176	69.5	-91.6	0	0	0	111.5	I807 I820 S823 V833 V834	I807-F825 HydrophobicContact CD1-CD2 4.27Å; I807-F825 HydrophobicContact CD1-CE1 4.29Å; I807-F825 HydrophobicContact CD1-CE2 3.99Å; I807-F825 HydrophobicContact CD1-CZ 4.01Å; I807-F825 HydrophobicContact CG1-CD1 4.4Å; I807-F825 HydrophobicContact CG1-CE1 3.8Å; I807-F825 HydrophobicContact CG1-CE2 4.2Å; I807-F825 HydrophobicContact CG1-CZ 3.69Å; I820-F825 HydrophobicContact CD1-CB 4.08Å; I820-F825 HydrophobicContact CG2-CB 3.93Å; I820-F825 HydrophobicContact CG2-CD1 4.07Å; I820-F825 HydrophobicContact CG2-CG 4.22Å; S823-F825 PolarHBondContact O-N 3.17Å; F825-V833 HydrophobicContact CB-CG1 4.02Å; F825-V833 HydrophobicContact CD2-CG1 3.73Å; F825-V833 HydrophobicContact CG-CG1 4.11Å; F825-V834 CarbonylContact C-O 3.06Å; F825-V834 VanDerWaalsContact CA-O 3.24Å; F825-V834 WeakPolarHBondContact CA-O 3.35Å; F825-V834 WeakPolarHBondContact CB-O 3.42Å
826	A	88.4	Confident	85.6	Confident	21 Å²	21	69.7 Å²	69.7	17%	0.174	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	146.8	170.1	0	0	0	0	0	109.2	V833 V834 C839	A826-V833 WeakPolarHBondContact O-CA 2.86Å; A826-V834 HydrophobicContact CB-CG2 4.11Å; A826-V834 PolarHBondContact N-O 3.44Å; A826-V834 PolarHBondContact O-N 3.18Å; A826-C839 HydrophobicContact CB-CB 3.92Å
827	R	86.7	Confident	85.5	Confident	103 Å²	103	76.5 Å²	76.5	39%	0.389	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	123.1	176.7	178.3	-176.5	177.3	-115.7	-6.5	109.4	V832 V833	R827-V832 WeakPolarHBondContact CA-O 3.5Å; R827-V833 HydrophobicContact CG-CG2 4.46Å
828	Y	85.3	Confident	85.4	Confident	10 Å²	10	70.6 Å²	70.6	4%	0.039	37%	0.374	C	S	.	.			trans	-79.6	157.9	173.3	-72.4	-84.3	0	0	0	111.6	N830 G831 V832 V834 C839 D841 V844 C845 P846	Y828-N830 WeakPolarHBondContact CB-OD1 3.35Å; Y828-N830 PolarHBondContact O-N 3.42Å; Y828-N830 VanDerWaalsContact O-N 3.16Å; Y828-G831 PolarHBondContact O-N 2.87Å; Y828-V832 PolarHBondContact N-O 3.45Å; Y828-V834 HydrophobicContact CD2-CG2 4.4Å; Y828-V834 HydrophobicContact CE2-CG1 4.29Å; Y828-V834 HydrophobicContact CE2-CG2 3.74Å; Y828-C839 PolarHBondContact OH-SG 3.24Å; Y828-D841 WeakPolarHBondContact CE1-O 3.26Å; Y828-D841 PolarHBondContact OH-O 3.44Å; Y828-V844 WeakPolarHBondContact CE1-O 3.29Å; Y828-V844 PolarHBondContact OH-O 2.95Å; Y828-C845 HydrophobicContact CD1-CB 4.08Å; Y828-C845 HydrophobicContact CD2-CB 4.45Å; Y828-C845 HydrophobicContact CE1-CB 4.46Å; Y828-C845 HydrophobicContact CG-CB 4.07Å; Y828-P846 VanDerWaalsContact CE2-CD 3.45Å; Y828-P846 HydrophobicContact CE2-CG 4.21Å; Y828-P846 VanDerWaalsContact CZ-CD 3.47Å; Y828-P846 WeakPolarHBondContact OH-CD 3.32Å
829	P	80.6	Confident	85.3	Confident	129 Å²	129	64.7 Å²	64.7	84%	0.838	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-31.6	178.3	-27.8	36	0	0	0	114.2	G831	P829-G831 PolarHBondContact O-N 2.73Å
