A0A060WKW5_ONCMY Loading...

Angel homolog 1 (Drosophila)

AlphaFold DB , UniProt , Accession A0A060WKW5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 803 aa.

						>A0A060WKW5_ONCMY|A0A060WKW5
MIGSAQSLERSMIGSLIFYGLYPLTRLINCVTEPLKKGPSVSINDNKVWDGEVPSKIFTKTQAGLLDPWLSTSSGPPKAKKDPGRVTGEWLKENGALEKEKSKEAEMKKSTVKEVMGSEPEKDRKEPVFVTLGGRLLDGVKEEEPEVRDDVEEDGVREEGPKQQDQEQTILYSEKLMRDDGVQEAPCSPTEKSENSNPAPELTTETSEVQNPSVKDSRTTDDKAIVHVLLEQIVEKMSMGESVTKAQVQKPEWESQTAAGLDLSSFVDPHASTSEVPAEIWDPGLDLVSLLCEAEAQTQPWESRAQPPPKGWHFPIGPGLKEVLFCPSTAFPSMSYYPHSLERETFQVVWRVWEELSETHTAPEPLQRPPSEPRPLFDFTVMSYNILAQDLLEANQELYTHCPLGVLSWDYRFPNLTQEFKKWEPDILCLQEVQENHFTEQLHPVLRDMGYTCVYKRRTGTKTDGCVICYRGDRFSQVSESLLEFYRPECELLDRDNVGIVLLLQPIITQGSEVTAKGPPLCVATTHLLFNTRRGDVKLTQLAMLLAEIDYIVRNCKVKGEHCNVVLCGDFNALPNMPLYQLITTRQLYYHGLPAWMISGQEDLSYNVHHRRVFAPLWPSTVGIDDNCQYTTVNEPKSQITSTQSPERNLQYNHGFLRRLRFCEAACIRPQDLELIPGVTDNTPDPEDKHPYTTRFRQTISHYLNLRSAYGHFIPGTDRAEVTTLHSEVGATVDYIFYSPRRGISGAYQKGGGQRQSQGLKLLGRLSLLPEEDLWSMNGLPNEMFPSDHLSLLAKFQLDLNPV
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41	Very low	34.1	Very low	231 Å²	231	123.4 Å²	123.4	100%	1.138	68%	0.684	S	S	*	*				0	95.7	0	-56.4	171.5	-164.4	0	0	108
2	I	30.3	Very low	34.2	Very low	143 Å²	143	124.3 Å²	124.3	73%	0.733	68%	0.683	S	S	*	*			trans	-141.5	-47.1	176.6	-56.4	-174.7	0	0	0	111	S4 A5	I2-S4 PolarHBondContact O-N 3.49Å; I2-A5 PolarHBondContact O-N 3.49Å
3	G	28.1	Very low	34.4	Very low	71 Å²	71	122.7 Å²	122.7	73%	0.732	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-8.9	-177.5	0	0	0	0	0	116.8
4	S	33.4	Very low	34.4	Very low	81 Å²	81	116.9 Å²	116.9	57%	0.566	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-19.5	178.1	53.1	0	0	0	0	114.2	I2 L8	I2-S4 PolarHBondContact O-N 3.49Å; S4-L8 VanDerWaalsContact O-CD1 3.3Å; S4-L8 WeakPolarHBondContact O-CD1 3.29Å
5	A	30.6	Very low	34.9	Very low	63 Å²	63	113.1 Å²	113.1	52%	0.521	64%	0.638	S	S	.	*	H	α-helix	trans	-75.2	-50	-176.4	0	0	0	0	0	112.3	I2 S7 L8	I2-A5 PolarHBondContact O-N 3.49Å; A5-S7 PolarHBondContact O-N 3.08Å; A5-L8 PolarHBondContact O-N 3.01Å
6	Q	31.9	Very low	35	Very low	143 Å²	143	114.1 Å²	114.1	67%	0.668	64%	0.64	S	S	*	*	H	α-helix	trans	-68.9	-7.9	-174.3	-67.9	179.7	-25.1	0	0	114.6
7	S	34.9	Very low	35.2	Very low	81 Å²	81	113.1 Å²	113.1	57%	0.566	63%	0.632	S	S	*	*	H	α-helix	trans	-84.6	-32.8	175.8	-173.1	0	0	0	0	112.8	A5 S11	A5-S7 PolarHBondContact O-N 3.08Å; S7-S11 PolarHBondContact O-N 3.25Å
8	L	35.1	Very low	35.5	Very low	121 Å²	121	114.5 Å²	114.5	63%	0.634	63%	0.63	S	S	*	*	H	α-helix	trans	-71	-43.3	-179	-86.1	88.9	0	0	0	112.6	S4 A5 R10 S11 M12	S4-L8 VanDerWaalsContact O-CD1 3.3Å; S4-L8 WeakPolarHBondContact O-CD1 3.29Å; A5-L8 PolarHBondContact O-N 3.01Å; L8-R10 VanDerWaalsContact C-N 3.31Å; L8-R10 PolarHBondContact O-N 3.23Å; L8-S11 WeakPolarHBondContact O-CB 3.18Å; L8-S11 PolarHBondContact O-N 3.32Å; L8-S11 VanDerWaalsContact O-N 3.09Å; L8-M12 PolarHBondContact O-N 3.11Å; L8-M12 VanDerWaalsContact O-N 3.14Å
9	E	32.7	Very low	35.9	Very low	137 Å²	137	118.4 Å²	118.4	64%	0.64	64%	0.636	S	S	*	*	H	α-helix	trans	-60.4	-41.1	-179.1	-66.5	-178.8	121.5	0	0	112	S11 I13	E9-S11 VanDerWaalsContact C-N 3.31Å; E9-S11 PolarHBondContact O-N 3.09Å; E9-I13 WeakPolarHBondContact O-CG1 3.22Å; E9-I13 PolarHBondContact O-N 3.46Å
10	R	35.3	Very low	36	Very low	209 Å²	209	114.9 Å²	114.9	79%	0.789	63%	0.629	S	S	*	*	H	α-helix	trans	-68.4	-29.6	176.8	-67.6	-173.7	175.7	-159.1	-2.2	112.9	L8 G14	L8-R10 VanDerWaalsContact C-N 3.31Å; L8-R10 PolarHBondContact O-N 3.23Å; R10-G14 PolarHBondContact O-N 3.44Å
11	S	41.6	Very low	36.1	Very low	77 Å²	77	113.5 Å²	113.5	54%	0.538	62%	0.621	S	S	.	*	H	α-helix	trans	-69.2	-47.7	176.6	-171.8	0	0	0	0	111.8	S7 L8 E9 I13 G14 S15	S7-S11 PolarHBondContact O-N 3.25Å; L8-S11 WeakPolarHBondContact O-CB 3.18Å; L8-S11 PolarHBondContact O-N 3.32Å; L8-S11 VanDerWaalsContact O-N 3.09Å; E9-S11 VanDerWaalsContact C-N 3.31Å; E9-S11 PolarHBondContact O-N 3.09Å; S11-I13 VanDerWaalsContact C-N 3.34Å; S11-I13 PolarHBondContact O-N 3.2Å; S11-G14 PolarHBondContact O-N 3.2Å; S11-S15 PolarHBondContact O-N 3.18Å; S11-S15 PolarHBondContact O-OG 2.67Å
12	M	35.2	Very low	36.1	Very low	135 Å²	135	110.4 Å²	110.4	67%	0.665	60%	0.597	S	S	*	*	H	α-helix	trans	-62	-39.1	-179.9	-70.1	-170.1	70.4	0	0	113.1	L8 S15 L16	L8-M12 PolarHBondContact O-N 3.11Å; L8-M12 VanDerWaalsContact O-N 3.14Å; M12-S15 PolarHBondContact O-N 3.15Å; M12-L16 PolarHBondContact O-N 2.81Å; M12-L16 VanDerWaalsContact O-N 3.14Å
13	I	37.3	Very low	36.7	Very low	103 Å²	103	107.4 Å²	107.4	53%	0.528	59%	0.587	S	S	.	*	H	α-helix	trans	-63.7	-42.3	177.9	-66.5	167.9	0	0	0	110.8	E9 S11 S15 L16 I17	E9-I13 WeakPolarHBondContact O-CG1 3.22Å; E9-I13 PolarHBondContact O-N 3.46Å; S11-I13 VanDerWaalsContact C-N 3.34Å; S11-I13 PolarHBondContact O-N 3.2Å; I13-S15 PolarHBondContact O-N 2.72Å; I13-L16 PolarHBondContact O-N 2.96Å; I13-I17 HydrophobicContact CG2-CD1 3.85Å; I13-I17 WeakPolarHBondContact O-CG1 3.04Å; I13-I17 PolarHBondContact O-N 3.11Å; I13-I17 VanDerWaalsContact O-N 3.12Å
14	G	34.7	Very low	37.2	Very low	41 Å²	41	108.4 Å²	108.4	42%	0.423	58%	0.575	S	S	.	*	H	α-helix	trans	-61.3	-42.3	176.8	0	0	0	0	0	113.3	R10 S11 I17 F18	R10-G14 PolarHBondContact O-N 3.44Å; S11-G14 PolarHBondContact O-N 3.2Å; G14-I17 PolarHBondContact O-N 3.46Å; G14-F18 PolarHBondContact O-N 3.26Å; G14-F18 VanDerWaalsContact O-N 3.13Å
15	S	41.1	Very low	37.7	Very low	61 Å²	61	108.2 Å²	108.2	43%	0.427	57%	0.571	S	S	.	*	H	α-helix	trans	-65	-43.3	177.4	-57.5	0	0	0	0	112.8	S11 M12 I13 I17 F18 Y19	S11-S15 PolarHBondContact O-N 3.18Å; S11-S15 PolarHBondContact O-OG 2.67Å; M12-S15 PolarHBondContact O-N 3.15Å; I13-S15 PolarHBondContact O-N 2.72Å; S15-I17 VanDerWaalsContact C-N 3.33Å; S15-I17 PolarHBondContact O-N 3.41Å; S15-F18 PolarHBondContact O-N 3.16Å; S15-Y19 WeakPolarHBondContact O-CD2 3.29Å; S15-Y19 PolarHBondContact O-N 3.18Å; S15-Y19 VanDerWaalsContact O-N 3.11Å
16	L	36.8	Very low	38.2	Very low	129 Å²	129	114.3 Å²	114.3	68%	0.675	58%	0.58	S	S	*	*	H	α-helix	trans	-62.2	-39.5	177.5	-81.2	163.2	0	0	0	112.2	M12 I13 G20	M12-L16 PolarHBondContact O-N 2.81Å; M12-L16 VanDerWaalsContact O-N 3.14Å; I13-L16 PolarHBondContact O-N 2.96Å; L16-G20 PolarHBondContact O-N 3.23Å
17	I	38.2	Very low	38.6	Very low	97 Å²	97	113.5 Å²	113.5	50%	0.497	58%	0.58	S	S	.	*	H	α-helix	trans	-63.7	-41.5	175.4	-69.4	167.9	0	0	0	111.1	I13 G14 S15 G20 L21	I13-I17 HydrophobicContact CG2-CD1 3.85Å; I13-I17 WeakPolarHBondContact O-CG1 3.04Å; I13-I17 PolarHBondContact O-N 3.11Å; I13-I17 VanDerWaalsContact O-N 3.12Å; G14-I17 PolarHBondContact O-N 3.46Å; S15-I17 VanDerWaalsContact C-N 3.33Å; S15-I17 PolarHBondContact O-N 3.41Å; I17-G20 PolarHBondContact O-N 3.27Å; I17-L21 HydrophobicContact CG2-CD1 3.66Å; I17-L21 HydrophobicContact CG2-CG 4.36Å; I17-L21 WeakPolarHBondContact O-CB 3.37Å; I17-L21 WeakPolarHBondContact O-CG 3.49Å; I17-L21 PolarHBondContact O-N 3.12Å
18	F	41.5	Very low	38.8	Very low	138 Å²	138	115.2 Å²	115.2	61%	0.605	58%	0.581	S	S	*	*	H	α-helix	trans	-66.2	-47	-179.7	-164.9	-95.1	0	0	0	112.6	G14 S15 G20 L21 Y22	G14-F18 PolarHBondContact O-N 3.26Å; G14-F18 VanDerWaalsContact O-N 3.13Å; S15-F18 PolarHBondContact O-N 3.16Å; F18-G20 VanDerWaalsContact C-N 3.29Å; F18-G20 PolarHBondContact O-N 2.87Å; F18-L21 PolarHBondContact O-N 2.8Å; F18-Y22 HydrophobicContact CE1-CD2 4.44Å; F18-Y22 PolarHBondContact O-N 3.39Å; F18-Y22 VanDerWaalsContact O-N 3.12Å