830	N	80.7	Confident	84.7	Confident	73 Å²	73	67.9 Å²	67.9	39%	0.39	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	2.6	174.5	66.6	4.9	0	0	0	114.3	Y828 V832 C845 E848	Y828-N830 WeakPolarHBondContact CB-OD1 3.35Å; Y828-N830 PolarHBondContact O-N 3.42Å; Y828-N830 VanDerWaalsContact O-N 3.16Å; N830-V832 VanDerWaalsContact C-N 3.35Å; N830-V832 VanDerWaalsContact OD1-CB 3.31Å; N830-V832 WeakPolarHBondContact OD1-CB 3.4Å; N830-V832 WeakPolarHBondContact OD1-CG2 3.45Å; N830-V832 PolarHBondContact OD1-N 3.38Å; N830-V832 VanDerWaalsContact OD1-N 3.09Å; N830-C845 WeakPolarHBondContact ND2-CB 3.43Å; N830-C845 PolarHBondContact ND2-SG 2.92Å; N830-E848 PolarHBondContact ND2-OE1 3.23Å
831	G	80.8	Confident	84.1	Confident	30 Å²	30	71.3 Å²	71.3	31%	0.309	38%	0.384	S	S	.	.	S	Bend	trans	85.5	-0.2	177.9	0	0	0	0	0	115.1	Y828 P829 V833	Y828-G831 PolarHBondContact O-N 2.87Å; P829-G831 PolarHBondContact O-N 2.73Å; G831-V833 PolarHBondContact O-N 3.18Å
832	V	86.4	Confident	83.9	Confident	18 Å²	18	79 Å²	79	11%	0.109	40%	0.402	C	S	.	.			trans	-70.5	127.5	177.1	171.2	0	0	0	0	110.5	R814 R827 Y828 N830 V834	R814-V832 HydrophobicContact CB-CG1 3.96Å; R814-V832 HydrophobicContact CG-CG1 3.91Å; R827-V832 WeakPolarHBondContact CA-O 3.5Å; Y828-V832 PolarHBondContact N-O 3.45Å; N830-V832 VanDerWaalsContact C-N 3.35Å; N830-V832 VanDerWaalsContact OD1-CB 3.31Å; N830-V832 WeakPolarHBondContact OD1-CB 3.4Å; N830-V832 WeakPolarHBondContact OD1-CG2 3.45Å; N830-V832 PolarHBondContact OD1-N 3.38Å; N830-V832 VanDerWaalsContact OD1-N 3.09Å; V832-V834 HydrophobicContact CG1-CG1 3.99Å
833	V	87.6	Confident	83.4	Confident	6 Å²	6	75.4 Å²	75.4	4%	0.036	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	130.7	176.7	-175.8	0	0	0	0	109.5	C805 I807 R814 I820 F825 A826 R827 G831	C805-V833 WeakPolarHBondContact SG-CG2 3.5Å; I807-V833 HydrophobicContact CD1-CG1 3.97Å; I807-V833 HydrophobicContact CD1-CG2 4.28Å; R814-V833 PolarHBondContact N-O 3.4Å; I820-V833 HydrophobicContact CD1-CG1 3.85Å; I820-V833 HydrophobicContact CG1-CG1 4.15Å; F825-V833 HydrophobicContact CB-CG1 4.02Å; F825-V833 HydrophobicContact CD2-CG1 3.73Å; F825-V833 HydrophobicContact CG-CG1 4.11Å; A826-V833 WeakPolarHBondContact O-CA 2.86Å; R827-V833 HydrophobicContact CG-CG2 4.46Å; G831-V833 PolarHBondContact O-N 3.18Å
834	V	89.8	Confident	83	Confident	0 Å²	0	76.4 Å²	76.4	0%	0	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	155.2	177	-59.8	0	0	0	0	109.7	V815 F825 A826 Y828 V832 C838 C839 P846	V815-V834 HydrophobicContact CG2-CB 4.48Å; V815-V834 HydrophobicContact CG2-CG1 3.81Å; F825-V834 CarbonylContact C-O 3.06Å; F825-V834 VanDerWaalsContact CA-O 3.24Å; F825-V834 WeakPolarHBondContact CA-O 3.35Å; F825-V834 WeakPolarHBondContact CB-O 3.42Å; A826-V834 HydrophobicContact CB-CG2 4.11Å; A826-V834 PolarHBondContact N-O 3.44Å; A826-V834 PolarHBondContact O-N 3.18Å; Y828-V834 HydrophobicContact CD2-CG2 4.4Å; Y828-V834 HydrophobicContact CE2-CG1 4.29Å; Y828-V834 HydrophobicContact CE2-CG2 3.74Å; V832-V834 HydrophobicContact CG1-CG1 3.99Å; V834-C838 HydrophobicContact CB-CB 4.21Å; V834-C839 HydrophobicContact CG2-CB 3.93Å; V834-P846 HydrophobicContact CG1-CG 4.34Å