19	Y	41.8	Very low	38.8	Very low	188 Å²	188	114.7 Å²	114.7	74%	0.737	58%	0.58	S	S	*	*	H	α-helix	trans	-67.5	-27.5	177.1	-71.1	-64.5	0	0	0	113.2	S15	S15-Y19 WeakPolarHBondContact O-CD2 3.29Å; S15-Y19 PolarHBondContact O-N 3.18Å; S15-Y19 VanDerWaalsContact O-N 3.11Å
20	G	38.7	Very low	38.9	Very low	48 Å²	48	113.1 Å²	113.1	50%	0.495	58%	0.582	S	S	.	*	H	α-helix	trans	-76	-31.5	173.8	0	0	0	0	0	114.8	L16 I17 F18	L16-G20 PolarHBondContact O-N 3.23Å; I17-G20 PolarHBondContact O-N 3.27Å; F18-G20 VanDerWaalsContact C-N 3.29Å; F18-G20 PolarHBondContact O-N 2.87Å
21	L	39.1	Very low	39.1	Very low	87 Å²	87	109 Å²	109	46%	0.455	58%	0.58	S	S	.	*	H	α-helix	trans	-96.3	-18.7	-174.6	-68.1	179.1	0	0	0	115	I17 F18 P23 L24 T25	I17-L21 HydrophobicContact CG2-CD1 3.66Å; I17-L21 HydrophobicContact CG2-CG 4.36Å; I17-L21 WeakPolarHBondContact O-CB 3.37Å; I17-L21 WeakPolarHBondContact O-CG 3.49Å; I17-L21 PolarHBondContact O-N 3.12Å; F18-L21 PolarHBondContact O-N 2.8Å; L21-P23 VanDerWaalsContact C-CD 3.45Å; L21-P23 VanDerWaalsContact C-N 3.32Å; L21-L24 HydrophobicContact CD2-CB 4.48Å; L21-L24 HydrophobicContact CD2-CD2 4.03Å; L21-L24 WeakPolarHBondContact O-CB 3.44Å; L21-L24 PolarHBondContact O-N 3.33Å; L21-T25 PolarHBondContact O-N 3.26Å; L21-T25 VanDerWaalsContact O-N 3.13Å
22	Y	40.5	Very low	38.8	Very low	165 Å²	165	110.4 Å²	110.4	65%	0.647	59%	0.585	S	S	*	*	H	α-helix	trans	-56.3	-33.6	177.4	-169.1	-98	0	0	0	114.6	F18 T25	F18-Y22 HydrophobicContact CE1-CD2 4.44Å; F18-Y22 PolarHBondContact O-N 3.39Å; F18-Y22 VanDerWaalsContact O-N 3.12Å; Y22-T25 PolarHBondContact O-OG1 3Å; Y22-T25 VanDerWaalsContact O-OG1 3.13Å
23	P	42.7	Very low	38.5	Very low	81 Å²	81	112.3 Å²	112.3	53%	0.526	59%	0.593	S	S	.	*	H	α-helix	trans	-70.7	-36.3	169.9	-19.7	33.9	0	0	0	113.4	L21 R26 L27	L21-P23 VanDerWaalsContact C-CD 3.45Å; L21-P23 VanDerWaalsContact C-N 3.32Å; P23-R26 PolarHBondContact O-N 3.23Å; P23-L27 PolarHBondContact O-N 3.21Å; P23-L27 VanDerWaalsContact O-N 3.11Å
24	L	37.1	Very low	38.3	Very low	92 Å²	92	113 Å²	113	48%	0.482	60%	0.604	S	S	.	*	H	α-helix	trans	-66.4	-39.4	-176.9	-112.6	74.8	0	0	0	112.3	L21 R26 L27 I28	L21-L24 HydrophobicContact CD2-CB 4.48Å; L21-L24 HydrophobicContact CD2-CD2 4.03Å; L21-L24 WeakPolarHBondContact O-CB 3.44Å; L21-L24 PolarHBondContact O-N 3.33Å; L24-R26 PolarHBondContact O-N 3.35Å; L24-L27 PolarHBondContact O-N 3.05Å; L24-L27 VanDerWaalsContact O-N 3.09Å; L24-I28 WeakPolarHBondContact O-CG1 3.46Å; L24-I28 PolarHBondContact O-N 2.86Å
25	T	44.7	Very low	38	Very low	76 Å²	76	118.5 Å²	118.5	47%	0.466	62%	0.623	S	S	.	*	H	α-helix	trans	-66.1	-20.9	177.7	49.5	0	0	0	0	113	L21 Y22 N29	L21-T25 PolarHBondContact O-N 3.26Å; L21-T25 VanDerWaalsContact O-N 3.13Å; Y22-T25 PolarHBondContact O-OG1 3Å; Y22-T25 VanDerWaalsContact O-OG1 3.13Å; T25-N29 PolarHBondContact O-ND2 2.9Å
26	R	41.7	Very low	37.6	Very low	191 Å²	191	125.3 Å²	125.3	72%	0.721	65%	0.645	S	S	*	*	H	α-helix	trans	-85.4	-33.6	167.3	-118.3	-173.9	178.9	-158.3	-1.8	113.2	P23 L24 I28 N29 C30	P23-R26 PolarHBondContact O-N 3.23Å; L24-R26 PolarHBondContact O-N 3.35Å; R26-I28 VanDerWaalsContact C-N 3.32Å; R26-I28 PolarHBondContact O-N 3.18Å; R26-N29 PolarHBondContact O-N 3.39Å; R26-C30 PolarHBondContact O-N 3.29Å; R26-C30 VanDerWaalsContact O-N 3.1Å; R26-C30 PolarHBondContact O-SG 2.96Å; R26-C30 VanDerWaalsContact O-SG 3.33Å
27	L	39.1	Very low	37.2	Very low	126 Å²	126	128.2 Å²	128.2	66%	0.66	65%	0.652	S	S	*	*	H	α-helix	trans	-60.7	-41.7	175.5	-148	83.6	0	0	0	112	P23 L24 C30	P23-L27 PolarHBondContact O-N 3.21Å; P23-L27 VanDerWaalsContact O-N 3.11Å; L24-L27 PolarHBondContact O-N 3.05Å; L24-L27 VanDerWaalsContact O-N 3.09Å; L27-C30 PolarHBondContact O-N 3.12Å
28	I	40.8	Very low	37.1	Very low	117 Å²	117	126.5 Å²	126.5	60%	0.6	66%	0.658	S	S	*	*	H	α-helix	trans	-63.4	-43.6	177	-67.2	166.6	0	0	0	111.2	L24 R26 C30 V31	L24-I28 WeakPolarHBondContact O-CG1 3.46Å; L24-I28 PolarHBondContact O-N 2.86Å; R26-I28 VanDerWaalsContact C-N 3.32Å; R26-I28 PolarHBondContact O-N 3.18Å; I28-C30 VanDerWaalsContact C-N 3.27Å; I28-C30 PolarHBondContact O-N 3.1Å; I28-V31 PolarHBondContact O-N 2.74Å
29	N	35	Very low	36.5	Very low	111 Å²	111	126 Å²	126	59%	0.594	67%	0.669	S	S	*	*	H	α-helix	trans	-70.5	-18.1	178.7	-76.5	-51.6	0	0	0	113.8	T25 R26 V31 T32	T25-N29 PolarHBondContact O-ND2 2.9Å; R26-N29 PolarHBondContact O-N 3.39Å; N29-V31 VanDerWaalsContact C-N 3.29Å; N29-V31 PolarHBondContact O-N 2.77Å; N29-T32 PolarHBondContact O-OG1 2.86Å
30	C	34.6	Very low	35.8	Very low	103 Å²	103	122.8 Å²	122.8	70%	0.696	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-7.5	173.3	-71.2	0	0	0	0	114.1	R26 L27 I28	R26-C30 PolarHBondContact O-N 3.29Å; R26-C30 VanDerWaalsContact O-N 3.1Å; R26-C30 PolarHBondContact O-SG 2.96Å; R26-C30 VanDerWaalsContact O-SG 3.33Å; L27-C30 PolarHBondContact O-N 3.12Å; I28-C30 VanDerWaalsContact C-N 3.27Å; I28-C30 PolarHBondContact O-N 3.1Å
31	V	38	Very low	35.3	Very low	124 Å²	124	126.8 Å²	126.8	75%	0.752	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-10.6	177.8	-179.5	0	0	0	0	111.9	I28 N29	I28-V31 PolarHBondContact O-N 2.74Å; N29-V31 VanDerWaalsContact C-N 3.29Å; N29-V31 PolarHBondContact O-N 2.77Å
32	T	36	Very low	34.9	Very low	105 Å²	105	127.9 Å²	127.9	64%	0.644	70%	0.703	S	S	*	*			trans	-114.3	41.7	-170.7	54.4	0	0	0	0	114.9	N29	N29-T32 PolarHBondContact O-OG1 2.86Å
33	E	29.8	Very low	34.3	Very low	176 Å²	176	126.9 Å²	126.9	82%	0.822	71%	0.708	S	S	*	*	S	Bend	trans	-119.1	128.1	156.9	-76.7	-149.8	140.5	0	0	111.3	L35	E33-L35 PolarHBondContact O-N 2.84Å
34	P	32.1	Very low	33.7	Very low	116 Å²	116	130 Å²	130	75%	0.753	72%	0.72	S	S	*	*			trans	-75.8	111.3	178.2	29.6	-32.9	0	0	0	111	K36	P34-K36 PolarHBondContact O-N 2.78Å
35	L	29.4	Very low	33.8	Very low	157 Å²	157	133.2 Å²	133.2	82%	0.822	74%	0.738	S	S	*	*			trans	-53	100.5	177.5	-171.8	79.6	0	0	0	112.1	E33 K37	E33-L35 PolarHBondContact O-N 2.84Å; L35-K37 PolarHBondContact O-N 3.05Å
36	K	31.5	Very low	33.1	Very low	205 Å²	205	137 Å²	137	89%	0.891	76%	0.755	S	S	*	*			trans	-67.8	93.2	175.8	-76.4	-179.2	179	171	0	110.6	P34 G38	P34-K36 PolarHBondContact O-N 2.78Å; K36-G38 PolarHBondContact O-N 2.93Å
37	K	29.3	Very low	32.5	Very low	190 Å²	190	137.6 Å²	137.6	83%	0.826	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-61.1	117.5	170.3	-70.4	178.9	177.4	175.7	0	110.2	L35	L35-K37 PolarHBondContact O-N 3.05Å
38	G	35.1	Very low	32	Very low	61 Å²	61	137.4 Å²	137.4	63%	0.629	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-65.7	159.8	161.2	0	0	0	0	0	111.4	K36	K36-G38 PolarHBondContact O-N 2.93Å
39	P	29.9	Very low	31.2	Very low	127 Å²	127	143.3 Å²	143.3	83%	0.825	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-67.4	137.9	-179.6	28.5	-34.6	0	0	0	111.5
40	S	26.9	Very low	30.8	Very low	121 Å²	121	145.7 Å²	145.7	85%	0.846	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-76.5	124.9	175.8	53.5	0	0	0	0	111.5
41	V	28.6	Very low	30.3	Very low	131 Å²	131	144 Å²	144	79%	0.794	80%	0.795	S	S	*	*			trans	-111.7	121.3	165.1	178.7	0	0	0	0	108.6
42	S	29.4	Very low	29.6	Very low	111 Å²	111	147 Å²	147	78%	0.776	80%	0.8	S	S	*	*			trans	-105.2	127.9	178.6	52.4	0	0	0	0	110.8
43	I	29	Very low	29.5	Very low	144 Å²	144	148.5 Å²	148.5	74%	0.738	81%	0.809	S	S	*	*			trans	-134.5	127.1	167.2	-60.3	-178.6	0	0	0	108.1
44	N	30.2	Very low	29.4	Very low	147 Å²	147	145.7 Å²	145.7	79%	0.786	81%	0.806	S	S	*	*	S	Bend	trans	57.8	95.5	177.6	-63.2	-6.1	0	0	0	115.9	N46	N44-N46 PolarHBondContact O-N 2.83Å
45	D	38.1	Very low	29	Very low	159 Å²	159	145 Å²	145	85%	0.85	80%	0.804	S	S	*	*			trans	-52.2	102.3	178.2	-60.6	-82	0	0	0	114.5
46	N	31.5	Very low	28.8	Very low	156 Å²	156	146 Å²	146	83%	0.834	80%	0.802	S	S	*	*			trans	-156.9	136	152	-101.3	-45.5	0	0	0	111.1	N44	N44-N46 PolarHBondContact O-N 2.83Å
47	K	29.2	Very low	28.4	Very low	202 Å²	202	143.4 Å²	143.4	88%	0.878	80%	0.796	S	S	*	*			trans	-101.5	125.7	165.5	-77	-178.4	176.8	177.7	0	108.5
48	V	27.6	Very low	28.3	Very low	123 Å²	123	144 Å²	144	75%	0.745	80%	0.799	S	S	*	*			trans	-129.8	129.7	163.3	-178.6	0	0	0	0	107.5
49	W	24.9	Very low	27.8	Very low	241 Å²	241	147.8 Å²	147.8	91%	0.913	81%	0.81	S	S	*	*			trans	-97.9	134.5	160.9	-87.2	72.2	0	0	0	107
50	D	25.1	Very low	27.7	Very low	161 Å²	161	151.3 Å²	151.3	86%	0.861	81%	0.812	S	S	*	*			trans	-167.2	152.7	149.2	-90.1	-35.7	0	0	0	108.2
51	G	24.8	Very low	27.7	Very low	68 Å²	68	151.8 Å²	151.8	70%	0.701	81%	0.81	S	S	*	*			cis	153.7	-3.7	-4.4	0	0	0	0	0	116.7
52	E	22.9	Very low	27.6	Very low	185 Å²	185	153.7 Å²	153.7	86%	0.864	81%	0.81	S	S	*	*			trans	-153	161.3	-174.2	-131.6	172.7	-146	0	0	116.2
53	V	33.2	Very low	27.5	Very low	138 Å²	138	153.1 Å²	153.1	84%	0.836	81%	0.812	S	S	*	*			trans	-124.2	125	172.5	174.4	0	0	0	0	108.8
54	P	29.7	Very low	27.4	Very low	117 Å²	117	149.8 Å²	149.8	76%	0.76	81%	0.814	S	S	*	*			trans	-124.7	133	157.2	33.6	-21.5	0	0	0	112.6
55	S	23.6	Very low	27.1	Very low	100 Å²	100	150.7 Å²	150.7	70%	0.699	82%	0.817	S	S	*	*			trans	-87.4	141.6	167.7	56.6	0	0	0	0	110.8
56	K	23.7	Very low	26.5	Very low	180 Å²	180	151 Å²	151	78%	0.783	82%	0.818	S	S	*	*				162.9	147.1	123.1	-94.2	172.1	177.3	176.5	0	117.2
57	I	22.8	Very low	26.2	Very low	149 Å²	149	150.4 Å²	150.4	76%	0.764	82%	0.815	S	S	*	*			trans	77.7	135.4	141.8	-71.4	164.6	0	0	0	119.6
58	F	27.2	Very low	27	Very low	202 Å²	202	145.2 Å²	145.2	89%	0.886	80%	0.802	S	S	*	*			trans	-79.5	151.7	170.3	-83.8	-105.7	0	0	0	112.9
59	T	25.2	Very low	26.9	Very low	141 Å²	141	150.8 Å²	150.8	87%	0.865	81%	0.81	S	S	*	*			trans	-130.1	150.7	148.9	45.1	0	0	0	0	110.4
60	K	28.5	Very low	27	Very low	202 Å²	202	146.6 Å²	146.6	88%	0.878	81%	0.805	S	S	*	*			trans	-86	147	-177.7	-71.5	178.2	173.3	-180	0	112.2
61	T	26	Very low	27	Very low	131 Å²	131	143.6 Å²	143.6	80%	0.804	80%	0.796	S	S	*	*			trans	-146.3	161.2	138.3	-2.1	0	0	0	0	110.8
62	Q	27.3	Very low	27	Very low	170 Å²	170	146.2 Å²	146.2	79%	0.794	80%	0.799	S	S	*	*			trans	-63.6	155.1	-170.6	-63.6	116.8	-60.9	0	0	113.8
63	A	26.3	Very low	27.1	Very low	99 Å²	99	142.6 Å²	142.6	82%	0.818	79%	0.794	S	S	*	*			cis	81.1	130.7	29.1	0	0	0	0	0	115.3
64	G	26.5	Very low	26.9	Very low	74 Å²	74	141.9 Å²	141.9	76%	0.763	80%	0.795	S	S	*	*			trans	105.9	102.6	-163.4	0	0	0	0	0	109.6
65	L	24.6	Very low	26.6	Very low	166 Å²	166	139.7 Å²	139.7	87%	0.869	79%	0.794	S	S	*	*			cis	68	99.2	37.8	-148.9	-176	0	0	0	111.4
66	L	25.2	Very low	27.2	Very low	165 Å²	165	140.3 Å²	140.3	86%	0.864	80%	0.796	S	S	*	*			trans	-166.5	124.7	155.8	-115.4	171.4	0	0	0	112.5
67	D	25.5	Very low	27.5	Very low	144 Å²	144	138 Å²	138	77%	0.77	80%	0.799	S	S	*	*			trans	-159.4	160.4	156.4	-131.2	-9.7	0	0	0	104.7
68	P	46.1	Very low	27.6	Very low	94 Å²	94	140.8 Å²	140.8	61%	0.61	81%	0.805	S	S	*	*			cis	-121.1	-167.7	-13	40.9	-26.9	0	0	0	111.7
69	W	25.6	Very low	27.7	Very low	239 Å²	239	135.7 Å²	135.7	91%	0.905	80%	0.801	S	S	*	*				179.3	167.7	121.9	-108	74.8	0	0	0	112.5
70	L	26.7	Very low	27.8	Very low	154 Å²	154	138.7 Å²	138.7	81%	0.806	80%	0.802	S	S	*	*			trans	-108.3	167.6	-167.8	-77	164	0	0	0	115.1
71	S	25.5	Very low	27.8	Very low	98 Å²	98	137.1 Å²	137.1	69%	0.685	80%	0.795	S	S	*	*			trans	89.3	124.3	144.7	75.2	0	0	0	0	122.7
72	T	25.6	Very low	28	Very low	123 Å²	123	136.9 Å²	136.9	76%	0.755	79%	0.789	S	S	*	*			trans	66.8	106.9	136.8	50.3	0	0	0	0	123.4
73	S	24.8	Very low	29.1	Very low	108 Å²	108	135 Å²	135	76%	0.755	79%	0.792	S	S	*	*				99.5	159.6	119	83.3	0	0	0	0	121.1
74	S	27.7	Very low	29.1	Very low	124 Å²	124	134 Å²	134	87%	0.867	79%	0.79	S	S	*	*			trans	72.5	140.9	178.4	79.9	0	0	0	0	118.3
75	G	25.1	Very low	29.2	Very low	71 Å²	71	141.6 Å²	141.6	73%	0.732	80%	0.796	S	S	*	*			trans	-155	-152.4	167.8	0	0	0	0	0	106.9
76	P	34.7	Very low	29.5	Very low	113 Å²	113	139.5 Å²	139.5	73%	0.734	79%	0.789	S	S	*	*			cis	-127.3	164.4	-18.2	40.3	-27.3	0	0	0	113
77	P	30.3	Very low	29.8	Very low	132 Å²	132	138 Å²	138	86%	0.857	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-81.4	136.8	168.5	-6.7	24.9	0	0	0	112.2
78	K	25.9	Very low	30	Very low	206 Å²	206	134.2 Å²	134.2	90%	0.896	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-88.4	141.8	175.8	-70.7	170.9	-179.8	166.6	0	111.6
79	A	29.5	Very low	29.3	Very low	95 Å²	95	139 Å²	139	79%	0.785	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-80.9	151.3	-178.2	0	0	0	0	0	114.7
80	K	26.2	Very low	29.4	Very low	204 Å²	204	139.2 Å²	139.2	89%	0.887	80%	0.798	S	S	*	*			trans	173.3	148.3	154.2	-97.8	159.1	-177.4	-178.1	0	110
81	K	27.9	Very low	29.7	Very low	170 Å²	170	139.1 Å²	139.1	74%	0.739	80%	0.797	S	S	*	*			cis	-173.4	130.5	-31.8	-135.2	-159.8	173	-145.2	0	110.6
82	D	31	Very low	30	Very low	126 Å²	126	143 Å²	143	67%	0.674	80%	0.802	S	S	*	*			trans	59.7	171.1	149.9	-68	-31.3	0	0	0	118.2
83	P	50.6	Low	30.1	Very low	131 Å²	131	144.3 Å²	144.3	85%	0.851	80%	0.799	S	S	*	*			cis	-138.6	158.5	10.3	40.9	-22.4	0	0	0	119.7
84	G	26.9	Very low	30.4	Very low	76 Å²	76	146.2 Å²	146.2	78%	0.784	80%	0.801	S	S	*	*			trans	118.7	151.4	145.7	0	0	0	0	0	117.5
85	R	27.4	Very low	30.4	Very low	234 Å²	234	144 Å²	144	88%	0.883	80%	0.797	S	S	*	*			cis	-169.3	117.8	-6.7	-178.2	-178.7	-172.3	-128.2	2.3	112.8
86	V	31.8	Very low	30.5	Very low	122 Å²	122	145 Å²	145	74%	0.739	80%	0.799	S	S	*	*			trans	67.2	141.3	153.2	173.1	0	0	0	0	116.8
87	T	31.2	Very low	30.2	Very low	133 Å²	133	146.5 Å²	146.5	82%	0.816	80%	0.8	S	S	*	*			cis	-143	172.4	3.3	1.1	0	0	0	0	108.7
88	G	30.4	Very low	30.2	Very low	65 Å²	65	148 Å²	148	67%	0.67	80%	0.796	S	S	*	*			cis	121.3	97.6	-6.2	0	0	0	0	0	115.4
89	E	29.9	Very low	30.2	Very low	196 Å²	196	147.1 Å²	147.1	92%	0.916	79%	0.792	S	S	*	*			trans	-138.1	177.8	168.1	-124.2	176	-160.7	0	0	112.2
90	W	27.5	Very low	30.4	Very low	243 Å²	243	151.3 Å²	151.3	92%	0.92	80%	0.795	S	S	*	*			trans	-113.7	165.4	-144.3	-98.1	47.8	0	0	0	119.4
91	L	32.9	Very low	30.5	Very low	152 Å²	152	151.8 Å²	151.8	80%	0.796	80%	0.797	S	S	*	*			trans	-90.3	152.8	-179.1	-63.1	88.2	0	0	0	114.9
92	K	31.6	Very low	30.7	Very low	179 Å²	179	149 Å²	149	78%	0.778	80%	0.799	S	S	*	*				177.8	167.2	125	-96.7	166.2	-179.1	-171.3	0	110.2
93	E	28	Very low	30.5	Very low	151 Å²	151	152 Å²	152	71%	0.706	81%	0.806	S	S	*	*			cis	-148.9	177.9	20.8	-156.9	139.5	-126.2	0	0	114.7
94	N	31.3	Very low	29.4	Very low	148 Å²	148	154.2 Å²	154.2	79%	0.791	81%	0.805	S	S	*	*			trans	-57.5	167.6	179.4	-32.8	-65.9	0	0	0	113.7
95	G	27.3	Very low	29.6	Very low	77 Å²	77	154.8 Å²	154.8	79%	0.794	80%	0.802	S	S	*	*			cis	177.1	-154.1	10	0	0	0	0	0	108.4
96	A	28.3	Very low	29.6	Very low	92 Å²	92	151.8 Å²	151.8	76%	0.76	80%	0.798	S	S	*	*			cis	-170.2	160	-10.7	0	0	0	0	0	111.4
97	L	28	Very low	29.3	Very low	145 Å²	145	152.8 Å²	152.8	76%	0.759	80%	0.797	S	S	*	*			trans	64.4	118.2	163.5	-88.4	79.8	0	0	0	123.6
98	E	29.8	Very low	29.2	Very low	164 Å²	164	155.5 Å²	155.5	77%	0.766	80%	0.797	S	S	*	*			trans	0	141.8	131.9	-55.9	174	170	0	0	121.6
99	K	27.4	Very low	29.2	Very low	187 Å²	187	161.8 Å²	161.8	81%	0.813	81%	0.806	S	S	*	*				-170.1	136.8	106.9	-106.6	157.5	-173.3	154.9	0	115.7
100	E	32.4	Very low	29.4	Very low	183 Å²	183	157.1 Å²	157.1	86%	0.855	80%	0.795	S	S	*	*			trans	-73.9	160.3	163	-55.5	175.3	108.4	0	0	111.9