835	H	89.6	Confident	82.3	Confident	23 Å²	23	73.3 Å²	73.3	11%	0.106	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	146.1	165.4	-72.9	112.2	0	0	0	109.6	C813 C816 K818 K819 F837 C838 C839	C813-H835 WeakPolarHBondContact CB-ND1 3.2Å; C813-H835 PolarHBondContact SG-N 3.25Å; C816-H835 PolarHBondContact SG-ND1 3.49Å; K818-H835 PolarHBondContact O-CE1 3.24Å; K819-H835 PolarHBondContact O-CE1 3.23Å; K819-H835 VanDerWaalsContact O-CE1 3.29Å; K819-H835 PolarHBondContact O-NE2 3.36Å; H835-F837 PolarHBondContact O-N 3.4Å; H835-C838 HydrophobicContact CB-CB 4.29Å; H835-C838 WeakPolarHBondContact O-CA 3.48Å; H835-C838 WeakPolarHBondContact O-CB 3.48Å; H835-C838 PolarHBondContact O-N 3.2Å; H835-C839 PolarHBondContact O-N 3.02Å
836	Y	86.5	Confident	81.3	Confident	133 Å²	133	71.7 Å²	71.7	52%	0.522	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-54.5	-39.6	179.9	-174.7	-102.2	0	0	0	111.8	A824 C838 C839 R842	A824-Y836 WeakPolarHBondContact O-CB 3.48Å; A824-Y836 PolarHBondContact O-N 3.16Å; Y836-C838 VanDerWaalsContact C-N 3.29Å; Y836-C838 PolarHBondContact O-N 3.03Å; Y836-C839 WeakPolarHBondContact O-CB 3.4Å; Y836-C839 PolarHBondContact O-N 3.2Å; Y836-R842 PolarHBondContact OH-NH2 3.17Å
837	F	84.3	Confident	80.1	Confident	190 Å²	190	73.3 Å²	73.3	83%	0.833	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-68	-23.7	175.6	-173.4	-98.9	0	0	0	114.4	H835 C839	H835-F837 PolarHBondContact O-N 3.4Å; F837-C839 VanDerWaalsContact C-N 3.32Å
838	C	82.8	Confident	78.7	Confident	19 Å²	19	74.8 Å²	74.8	13%	0.128	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-84.2	-8.8	175.7	-65.4	0	0	0	0	112.8	V815 V834 H835 Y836 K840	V815-C838 HydrophobicContact CB-CB 3.84Å; V815-C838 HydrophobicContact CG1-CB 4.05Å; V815-C838 HydrophobicContact CG2-CB 4.16Å; V834-C838 HydrophobicContact CB-CB 4.21Å; H835-C838 HydrophobicContact CB-CB 4.29Å; H835-C838 WeakPolarHBondContact O-CA 3.48Å; H835-C838 WeakPolarHBondContact O-CB 3.48Å; H835-C838 PolarHBondContact O-N 3.2Å; Y836-C838 VanDerWaalsContact C-N 3.29Å; Y836-C838 PolarHBondContact O-N 3.03Å; C838-K840 PolarHBondContact O-N 3.3Å
839	C	83.5	Confident	76.9	Confident	26 Å²	26	86.3 Å²	86.3	18%	0.176	44%	0.441	C	S	.	.			trans	-84.7	81.5	174.8	-176.8	0	0	0	0	109.6	A826 Y828 V834 H835 Y836 F837	A826-C839 HydrophobicContact CB-CB 3.92Å; Y828-C839 PolarHBondContact OH-SG 3.24Å; V834-C839 HydrophobicContact CG2-CB 3.93Å; H835-C839 PolarHBondContact O-N 3.02Å; Y836-C839 WeakPolarHBondContact O-CB 3.4Å; Y836-C839 PolarHBondContact O-N 3.2Å; F837-C839 VanDerWaalsContact C-N 3.32Å
840	K	76.8	Confident	76.7	Confident	206 Å²	206	84.2 Å²	84.2	90%	0.896	42%	0.421	S	S	*	.	S	Bend	trans	-73.8	-38.5	178.9	-68.4	-173.5	177.8	-177.9	0	112.8	C838	C838-K840 PolarHBondContact O-N 3.3Å
841	D	75.7	Confident	76.5	Confident	73 Å²	73	84.7 Å²	84.7	39%	0.39	42%	0.423	S	S	.	.			trans	-126.4	128.8	178.4	-170.3	-31.5	0	0	0	109.1	Y828 S843 V844	Y828-D841 WeakPolarHBondContact CE1-O 3.26Å; Y828-D841 PolarHBondContact OH-O 3.44Å; D841-S843 PolarHBondContact OD1-N 3.07Å; D841-S843 PolarHBondContact OD1-OG 3.04Å; D841-V844 HydrophobicContact CB-CB 4.4Å; D841-V844 PolarHBondContact OD1-N 3.02Å