101	K	27.9	Very low	29.5	Very low	214 Å²	214	152.2 Å²	152.2	93%	0.93	79%	0.792	S	S	*	*			trans	-161.8	127.1	134.9	-117.2	166.9	-173.6	177	0	113.9
102	S	32.3	Very low	29.4	Very low	112 Å²	112	150.3 Å²	150.3	78%	0.783	79%	0.787	S	S	*	*			trans	-93.2	149.7	174.9	47.8	0	0	0	0	112.4
103	K	28	Very low	29.5	Very low	187 Å²	187	149 Å²	149	81%	0.813	78%	0.781	S	S	*	*			trans	-150.1	121.6	152	-73.8	-153.1	171.8	-154.7	0	107
104	E	27.7	Very low	29.9	Very low	179 Å²	179	148.8 Å²	148.8	84%	0.836	78%	0.78	S	S	*	*				84.7	139.2	59	-168.4	170.3	-126.1	0	0	111.5
105	A	30.3	Very low	30.1	Very low	87 Å²	87	147.2 Å²	147.2	72%	0.719	78%	0.775	S	S	*	*			trans	-105.4	160.8	-158.4	0	0	0	0	0	113.8
106	E	26.8	Very low	30.4	Very low	171 Å²	171	152.2 Å²	152.2	80%	0.799	78%	0.78	S	S	*	*				-173	149	123.8	-106.9	-158.7	124.3	0	0	117.2
107	M	26.8	Very low	30.5	Very low	144 Å²	144	151 Å²	151	71%	0.709	78%	0.776	S	S	*	*			trans	27.9	118.1	140.1	-164	147.8	56.5	0	0	124.3
108	K	29.4	Very low	30.6	Very low	189 Å²	189	150.4 Å²	150.4	82%	0.822	78%	0.784	S	S	*	*			trans	14.5	129	136.3	-53.3	170.1	179.1	172.4	0	120.3
109	K	29.8	Very low	30.8	Very low	198 Å²	198	151.1 Å²	151.1	86%	0.861	79%	0.788	S	S	*	*				171.9	123	115.5	-95	179.6	177.8	176.2	0	110.1
110	S	33.2	Very low	31.9	Very low	97 Å²	97	147.3 Å²	147.3	68%	0.678	78%	0.782	S	S	*	*				84.8	114.8	64.4	80.9	0	0	0	0	115.2
111	T	29.5	Very low	32.1	Very low	140 Å²	140	145.4 Å²	145.4	86%	0.859	77%	0.773	S	S	*	*			trans	-174.1	137.3	161.9	-82.8	0	0	0	0	109.1
112	V	31.8	Very low	32.5	Very low	113 Å²	113	142.1 Å²	142.1	69%	0.685	76%	0.759	S	S	*	*			cis	-168.1	143.9	-25.3	91.9	0	0	0	0	110.6
113	K	33.8	Very low	32.5	Very low	152 Å²	152	141.7 Å²	141.7	66%	0.661	75%	0.748	S	S	*	*			trans	56.9	165.3	158.4	-70.2	165.8	157.7	-82.3	0	118.8
114	E	36.4	Very low	32.7	Very low	145 Å²	145	142.6 Å²	142.6	68%	0.678	75%	0.746	S	S	*	*			cis	-159.9	163.1	-21.2	-105.4	160.7	168.3	0	0	106
115	V	35.8	Very low	32.8	Very low	116 Å²	116	143.9 Å²	143.9	70%	0.703	75%	0.749	S	S	*	*			cis	-154	154	42.9	172.2	0	0	0	0	110.7
116	M	33	Very low	32.8	Very low	182 Å²	182	148.5 Å²	148.5	90%	0.897	76%	0.755	S	S	*	*			trans	-5.3	152.2	162.9	-54	178.9	-69.2	0	0	121.8
117	G	31.1	Very low	34.4	Very low	65 Å²	65	145.8 Å²	145.8	67%	0.67	75%	0.753	S	S	*	*			cis	155.6	-163.3	-2.3	0	0	0	0	0	115.4
118	S	29.8	Very low	34.3	Very low	133 Å²	133	146 Å²	146	93%	0.93	76%	0.762	S	S	*	*			trans	95.1	155.4	-177.8	74.7	0	0	0	0	118
119	E	34.4	Very low	34	Very low	179 Å²	179	146 Å²	146	84%	0.836	76%	0.762	S	S	*	*			trans	-144.7	-174.5	-149.3	-99	-175.9	164.3	0	0	110
120	P	50.5	Low	33.8	Very low	107 Å²	107	142.2 Å²	142.2	70%	0.695	76%	0.756	S	S	*	*			cis	-135.7	166.5	4	21.5	4.8	0	0	0	118
121	E	36.7	Very low	33.5	Very low	144 Å²	144	143.5 Å²	143.5	67%	0.673	76%	0.759	S	S	*	*			trans	39.6	150.4	134.7	-56.7	-152.9	134.3	0	0	123.7
122	K	35.2	Very low	33.5	Very low	145 Å²	145	144.7 Å²	144.7	63%	0.63	76%	0.76	S	S	*	*			cis	-163.6	162.8	6.4	-129.8	170.7	-173.1	138.2	0	115.9
123	D	33	Very low	33.3	Very low	103 Å²	103	143 Å²	143	55%	0.551	77%	0.765	S	S	*	*			trans	65.7	113.3	144.2	-78.5	-33.2	0	0	0	125.4
124	R	32.3	Very low	33	Very low	206 Å²	206	138.9 Å²	138.9	78%	0.777	77%	0.765	S	S	*	*				71.1	117.8	121.7	-64.6	171.4	-161.3	-149.8	2	124.6
125	K	29.3	Very low	32.8	Very low	206 Å²	206	142.9 Å²	142.9	90%	0.896	77%	0.774	S	S	*	*				59.5	138.4	124.1	-63.3	-168.3	173.3	-167.8	0	122.3
126	E	30.5	Very low	32.5	Very low	183 Å²	183	143.1 Å²	143.1	86%	0.855	77%	0.771	S	S	*	*			trans	-75.8	-173.6	169.7	-28.8	162.4	119.7	0	0	112.7
127	P	60.2	Low	32.4	Very low	115 Å²	115	141.5 Å²	141.5	75%	0.747	77%	0.765	S	S	*	*			cis	-130.8	164.6	-20	37.2	-21.6	0	0	0	114.2
128	V	25.5	Very low	32.3	Very low	148 Å²	148	145 Å²	145	90%	0.897	77%	0.768	S	S	*	*			trans	-144.5	153	173.5	-175.8	0	0	0	0	113.9
129	F	22.3	Very low	32.2	Very low	190 Å²	190	141.6 Å²	141.6	83%	0.833	76%	0.755	S	S	*	*			trans	-78.9	145.6	-177.3	-93	-126.8	0	0	0	116.9
130	V	25.5	Very low	31.9	Very low	118 Å²	118	139 Å²	139	72%	0.715	75%	0.751	S	S	*	*				18.6	133.8	121.9	-179.8	0	0	0	0	119.7
131	T	27.7	Very low	30.8	Very low	124 Å²	124	141.2 Å²	141.2	76%	0.761	75%	0.75	S	S	*	*				-173	132.2	127.4	15.6	0	0	0	0	116.7
132	L	28.9	Very low	30.3	Very low	165 Å²	165	140.8 Å²	140.8	86%	0.864	75%	0.748	S	S	*	*			trans	53.8	150.8	155.4	-83.1	71.5	0	0	0	120.9
133	G	28.1	Very low	29.9	Very low	77 Å²	77	142.5 Å²	142.5	79%	0.794	76%	0.758	S	S	*	*			cis	171.8	166.8	-3.4	0	0	0	0	0	111.3
134	G	26.3	Very low	29.8	Very low	65 Å²	65	146.1 Å²	146.1	67%	0.67	77%	0.772	S	S	*	*			cis	-142	170	4	0	0	0	0	0	112.9
135	R	31.9	Very low	30.1	Very low	229 Å²	229	142.3 Å²	142.3	86%	0.864	77%	0.773	S	S	*	*				75.8	138.1	86.1	-70.5	-164.7	162.6	-143.8	-3.8	113.3
136	L	31.5	Very low	30	Very low	122 Å²	122	140.8 Å²	140.8	64%	0.639	77%	0.769	S	S	*	*			cis	-170.4	159.9	-3.5	-102.4	175.4	0	0	0	105.5
137	L	30.4	Very low	30	Very low	148 Å²	148	137 Å²	137	78%	0.775	76%	0.759	S	S	*	*			cis	-146.7	-179.2	9.6	-83.7	120.3	0	0	0	107.7
138	D	28.4	Very low	28.4	Very low	137 Å²	137	141.4 Å²	141.4	73%	0.733	76%	0.76	S	S	*	*			cis	-179.9	161.3	-38.6	-164.7	1.4	0	0	0	108.2
139	G	28.1	Very low	28.5	Very low	63 Å²	63	140.2 Å²	140.2	65%	0.649	75%	0.749	S	S	*	*			trans	112.1	105	178.4	0	0	0	0	0	114.1
140	V	28.2	Very low	28.8	Very low	125 Å²	125	138.3 Å²	138.3	76%	0.758	75%	0.748	S	S	*	*			cis	74.1	120.7	43.9	-177.3	0	0	0	0	111.8
141	K	26.5	Very low	29	Very low	152 Å²	152	138 Å²	138	66%	0.661	75%	0.745	S	S	*	*			cis	-157.7	140.2	-5.1	-117.1	-173.7	179.4	-121.7	0	108.9
142	E	27.1	Very low	29.1	Very low	135 Å²	135	139.6 Å²	139.6	63%	0.631	74%	0.744	S	S	*	*				67.2	123.2	100.5	-75.7	173.2	-158.4	0	0	119
143	E	26.9	Very low	29.2	Very low	182 Å²	182	140.3 Å²	140.3	85%	0.85	74%	0.743	S	S	*	*			trans	79.8	151.8	143.6	-65.9	-175.9	172.1	0	0	123.1
144	E	31.1	Very low	29.2	Very low	179 Å²	179	143.7 Å²	143.7	84%	0.836	74%	0.743	S	S	*	*			trans	-89.1	177.4	-174	-47.1	179.3	138.4	0	0	111.4
145	P	38.3	Very low	29.3	Very low	125 Å²	125	143.5 Å²	143.5	81%	0.812	74%	0.741	S	S	*	*				-153.4	174.6	81.9	40.8	-20.8	0	0	0	118
146	E	27.1	Very low	29.3	Very low	174 Å²	174	137.5 Å²	137.5	81%	0.813	73%	0.73	S	S	*	*			trans	-30.3	150.7	164.3	-83.4	-162.4	124.9	0	0	122.4
147	V	29.6	Very low	29.2	Very low	104 Å²	104	141 Å²	141	63%	0.63	73%	0.734	S	S	*	*				88	110.1	128	163.5	0	0	0	0	122.7
148	R	28.1	Very low	29.3	Very low	208 Å²	208	140.3 Å²	140.3	79%	0.785	73%	0.727	S	S	*	*			trans	76.4	126.3	132.7	-73.3	-175.7	-173.6	168.3	5	124.7
149	D	27.3	Very low	29.3	Very low	122 Å²	122	142.8 Å²	142.8	65%	0.652	73%	0.734	S	S	*	*				72.9	130.3	122.2	-49.8	-10.6	0	0	0	123.6
150	D	28.2	Very low	29.2	Very low	151 Å²	151	143 Å²	143	81%	0.807	74%	0.736	S	S	*	*			trans	95	128.4	133.4	-81.2	-8.5	0	0	0	125.1
151	V	29.7	Very low	30	Very low	110 Å²	110	142.4 Å²	142.4	67%	0.667	74%	0.736	S	S	*	*			trans	100.1	120	134.7	161.1	0	0	0	0	122.7
152	E	29.6	Very low	30.1	Very low	158 Å²	158	144.1 Å²	144.1	74%	0.738	74%	0.743	S	S	*	*			trans	58.7	117.2	149.1	-70.3	164.6	-169.9	0	0	121.3
153	E	31.3	Very low	30.1	Very low	180 Å²	180	146 Å²	146	84%	0.841	75%	0.752	S	S	*	*				78.6	148.7	94.7	-67.1	-166.9	158.9	0	0	113.9
154	D	28.5	Very low	30.2	Very low	149 Å²	149	145.9 Å²	145.9	80%	0.797	75%	0.751	S	S	*	*			cis	-157.2	171.4	28.2	-177.2	16.4	0	0	0	111
155	G	27.9	Very low	30	Very low	61 Å²	61	145.1 Å²	145.1	63%	0.629	75%	0.753	S	S	*	*			trans	118.3	70.1	163.2	0	0	0	0	0	116.8
156	V	31.2	Very low	29.5	Very low	103 Å²	103	148.1 Å²	148.1	62%	0.624	76%	0.756	S	S	*	*				59.8	112.6	91.3	-180	0	0	0	0	113.2
157	R	29.2	Very low	29.6	Very low	194 Å²	194	149.3 Å²	149.3	73%	0.732	76%	0.762	S	S	*	*				174.5	171.6	83.6	-141	159.7	-175.9	89.6	26.9	110
158	E	33.5	Very low	29.4	Very low	134 Å²	134	153.7 Å²	153.7	63%	0.626	78%	0.775	S	S	*	*				-159.3	161.7	-51.1	-91.3	167.6	171.4	0	0	105
159	E	28.5	Very low	29.3	Very low	189 Å²	189	150.5 Å²	150.5	88%	0.883	78%	0.779	S	S	*	*			cis	-128.4	-150	-0.1	-62.5	-173.9	65.4	0	0	110.3
160	G	24.6	Very low	29.1	Very low	67 Å²	67	152.1 Å²	152.1	69%	0.691	79%	0.786	S	S	*	*			trans	-129.9	-137.1	165.4	0	0	0	0	0	110.9
161	P	45	Very low	28.9	Very low	114 Å²	114	152 Å²	152	74%	0.74	79%	0.785	S	S	*	*			cis	-137.6	164	-18.1	40	-24.4	0	0	0	114.6
162	K	28.4	Very low	28.6	Very low	187 Å²	187	158 Å²	158	81%	0.813	80%	0.797	S	S	*	*				169.7	146.7	126	-94.7	164	-174.8	177.3	0	115.3
163	Q	27.4	Very low	28.5	Very low	175 Å²	175	155.4 Å²	155.4	82%	0.818	80%	0.796	S	S	*	*			trans	-25.4	153.1	158.5	-61.4	153	-44.2	0	0	115.1
164	Q	28.6	Very low	28.3	Very low	179 Å²	179	156.6 Å²	156.6	84%	0.836	80%	0.802	S	S	*	*			cis	-168.1	130.1	46.3	-166	170.4	-0.5	0	0	112.4
165	D	27.4	Very low	28.2	Very low	164 Å²	164	159.5 Å²	159.5	88%	0.877	81%	0.808	S	S	*	*			trans	-89.6	134.9	-177.9	-59.8	-54	0	0	0	114
166	Q	27.4	Very low	28.2	Very low	188 Å²	188	164.9 Å²	164.9	88%	0.879	82%	0.821	S	S	*	*			trans	-150.1	114.8	158.9	-79.1	-166.8	-26.9	0	0	109
167	E	29.5	Very low	28.1	Very low	199 Å²	199	167.4 Å²	167.4	93%	0.93	83%	0.828	S	S	*	*			trans	-126	141.8	165	-72.4	-158.8	134.4	0	0	111.1
168	Q	26.4	Very low	28.1	Very low	196 Å²	196	169.8 Å²	169.8	92%	0.916	84%	0.837	S	S	*	*			trans	-114.2	121.5	172.5	-65.3	-174.7	-86.4	0	0	109.1
169	T	24.6	Very low	27.9	Very low	141 Å²	141	170 Å²	170	87%	0.865	84%	0.842	S	S	*	*			trans	-82.5	115.6	178.9	-47.9	0	0	0	0	111.9
170	I	24.6	Very low	27.8	Very low	155 Å²	155	169.5 Å²	169.5	80%	0.795	85%	0.845	S	S	*	*			trans	-140.1	125.5	156	-70.4	-169.7	0	0	0	109.8
171	L	23.8	Very low	27.9	Very low	149 Å²	149	169.5 Å²	169.5	78%	0.78	85%	0.845	S	S	*	*			trans	33.3	129.1	158.3	-110.4	68.5	0	0	0	120.5
172	Y	23.9	Very low	27.3	Very low	236 Å²	236	170.2 Å²	170.2	93%	0.925	85%	0.848	S	S	*	*			trans	-138.4	149.3	134.7	-113.6	-82.2	0	0	0	111.7
173	S	27.6	Very low	27.2	Very low	104 Å²	104	168.6 Å²	168.6	73%	0.727	84%	0.843	S	S	*	*			trans	-117	137.6	173.7	52.9	0	0	0	0	109.8
174	E	27.3	Very low	27.3	Very low	205 Å²	205	167.8 Å²	167.8	96%	0.958	84%	0.839	S	S	*	*			trans	-89	136.9	175.5	-68.6	-163.1	125.4	0	0	112.2
175	K	26.2	Very low	27.1	Very low	210 Å²	210	163.3 Å²	163.3	91%	0.913	83%	0.833	S	S	*	*			trans	-147.7	143.7	159.2	-158.8	167.3	-174	173.2	0	109.5
176	L	26.4	Very low	27.7	Very low	174 Å²	174	160.8 Å²	160.8	91%	0.911	83%	0.826	S	S	*	*			trans	-73.6	151.8	-159.4	-147.2	73.4	0	0	0	115
177	M	29.9	Very low	27.5	Very low	156 Å²	156	157.5 Å²	157.5	77%	0.768	82%	0.822	S	S	*	*			trans	-59.3	152	-174.7	-59.9	-67.2	-137.2	0	0	116.5
178	R	29	Very low	27.3	Very low	243 Å²	243	153.5 Å²	153.5	92%	0.917	82%	0.816	S	S	*	*			trans	-154.9	130.1	130	-158.3	162.7	-66.3	171.8	0.3	110.6
179	D	29.1	Very low	28.4	Very low	140 Å²	140	149.5 Å²	149.5	75%	0.749	81%	0.807	S	S	*	*			trans	-74.9	151.4	-178.5	-67.7	-67.1	0	0	0	113.7
180	D	26.1	Very low	28.5	Very low	177 Å²	177	149.3 Å²	149.3	95%	0.947	81%	0.806	S	S	*	*			trans	-159.8	140.4	149.7	-118.5	-32.1	0	0	0	111.6
181	G	28	Very low	28.7	Very low	67 Å²	67	148.5 Å²	148.5	69%	0.691	80%	0.799	S	S	*	*			trans	165.7	153.1	-179.5	0	0	0	0	0	111.5
182	V	30.7	Very low	28.9	Very low	130 Å²	130	149.2 Å²	149.2	79%	0.788	80%	0.796	S	S	*	*			cis	-145.8	166.5	16.6	170	0	0	0	0	110.9
183	Q	27.4	Very low	29	Very low	153 Å²	153	142.6 Å²	142.6	72%	0.715	78%	0.783	S	S	*	*			trans	-38.7	166.8	165.4	-65.1	151.3	-89.5	0	0	116.4
184	E	28.5	Very low	29.2	Very low	157 Å²	157	145.4 Å²	145.4	73%	0.734	79%	0.785	S	S	*	*			cis	-163.3	163.7	6.2	-126.6	157.6	-129.6	0	0	112.6
185	A	25.3	Very low	29.3	Very low	86 Å²	86	142.5 Å²	142.5	71%	0.711	78%	0.776	S	S	*	*			trans	17.4	166.5	147	0	0	0	0	0	124.6
186	P	39.6	Very low	29.3	Very low	111 Å²	111	137.8 Å²	137.8	72%	0.721	77%	0.77	S	S	*	*			cis	-141.5	172.2	-36.5	39.3	-21.3	0	0	0	117
187	C	22.7	Very low	29.4	Very low	119 Å²	119	136.9 Å²	136.9	80%	0.804	77%	0.766	S	S	*	*			trans	74	121.2	148.6	-76.4	0	0	0	0	125.2
188	S	26.5	Very low	30.1	Very low	115 Å²	115	135.4 Å²	135.4	80%	0.804	77%	0.768	S	S	*	*			trans	93.8	169.5	134.8	88.5	0	0	0	0	119.4
189	P	49.3	Very low	30.2	Very low	112 Å²	112	128 Å²	128	73%	0.727	76%	0.759	S	S	*	*				-141.4	154.6	-104	38.6	-18	0	0	0	118.7
190	T	26.1	Very low	30.7	Very low	136 Å²	136	127 Å²	127	83%	0.834	76%	0.76	S	S	*	*			trans	167.9	161.1	159	36.6	0	0	0	0	108.5
191	E	29	Very low	30.7	Very low	138 Å²	138	126.9 Å²	126.9	65%	0.645	75%	0.754	S	S	*	*			cis	-166	157.1	-15.3	-116.9	-166.6	140.5	0	0	108.5
192	K	27.9	Very low	30.7	Very low	165 Å²	165	130 Å²	130	72%	0.717	75%	0.753	S	S	*	*			trans	65.1	152.8	154.9	-69.4	158.3	-175.2	149.7	0	118.4
193	S	27.4	Very low	30.4	Very low	96 Å²	96	129.2 Å²	129.2	67%	0.671	75%	0.749	S	S	*	*			cis	-167	148.3	-13.5	46.4	0	0	0	0	113.2
194	E	30.1	Very low	30.5	Very low	163 Å²	163	127.2 Å²	127.2	76%	0.762	75%	0.748	S	S	*	*			trans	71.8	123.1	145.3	-74.4	177.1	-147.5	0	0	124.5
195	N	29.8	Very low	30.4	Very low	144 Å²	144	127.8 Å²	127.8	77%	0.77	75%	0.75	S	S	*	*			trans	69.2	147.8	132.5	-68	-31.1	0	0	0	121.4
196	S	26.4	Very low	30.5	Very low	111 Å²	111	128.8 Å²	128.8	78%	0.776	75%	0.748	S	S	*	*			cis	-153	154	0.4	47.3	0	0	0	0	114.1
197	N	29.3	Very low	29.8	Very low	155 Å²	155	128.2 Å²	128.2	83%	0.829	75%	0.746	S	S	*	*			trans	-70	173.5	163.7	-103.2	-10.3	0	0	0	112.1
198	P	44	Very low	30	Very low	126 Å²	126	130.7 Å²	130.7	82%	0.818	75%	0.746	S	S	*	*			cis	-146.9	-174.9	37	43.7	-23	0	0	0	118.7
199	A	30.2	Very low	30	Very low	87 Å²	87	130 Å²	130	72%	0.719	74%	0.737	S	S	*	*			trans	-106.3	172.9	168.9	0	0	0	0	0	112.5
200	P	39.5	Very low	28.8	Very low	119 Å²	119	132.9 Å²	132.9	77%	0.773	74%	0.741	S	S	*	*				-132	158.7	117.8	40.1	-31.6	0	0	0	111.7
201	E	26.8	Very low	28.8	Very low	175 Å²	175	133.2 Å²	133.2	82%	0.818	74%	0.737	S	S	*	*			cis	65.4	138.5	48.1	-75.9	-164.5	175.4	0	0	114.2
202	L	28.2	Very low	29.2	Very low	131 Å²	131	132.4 Å²	132.4	69%	0.686	74%	0.744	S	S	*	*			cis	-156.5	152.4	-8.9	-162.5	70.2	0	0	0	106.7
203	T	24.3	Very low	29.1	Very low	115 Å²	115	129.5 Å²	129.5	71%	0.706	75%	0.745	S	S	*	*				167.1	129.4	99	44	0	0	0	0	107.1
204	T	28.7	Very low	29	Very low	110 Å²	110	130.5 Å²	130.5	68%	0.675	75%	0.746	S	S	*	*				58.2	146	72.6	70.2	0	0	0	0	114.1
205	E	26.9	Very low	28.9	Very low	169 Å²	169	131.8 Å²	131.8	79%	0.79	75%	0.749	S	S	*	*			cis	-125.8	-163.1	9.9	-61.3	175.1	60.8	0	0	110.5
206	T	27.1	Very low	28.9	Very low	108 Å²	108	133 Å²	133	66%	0.663	76%	0.756	S	S	*	*			cis	-156	154.1	3.2	-26	0	0	0	0	111
207	S	25.4	Very low	29	Very low	98 Å²	98	132.4 Å²	132.4	69%	0.685	75%	0.752	S	S	*	*			trans	42	147	141	65.6	0	0	0	0	123.7
208	E	27.2	Very low	29.1	Very low	172 Å²	172	136.3 Å²	136.3	80%	0.804	76%	0.755	S	S	*	*			cis	-179.7	165.2	-10	-104.4	-145.2	107.2	0	0	106
209	V	26.4	Very low	28.3	Very low	100 Å²	100	136.2 Å²	136.2	61%	0.606	75%	0.752	S	S	*	*			cis	-165.7	158.8	-25.2	88	0	0	0	0	104.8
210	Q	23.9	Very low	28.4	Very low	173 Å²	173	137.7 Å²	137.7	81%	0.808	75%	0.752	S	S	*	*				-171.9	161.8	72.1	-158.5	158	108.3	0	0	113.3
211	N	26.9	Very low	28.1	Very low	143 Å²	143	138.7 Å²	138.7	77%	0.765	75%	0.751	S	S	*	*			trans	-48.9	175.5	164.5	-74.6	-24.4	0	0	0	117.9