842	R	76.2	Confident	76.3	Confident	195 Å²	195	87.8 Å²	87.8	74%	0.736	43%	0.429	S	S	*	.	S	Bend	trans	-79.6	-20.1	-178.2	-66.8	-178.8	177.8	-178.9	-1.2	112.8	Y836	Y836-R842 PolarHBondContact OH-NH2 3.17Å
843	S	72.3	Confident	75.7	Confident	106 Å²	106	91.9 Å²	91.9	74%	0.741	45%	0.448	S	S	*	.	S	Bend	trans	-92.7	-25.6	-180	32.5	0	0	0	0	113.9	D841	D841-S843 PolarHBondContact OD1-N 3.07Å; D841-S843 PolarHBondContact OD1-OG 3.04Å
844	V	73.2	Confident	74.9	Confident	80 Å²	80	97.3 Å²	97.3	49%	0.485	47%	0.473	S	S	.	.	S	Bend	trans	-116.7	122.5	-175.2	-175.2	0	0	0	0	110.6	Y828 D841 P846	Y828-V844 WeakPolarHBondContact CE1-O 3.29Å; Y828-V844 PolarHBondContact OH-O 2.95Å; D841-V844 HydrophobicContact CB-CB 4.4Å; D841-V844 PolarHBondContact OD1-N 3.02Å; V844-P846 WeakPolarHBondContact O-CD 3.45Å
845	C	72.9	Confident	73.9	Confident	6 Å²	6	103.7 Å²	103.7	4%	0.041	51%	0.505	C	S	.	.			trans	-73.3	124.9	177.6	-167.3	0	0	0	0	110.1	Y828 N830 T847 E848	Y828-C845 HydrophobicContact CD1-CB 4.08Å; Y828-C845 HydrophobicContact CD2-CB 4.45Å; Y828-C845 HydrophobicContact CE1-CB 4.46Å; Y828-C845 HydrophobicContact CG-CB 4.07Å; N830-C845 WeakPolarHBondContact ND2-CB 3.43Å; N830-C845 PolarHBondContact ND2-SG 2.92Å; C845-T847 PolarHBondContact O-N 3.31Å; C845-T847 PolarHBondContact SG-OG1 3.4Å; C845-E848 HydrophobicContact CB-CG 4.22Å; C845-E848 PolarHBondContact O-N 2.93Å
846	P	66.7	Low	72.8	Confident	58 Å²	58	109.5 Å²	109.5	38%	0.377	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	1	-176.2	26.9	-34.6	0	0	0	114.5	V815 Y828 V834 V844	V815-P846 HydrophobicContact CG2-CB 3.85Å; V815-P846 HydrophobicContact CG2-CG 3.45Å; V815-P846 VanDerWaalsContact CG2-CG 3.45Å; Y828-P846 VanDerWaalsContact CE2-CD 3.45Å; Y828-P846 HydrophobicContact CE2-CG 4.21Å; Y828-P846 VanDerWaalsContact CZ-CD 3.47Å; Y828-P846 WeakPolarHBondContact OH-CD 3.32Å; V834-P846 HydrophobicContact CG1-CG 4.34Å; V844-P846 WeakPolarHBondContact O-CD 3.45Å
847	T	64	Low	71.8	Confident	56 Å²	56	107.7 Å²	107.7	34%	0.344	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	4.6	172.5	43	0	0	0	0	114.1	R814 C845	R814-T847 HydrophobicContact CB-CG2 3.68Å; R814-T847 HydrophobicContact CG-CG2 4.49Å; C845-T847 PolarHBondContact O-N 3.31Å; C845-T847 PolarHBondContact SG-OG1 3.4Å
848	E	57.8	Low	70.7	Confident	133 Å²	133	100.8 Å²	100.8	62%	0.621	51%	0.509	S	S	*	.			trans	-102	28.9	176.5	-74	177.8	-173.6	0	0	112.8	N830 C845	N830-E848 PolarHBondContact ND2-OE1 3.23Å; C845-E848 HydrophobicContact CB-CG 4.22Å; C845-E848 PolarHBondContact O-N 2.93Å
849	Q	46.8	Very low	69.6	Low	252 Å²	252	108.3 Å²	108.3	100%	1.178	54%	0.544	S	S	*	.			trans	-102.6	0	162.6	-79.1	-172.9	-8.2	0	0	110.8

Retrieved 849 of 849 residues in 1092 ms (Link to these results)

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