212	P	36.1	Very low	28.4	Very low	121 Å²	121	137.5 Å²	137.5	79%	0.786	75%	0.75	S	S	*	*			cis	-136.6	-176.5	-12.8	27.6	-4.1	0	0	0	115.8
213	S	25.4	Very low	28.7	Very low	104 Å²	104	140 Å²	140	73%	0.727	76%	0.756	S	S	*	*			trans	-64.4	153.9	161.2	171.8	0	0	0	0	114.2
214	V	27	Very low	29.3	Very low	117 Å²	117	137.6 Å²	137.6	71%	0.709	75%	0.748	S	S	*	*				174.2	129.4	126.6	147.3	0	0	0	0	113.8
215	K	27.1	Very low	29.7	Very low	189 Å²	189	138.5 Å²	138.5	82%	0.822	75%	0.747	S	S	*	*			trans	46.8	124.9	156.2	-66.3	169.5	-172.8	173.2	0	121.2
216	D	31	Very low	30.3	Very low	170 Å²	170	135.3 Å²	135.3	91%	0.909	74%	0.739	S	S	*	*			trans	-66.2	135.3	162.2	-62.5	-73.8	0	0	0	114.2
217	S	28.1	Very low	30.7	Very low	99 Å²	99	136 Å²	136	69%	0.692	74%	0.735	S	S	*	*			trans	-162.4	115.9	155.1	66.4	0	0	0	0	113.3
218	R	30.4	Very low	31.3	Very low	237 Å²	237	135.6 Å²	135.6	89%	0.894	73%	0.727	S	S	*	*			trans	66.7	160.9	167.5	-49.6	177.3	175.2	172.2	-1.9	113.6
219	T	28	Very low	31.8	Very low	124 Å²	124	133 Å²	133	76%	0.761	72%	0.719	S	S	*	*			cis	-146.9	177.3	1.2	-18.7	0	0	0	0	109.9
220	T	32.3	Very low	32.4	Very low	118 Å²	118	133.6 Å²	133.6	72%	0.724	72%	0.718	S	S	*	*			trans	-50.7	134.7	164.5	47.3	0	0	0	0	113.9
221	D	31.9	Very low	33	Very low	140 Å²	140	130.5 Å²	130.5	75%	0.749	70%	0.703	S	S	*	*				-171.4	114.3	120.5	-105.7	-29.7	0	0	0	112.7
222	D	34.8	Very low	33.5	Very low	149 Å²	149	129 Å²	129	80%	0.797	69%	0.692	S	S	*	*			trans	-148.4	20.2	171.1	-128.7	-20.1	0	0	0	112.4
223	K	34.7	Very low	33.5	Very low	183 Å²	183	128.3 Å²	128.3	80%	0.796	68%	0.68	S	S	*	*	S	Bend	trans	-103.7	-11	178.4	-77.4	-172.5	173.1	-177.3	0	114.2	I225	K223-I225 PolarHBondContact O-N 3.02Å
224	A	36.3	Very low	34	Very low	66 Å²	66	128.4 Å²	128.4	55%	0.545	68%	0.676	S	S	.	*	H	α-helix	trans	-69.3	-33.4	-173.2	0	0	0	0	0	114	V226	A224-V226 PolarHBondContact O-N 3.05Å
225	I	37.7	Very low	34.3	Very low	128 Å²	128	130.1 Å²	130.1	66%	0.656	68%	0.676	S	S	*	*	H	α-helix	trans	-75.4	-28.3	-169.8	-62.5	176.9	0	0	0	112.7	K223	K223-I225 PolarHBondContact O-N 3.02Å
226	V	37.9	Very low	34.6	Very low	103 Å²	103	129.7 Å²	129.7	62%	0.624	68%	0.675	S	S	*	*	H	α-helix	trans	-76.7	-28.7	-177.6	-176.4	0	0	0	0	112.5	A224	A224-V226 PolarHBondContact O-N 3.05Å
227	H	35.6	Very low	34.6	Very low	123 Å²	123	129.8 Å²	129.8	57%	0.569	67%	0.672	S	S	*	*	H	α-helix	trans	-70.7	-40.8	-176.9	-142.8	-85	0	0	0	112.5	L229 L230 E231	H227-L229 VanDerWaalsContact C-N 3.26Å; H227-L229 PolarHBondContact O-N 2.96Å; H227-L230 PolarHBondContact O-N 2.84Å; H227-E231 IonicContact CE1-OE1 3.08Å; H227-E231 PolarHBondContact CE1-OE1 3.3Å; H227-E231 IonicContact ND1-OE1 3.94Å; H227-E231 PolarHBondContact ND1-OE1 2.98Å
228	V	38.9	Very low	35	Very low	88 Å²	88	129.6 Å²	129.6	53%	0.533	67%	0.67	S	S	.	*	H	α-helix	trans	-64.6	-28.1	-175.1	-178.7	0	0	0	0	112.8
229	L	38.3	Very low	34.9	Very low	118 Å²	118	126.6 Å²	126.6	62%	0.618	67%	0.669	S	S	*	*	H	α-helix	trans	-82.3	-18.2	-179.3	-97.6	158.5	0	0	0	114.3	H227	H227-L229 VanDerWaalsContact C-N 3.26Å; H227-L229 PolarHBondContact O-N 2.96Å
230	L	38.6	Very low	34.9	Very low	112 Å²	112	124.6 Å²	124.6	59%	0.586	67%	0.673	S	S	*	*	H	α-helix	trans	-89.5	-38.2	179.7	-84.4	161.7	0	0	0	112.6	H227 Q232 I233 V234	H227-L230 PolarHBondContact O-N 2.84Å; L230-Q232 PolarHBondContact O-N 3.07Å; L230-I233 PolarHBondContact O-N 3.5Å; L230-V234 PolarHBondContact O-N 2.93Å
231	E	36.7	Very low	34.7	Very low	109 Å²	109	128.2 Å²	128.2	51%	0.509	68%	0.682	S	S	.	*	H	α-helix	trans	-64.8	-38.2	179.6	-70.2	172.8	172.3	0	0	112.1	H227 I233 V234 E235	H227-E231 IonicContact CE1-OE1 3.08Å; H227-E231 PolarHBondContact CE1-OE1 3.3Å; H227-E231 IonicContact ND1-OE1 3.94Å; H227-E231 PolarHBondContact ND1-OE1 2.98Å; E231-I233 PolarHBondContact O-N 3.11Å; E231-I233 VanDerWaalsContact O-N 3.11Å; E231-V234 PolarHBondContact O-N 2.86Å; E231-V234 VanDerWaalsContact O-N 3.09Å; E231-E235 PolarHBondContact O-N 3.19Å
232	Q	36.5	Very low	34.5	Very low	112 Å²	112	127.3 Å²	127.3	52%	0.523	69%	0.686	S	S	.	*	H	α-helix	trans	-65.7	-12	176.6	-68.6	-169.7	1.2	0	0	115	L230	L230-Q232 PolarHBondContact O-N 3.07Å
233	I	36.8	Very low	34.2	Very low	106 Å²	106	126.1 Å²	126.1	54%	0.544	68%	0.684	S	S	.	*	H	α-helix	trans	-90.7	-35.8	173.9	-63.1	176.4	0	0	0	110.3	L230 E231 K236	L230-I233 PolarHBondContact O-N 3.5Å; E231-I233 PolarHBondContact O-N 3.11Å; E231-I233 VanDerWaalsContact O-N 3.11Å; I233-K236 PolarHBondContact O-N 3.28Å
234	V	35.1	Very low	33.9	Very low	106 Å²	106	123.1 Å²	123.1	64%	0.642	68%	0.681	S	S	*	*	H	α-helix	trans	-69.6	-43.4	-179.9	179	0	0	0	0	111.6	L230 E231 K236 M237	L230-V234 PolarHBondContact O-N 2.93Å; E231-V234 PolarHBondContact O-N 2.86Å; E231-V234 VanDerWaalsContact O-N 3.09Å; V234-K236 PolarHBondContact O-N 2.78Å; V234-M237 PolarHBondContact O-N 3.31Å; V234-M237 VanDerWaalsContact O-N 3.16Å
235	E	32.8	Very low	33.4	Very low	152 Å²	152	129.4 Å²	129.4	71%	0.71	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-58.1	-32.5	177.4	-72.9	-166.1	123.4	0	0	113	E231 M237 S238	E231-E235 PolarHBondContact O-N 3.19Å; E235-M237 PolarHBondContact O-N 3.37Å; E235-S238 PolarHBondContact O-N 3.28Å
236	K	34.2	Very low	32.9	Very low	181 Å²	181	127.4 Å²	127.4	79%	0.787	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-75.9	-3.9	-177.7	-73.9	-177.9	178.9	171.5	0	114.9	I233 V234	I233-K236 PolarHBondContact O-N 3.28Å; V234-K236 PolarHBondContact O-N 2.78Å
237	M	31.8	Very low	32.2	Very low	171 Å²	171	131.2 Å²	131.2	84%	0.842	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-111.3	5.2	176.5	-60.1	-168.4	72.4	0	0	113.5	V234 E235	V234-M237 PolarHBondContact O-N 3.31Å; V234-M237 VanDerWaalsContact O-N 3.16Å; E235-M237 PolarHBondContact O-N 3.37Å
238	S	35.1	Very low	31.7	Very low	95 Å²	95	131.1 Å²	131.1	66%	0.664	72%	0.718	S	S	*	*	S	Bend	trans	-121.1	8.7	-168.3	-165.2	0	0	0	0	116.5	E235	E235-S238 PolarHBondContact O-N 3.28Å
239	M	28.3	Very low	30.9	Very low	174 Å²	174	135.1 Å²	135.1	86%	0.857	73%	0.73	S	S	*	*			trans	-133.5	101.4	176.2	-74.9	-64.9	-74.1	0	0	111.2
240	G	28.1	Very low	30.3	Very low	83 Å²	83	138.7 Å²	138.7	86%	0.856	74%	0.741	S	S	*	*			trans	-148.4	-4.8	-173.6	0	0	0	0	0	116.9
241	E	29.4	Very low	30.6	Very low	193 Å²	193	137.7 Å²	137.7	90%	0.902	74%	0.741	S	S	*	*			trans	-120.6	121.1	171.4	-72.5	-163	132	0	0	111
242	S	27.3	Very low	29.9	Very low	121 Å²	121	140.7 Å²	140.7	85%	0.846	76%	0.755	S	S	*	*			trans	-160.6	146.3	164.1	-173.6	0	0	0	0	109.2
243	V	27.6	Very low	29.5	Very low	124 Å²	124	145.4 Å²	145.4	75%	0.752	77%	0.768	S	S	*	*			trans	-135.4	144.2	-162.6	-178.6	0	0	0	0	110.2
244	T	29.7	Very low	29	Very low	120 Å²	120	146.7 Å²	146.7	74%	0.736	77%	0.772	S	S	*	*				162.2	149.1	127.3	41.9	0	0	0	0	115.8
245	K	25.1	Very low	28.7	Very low	199 Å²	199	145.4 Å²	145.4	87%	0.865	77%	0.768	S	S	*	*			trans	72.1	150.8	158.6	-69.4	162.1	-178.5	174.3	0	119.5
246	A	27.4	Very low	28.3	Very low	85 Å²	85	146.5 Å²	146.5	70%	0.702	77%	0.773	S	S	*	*			cis	-176.4	137.8	-27.4	0	0	0	0	0	112.1
247	Q	22.9	Very low	27.9	Very low	184 Å²	184	143.7 Å²	143.7	86%	0.86	77%	0.771	S	S	*	*			trans	-175.4	117.2	146.3	-102.3	162.4	-0.9	0	0	108.1
248	V	25.8	Very low	27.7	Very low	121 Å²	121	140 Å²	140	73%	0.733	77%	0.768	S	S	*	*				73.9	126.3	81.6	171.7	0	0	0	0	111.5
249	Q	22.4	Very low	27.3	Very low	172 Å²	172	140.8 Å²	140.8	80%	0.804	78%	0.78	S	S	*	*			cis	-148.9	137.1	22.9	-131.6	147.7	26.2	0	0	109.2
250	K	24.8	Very low	27	Very low	192 Å²	192	136.2 Å²	136.2	84%	0.835	78%	0.778	S	S	*	*				65.8	151.4	84.2	-123.9	-142.2	173.9	-167.3	0	115.7
251	P	44.7	Very low	27	Very low	92 Å²	92	140.3 Å²	140.3	60%	0.597	78%	0.779	S	S	*	*			cis	-137.1	175.7	-21.7	36.8	-17.4	0	0	0	117.2
252	E	22.3	Very low	26.9	Very low	172 Å²	172	137.9 Å²	137.9	80%	0.804	77%	0.772	S	S	*	*			trans	149	116.3	136.2	-82.8	176.6	-171	0	0	111.6
253	W	27.8	Very low	26.9	Very low	211 Å²	211	139 Å²	139	80%	0.799	77%	0.768	S	S	*	*				73.2	133.8	88.4	135.5	-70.5	0	0	0	113.9
254	E	26.1	Very low	26.9	Very low	132 Å²	132	137.6 Å²	137.6	62%	0.617	76%	0.764	S	S	*	*			cis	-168.7	160.3	-12.6	-164.9	-164.6	-93.3	0	0	111
255	S	28.6	Very low	26.8	Very low	80 Å²	80	137 Å²	137	56%	0.559	77%	0.765	S	S	*	*			trans	67	156.5	153.9	-79.7	0	0	0	0	119
256	Q	25.7	Very low	26.9	Very low	175 Å²	175	136.6 Å²	136.6	82%	0.818	76%	0.763	S	S	*	*			cis	-156.2	-178	-17.4	-121.7	174.4	41.6	0	0	112.8
257	T	25.8	Very low	26.9	Very low	122 Å²	122	137.9 Å²	137.9	75%	0.748	76%	0.762	S	S	*	*			trans	-68.5	142.3	-165.7	46.4	0	0	0	0	121.4
258	A	26.1	Very low	27	Very low	94 Å²	94	136 Å²	136	78%	0.777	76%	0.758	S	S	*	*				75.4	145.1	123.9	0	0	0	0	0	125.7
259	A	26.7	Very low	28.3	Very low	110 Å²	110	134 Å²	134	91%	0.909	75%	0.748	S	S	*	*			trans	69.8	154.4	149.5	0	0	0	0	0	121.1
260	G	23.5	Very low	28.6	Very low	79 Å²	79	134.3 Å²	134.3	81%	0.814	75%	0.749	S	S	*	*			trans	150.7	126.9	166.8	0	0	0	0	0	115.5
261	L	26.7	Very low	28.7	Very low	168 Å²	168	129 Å²	129	88%	0.88	74%	0.74	S	S	*	*			trans	-103.8	169.6	172.6	-71.4	158.1	0	0	0	110.8
262	D	28.1	Very low	27.9	Very low	143 Å²	143	129.3 Å²	129.3	77%	0.765	75%	0.745	S	S	*	*			trans	71.3	162.7	146.2	-108.3	6.1	0	0	0	118.8
263	L	27.7	Very low	28.1	Very low	143 Å²	143	127.6 Å²	127.6	75%	0.749	75%	0.747	S	S	*	*			cis	-149.2	172.1	-1.2	-174.3	50.2	0	0	0	111.3
264	S	27	Very low	28	Very low	95 Å²	95	121.6 Å²	121.6	66%	0.664	74%	0.737	S	S	*	*			trans	-76.9	157.7	-174.9	60.8	0	0	0	0	118.9
265	S	28.1	Very low	28.1	Very low	109 Å²	109	123.1 Å²	123.1	76%	0.762	74%	0.744	S	S	*	*			trans	175.1	154.2	141.5	43.5	0	0	0	0	110.7
266	F	26.8	Very low	28	Very low	189 Å²	189	125.8 Å²	125.8	83%	0.829	76%	0.756	S	S	*	*			cis	-161	149.3	-3.4	-134.1	-134.2	0	0	0	110.8
267	V	27.8	Very low	28.7	Very low	113 Å²	113	123 Å²	123	69%	0.685	75%	0.754	S	S	*	*			trans	48.3	122.2	145.2	176.6	0	0	0	0	119.9
268	D	25.5	Very low	28.6	Very low	145 Å²	145	121.4 Å²	121.4	78%	0.775	75%	0.753	S	S	*	*			cis	81	163.7	34.5	-141.9	48.2	0	0	0	114.1
269	P	53.3	Low	28.6	Very low	79 Å²	79	125.3 Å²	125.3	51%	0.513	76%	0.755	S	S	.	*				-127.8	-150.7	-58.9	39.3	-24.3	0	0	0	114.6
270	H	28.1	Very low	28.6	Very low	177 Å²	177	127.5 Å²	127.5	82%	0.819	75%	0.75	S	S	*	*			trans	94.1	144	165.9	-56.8	-58.7	0	0	0	118.9
271	A	27	Very low	28.7	Very low	80 Å²	80	135.3 Å²	135.3	66%	0.661	76%	0.755	S	S	*	*			cis	-165.9	157.2	-14.5	0	0	0	0	0	115.4
272	S	27.2	Very low	28.8	Very low	100 Å²	100	134 Å²	134	70%	0.699	75%	0.748	S	S	*	*			trans	63.3	139.3	138.7	61.3	0	0	0	0	126.1
273	T	26.5	Very low	29.2	Very low	136 Å²	136	132.3 Å²	132.3	83%	0.834	75%	0.745	S	S	*	*			trans	66.6	148.9	146.8	43.8	0	0	0	0	120.1
274	S	26.4	Very low	29.3	Very low	85 Å²	85	128.7 Å²	128.7	59%	0.594	74%	0.743	S	S	*	*			cis	-158.9	177.6	-11.5	-153.3	0	0	0	0	111.6
275	E	27.7	Very low	29.6	Very low	164 Å²	164	132.2 Å²	132.2	77%	0.766	75%	0.753	S	S	*	*			trans	38.8	111.2	155.8	-71.1	141.1	-102.4	0	0	120.5
276	V	26.3	Very low	29.8	Very low	135 Å²	135	131.7 Å²	131.7	82%	0.818	74%	0.742	S	S	*	*				55.4	132.5	70.8	-175.9	0	0	0	0	113.9
277	P	40.3	Very low	30	Very low	117 Å²	117	130.4 Å²	130.4	76%	0.76	74%	0.743	S	S	*	*			cis	-133.3	-174.5	-6.6	39.2	-20.6	0	0	0	116.5
278	A	24.4	Very low	30.4	Very low	89 Å²	89	130.9 Å²	130.9	74%	0.736	75%	0.746	S	S	*	*			trans	101.9	135.1	137	0	0	0	0	0	122.7
279	E	26.2	Very low	30.8	Very low	176 Å²	176	128.6 Å²	128.6	82%	0.822	74%	0.742	S	S	*	*			trans	78.6	142.5	145.8	-92.4	179.1	-145.7	0	0	124.4
280	I	27.1	Very low	29.8	Very low	156 Å²	156	131.8 Å²	131.8	80%	0.8	75%	0.754	S	S	*	*			trans	74.7	136.3	161.4	-63.2	158.1	0	0	0	117.9
281	W	25.3	Very low	29.9	Very low	243 Å²	243	131.5 Å²	131.5	92%	0.92	76%	0.757	S	S	*	*			trans	-129.7	103.8	-175.1	179.6	-44.4	0	0	0	108.5
282	D	28.7	Very low	30.1	Very low	139 Å²	139	133.6 Å²	133.6	74%	0.743	77%	0.765	S	S	*	*			trans	-160.2	118	162.8	-171.7	15	0	0	0	111.5	G284	D282-G284 PolarHBondContact OD1-N 2.73Å
283	P	36.6	Very low	30.1	Very low	108 Å²	108	138.2 Å²	138.2	70%	0.701	78%	0.776	S	S	*	*			trans	-107.6	65.4	169.7	38.4	-29.1	0	0	0	111.6	L285	P283-L285 PolarHBondContact O-N 2.71Å; P283-L285 VanDerWaalsContact O-N 3.12Å
284	G	30	Very low	30.2	Very low	68 Å²	68	136.8 Å²	136.8	70%	0.701	78%	0.778	S	S	*	*			trans	-65.6	105.3	166.7	0	0	0	0	0	111.3	D282	D282-G284 PolarHBondContact OD1-N 2.73Å
285	L	32.6	Very low	30.5	Very low	168 Å²	168	142.2 Å²	142.2	88%	0.88	79%	0.794	S	S	*	*			trans	-120.9	118.5	173.7	-111	169.4	0	0	0	111	P283	P283-L285 PolarHBondContact O-N 2.71Å; P283-L285 VanDerWaalsContact O-N 3.12Å
286	D	32.9	Very low	30.6	Very low	99 Å²	99	138.8 Å²	138.8	53%	0.529	79%	0.793	S	S	.	*			trans	-67.5	125.1	-176.8	171.3	36.9	0	0	0	112.4	V288 S289	D286-V288 VanDerWaalsContact OD1-CB 3.24Å; D286-V288 WeakPolarHBondContact OD1-CB 3.37Å; D286-V288 VanDerWaalsContact OD1-CG2 3.3Å; D286-V288 WeakPolarHBondContact OD1-CG2 3.47Å; D286-V288 PolarHBondContact OD1-N 3.37Å; D286-S289 PolarHBondContact OD2-OG 2.91Å
287	L	29.9	Very low	30.7	Very low	161 Å²	161	141.2 Å²	141.2	84%	0.843	80%	0.796	S	S	*	*			trans	-107.7	16	176.4	-151.6	77.3	0	0	0	113.2
288	V	35.8	Very low	30.2	Very low	123 Å²	123	142.3 Å²	142.3	75%	0.745	80%	0.8	S	S	*	*	S	Bend	trans	-80.4	-25.8	174.6	-179.6	0	0	0	0	111.7	D286 L290	D286-V288 VanDerWaalsContact OD1-CB 3.24Å; D286-V288 WeakPolarHBondContact OD1-CB 3.37Å; D286-V288 VanDerWaalsContact OD1-CG2 3.3Å; D286-V288 WeakPolarHBondContact OD1-CG2 3.47Å; D286-V288 PolarHBondContact OD1-N 3.37Å; V288-L290 VanDerWaalsContact C-N 3.32Å; V288-L290 PolarHBondContact O-N 3.11Å; V288-L290 VanDerWaalsContact O-N 3.1Å
289	S	34.6	Very low	30.4	Very low	98 Å²	98	146.2 Å²	146.2	69%	0.685	80%	0.804	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	26	-168.4	-63.7	0	0	0	0	116.8	D286	D286-S289 PolarHBondContact OD2-OG 2.91Å
290	L	31.7	Very low	31.2	Very low	146 Å²	146	143 Å²	143	76%	0.764	80%	0.798	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.3	9.1	-174.7	-109.3	172.9	0	0	0	117.5	V288	V288-L290 VanDerWaalsContact C-N 3.32Å; V288-L290 PolarHBondContact O-N 3.11Å; V288-L290 VanDerWaalsContact O-N 3.1Å
291	L	30.6	Very low	31.2	Very low	170 Å²	170	146.4 Å²	146.4	89%	0.89	80%	0.801	S	S	*	*	S	Bend	trans	-131.4	32.9	-178.8	-74.1	177.1	0	0	0	115.1
292	C	30.6	Very low	31.5	Very low	124 Å²	124	143.4 Å²	143.4	84%	0.838	80%	0.797	S	S	*	*			trans	-135.6	92.8	172.5	-77.5	0	0	0	0	111.8
293	E	27.3	Very low	31.6	Very low	198 Å²	198	141.3 Å²	141.3	93%	0.925	79%	0.793	S	S	*	*			trans	170.4	101.7	144.5	-100.7	176.7	-155.4	0	0	110.9
294	A	28.4	Very low	31.3	Very low	105 Å²	105	147.4 Å²	147.4	87%	0.868	80%	0.802	S	S	*	*			trans	177.4	64.1	154.1	0	0	0	0	0	113.5
295	E	32.7	Very low	31.5	Very low	199 Å²	199	148.6 Å²	148.6	93%	0.93	81%	0.805	S	S	*	*			trans	-129	115.2	161	-80.7	-157.1	152.8	0	0	111.5
296	A	30.5	Very low	31.7	Very low	92 Å²	92	147.9 Å²	147.9	76%	0.76	80%	0.798	S	S	*	*			trans	-157.5	103.4	167.8	0	0	0	0	0	111.7
297	Q	29.5	Very low	32	Very low	187 Å²	187	148 Å²	148	87%	0.874	80%	0.804	S	S	*	*			trans	43.5	125.2	139.9	-50	178	7.5	0	0	118.1
298	T	28.9	Very low	32.6	Very low	139 Å²	139	146 Å²	146	85%	0.853	80%	0.8	S	S	*	*			cis	-154.3	174.1	45.9	45.3	0	0	0	0	114.9
299	Q	28.6	Very low	32.9	Very low	172 Å²	172	144.6 Å²	144.6	80%	0.804	79%	0.794	S	S	*	*			trans	-87.9	-179.6	-178.7	-68.1	-75.7	-12.3	0	0	113.2
300	P	43.5	Very low	33.4	Very low	108 Å²	108	148.3 Å²	148.3	70%	0.701	80%	0.797	S	S	*	*			cis	-135.4	162.2	-36.5	34	-18	0	0	0	114.3
301	W	25.8	Very low	34.2	Very low	228 Å²	228	142.5 Å²	142.5	86%	0.864	77%	0.773	S	S	*	*			trans	-158	163.4	138.5	85.9	-77.8	0	0	0	112.3
302	E	33.1	Very low	35	Very low	180 Å²	180	143.7 Å²	143.7	84%	0.841	77%	0.766	S	S	*	*			trans	-95.9	124	-164.4	-59.6	176.7	121.8	0	0	114.6
303	S	30.9	Very low	36	Very low	95 Å²	95	143.9 Å²	143.9	66%	0.664	75%	0.754	S	S	*	*			trans	-160.7	116.9	148	31.5	0	0	0	0	110.6	A305	S303-A305 PolarHBondContact O-N 2.88Å
304	R	29.3	Very low	37.1	Very low	236 Å²	236	138.8 Å²	138.8	89%	0.891	73%	0.729	S	S	*	*			trans	-83.5	79.3	-170.7	-169.1	178.8	-175.9	172.1	1.5	111.9
305	A	33.8	Very low	37.9	Very low	92 Å²	92	137 Å²	137	76%	0.76	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-63.9	137.1	166.3	0	0	0	0	0	110.7	S303	S303-A305 PolarHBondContact O-N 2.88Å
306	Q	37.3	Very low	39	Very low	154 Å²	154	130.1 Å²	130.1	72%	0.72	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-78.1	151.1	171.4	-63.9	-70.3	10.3	0	0	110.1
307	P	39.7	Very low	39.5	Very low	102 Å²	102	127.5 Å²	127.5	66%	0.662	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-63.1	150.3	169.6	29	-34.9	0	0	0	110.6
308	P	41.6	Very low	39.6	Very low	118 Å²	118	124.4 Å²	124.4	77%	0.766	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-62.5	136.6	178	26.3	-34.1	0	0	0	110.6
309	P	42.7	Very low	40.4	Very low	94 Å²	94	120.9 Å²	120.9	61%	0.61	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-67.5	136.8	-176.3	28.3	-35.2	0	0	0	111	G311 F325	P309-G311 PolarHBondContact O-N 3.18Å; P309-F325 HydrophobicContact CB-CE1 4.24Å; P309-F325 HydrophobicContact CB-CZ 3.84Å; P309-F325 HydrophobicContact CG-CE1 3.98Å; P309-F325 HydrophobicContact CG-CE2 4.46Å; P309-F325 HydrophobicContact CG-CZ 3.67Å
310	K	45	Very low	41.3	Very low	175 Å²	175	118.3 Å²	118.3	76%	0.761	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-71.7	124.7	171.2	-70.6	-178.5	178.3	178.2	0	108.8	S328	K310-S328 PolarHBondContact O-N 2.71Å; K310-S328 PolarHBondContact O-OG 2.75Å
311	G	48.3	Very low	41.1	Very low	24 Å²	24	121.5 Å²	121.5	25%	0.247	64%	0.641	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-177.9	159.8	-179.9	0	0	0	0	0	112.7	P309 H313 F325 C326	P309-G311 PolarHBondContact O-N 3.18Å; G311-H313 PolarHBondContact O-ND1 3.27Å; G311-F325 VanDerWaalsContact CA-CE2 3.46Å; G311-C326 CarbonylContact C-O 3.56Å; G311-C326 WeakPolarHBondContact CA-O 3.19Å
312	W	48.1	Very low	42.3	Very low	195 Å²	195	116.2 Å²	116.2	74%	0.739	63%	0.626	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-80.1	146.6	-180	-60.3	98.5	0	0	0	110.5	F325 C326	W312-F325 WeakPolarHBondContact O-CA 3.38Å; W312-C326 PolarHBondContact N-O 3.39Å; W312-C326 PolarHBondContact O-N 2.83Å
313	H	51.2	Low	42.9	Very low	129 Å²	129	112 Å²	112	60%	0.597	61%	0.612	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-119.8	125	174.4	-69.1	74.7	0	0	0	107.8	G311 V323 L324 F325	G311-H313 PolarHBondContact O-ND1 3.27Å; H313-V323 HydrophobicContact CB-CG1 3.86Å; H313-L324 WeakPolarHBondContact CA-O 3.4Å; H313-F325 AromaticContact CE1-CD2 3.39Å; H313-F325 WeakPolarHBondContact CE1-CD2 3.37Å; H313-F325 AromaticContact CE1-CE2 3.71Å; H313-F325 AromaticContact ND1-CD2 3.8Å; H313-F325 AromaticContact NE2-CD2 3.61Å
314	F	49.2	Very low	43.7	Very low	91 Å²	91	111.7 Å²	111.7	40%	0.399	60%	0.602	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.5	138.3	177.6	43.6	-102	0	0	0	111.8	I316 L324 C326	F314-I316 HydrophobicContact CD2-CG2 4.33Å; F314-L324 HydrophobicContact CD2-CB 3.98Å; F314-L324 HydrophobicContact CE2-CB 3.6Å; F314-L324 HydrophobicContact CE2-CD1 4.23Å; F314-L324 HydrophobicContact CZ-CB 4.31Å; F314-L324 PolarHBondContact N-O 2.9Å; F314-L324 PolarHBondContact O-N 2.91Å; F314-C326 HydrophobicContact CE1-CB 3.59Å; F314-C326 HydrophobicContact CZ-CB 3.97Å
315	P	46.5	Very low	45.3	Very low	67 Å²	67	104.2 Å²	104.2	44%	0.435	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-77.9	142.3	-177.1	31.1	-34.4	0	0	0	112.3	L320 E322	P315-L320 HydrophobicContact CB-CB 3.85Å; P315-L320 HydrophobicContact CB-CD2 4.21Å; P315-L320 HydrophobicContact CG-CB 4.24Å; P315-L320 HydrophobicContact CG-CD1 4.41Å; P315-L320 HydrophobicContact CG-CD2 4.15Å; P315-L320 HydrophobicContact CG-CG 4.49Å; P315-E322 CarbonylContact C-O 3.34Å; P315-E322 WeakPolarHBondContact CA-O 3.22Å
316	I	54.4	Low	45.9	Very low	55 Å²	55	102.4 Å²	102.4	28%	0.282	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-132	174.8	178.1	55	148.2	0	0	0	111.2	F314 K321 E322 L324	F314-I316 HydrophobicContact CD2-CG2 4.33Å; I316-K321 PolarHBondContact O-N 3.06Å; I316-E322 HydrophobicContact CD1-CB 4.27Å; I316-E322 HydrophobicContact CG1-CB 3.84Å; I316-E322 PolarHBondContact N-O 3.39Å; I316-E322 PolarHBondContact O-N 3.35Å; I316-L324 HydrophobicContact CD1-CD1 3.76Å; I316-L324 HydrophobicContact CD1-CG 3.81Å; I316-L324 HydrophobicContact CG1-CD1 4.38Å; I316-L324 HydrophobicContact CG1-CG 4.26Å; I316-L324 HydrophobicContact CG2-CD1 4.27Å
317	G	42	Very low	46.5	Very low	36 Å²	36	98.1 Å²	98.1	37%	0.371	54%	0.543	S	S	.	.	S	Bend	trans	78	171.5	176.8	0	0	0	0	0	114.9	G319 L320	G317-G319 PolarHBondContact O-N 3.04Å; G317-L320 PolarHBondContact O-N 2.85Å
318	P	30.6	Very low	46.8	Very low	122 Å²	122	96.1 Å²	96.1	79%	0.792	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	106.3	-175	-24.3	35.6	0	0	0	113
319	G	45.8	Very low	46.9	Very low	65 Å²	65	96.9 Å²	96.9	67%	0.67	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	83	27.1	-177.9	0	0	0	0	0	114.7	G317 K321	G317-G319 PolarHBondContact O-N 3.04Å; G319-K321 VanDerWaalsContact C-N 3.35Å; G319-K321 PolarHBondContact O-N 3.05Å
320	L	48.4	Very low	46.7	Very low	118 Å²	118	96.9 Å²	96.9	62%	0.618	54%	0.542	S	S	*	.	S	Bend	trans	61	37.1	168.3	-55.5	-175.8	0	0	0	114.1	P315 G317	P315-L320 HydrophobicContact CB-CB 3.85Å; P315-L320 HydrophobicContact CB-CD2 4.21Å; P315-L320 HydrophobicContact CG-CB 4.24Å; P315-L320 HydrophobicContact CG-CD1 4.41Å; P315-L320 HydrophobicContact CG-CD2 4.15Å; P315-L320 HydrophobicContact CG-CG 4.49Å; G317-L320 PolarHBondContact O-N 2.85Å
321	K	39.5	Very low	46.2	Very low	176 Å²	176	97.9 Å²	97.9	77%	0.765	55%	0.547	S	S	*	.			trans	-93.5	-22.4	-171.1	-64.7	-179	-177.8	174.3	0	114.7	I316 G319	I316-K321 PolarHBondContact O-N 3.06Å; G319-K321 VanDerWaalsContact C-N 3.35Å; G319-K321 PolarHBondContact O-N 3.05Å
322	E	49.9	Very low	45.8	Very low	117 Å²	117	102.6 Å²	102.6	55%	0.547	57%	0.574	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.8	155.9	176.5	-71.4	159.3	-150	0	0	108.2	P315 I316	P315-E322 CarbonylContact C-O 3.34Å; P315-E322 WeakPolarHBondContact CA-O 3.22Å; I316-E322 HydrophobicContact CD1-CB 4.27Å; I316-E322 HydrophobicContact CG1-CB 3.84Å; I316-E322 PolarHBondContact N-O 3.39Å; I316-E322 PolarHBondContact O-N 3.35Å
323	V	47.5	Very low	45.3	Very low	92 Å²	92	98.8 Å²	98.8	56%	0.558	58%	0.576	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-132.2	124.5	179.4	-180	0	0	0	0	108.9	H313	H313-V323 HydrophobicContact CB-CG1 3.86Å
324	L	46.5	Very low	44.5	Very low	87 Å²	87	101.2 Å²	101.2	46%	0.455	59%	0.59	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.7	143	170.2	-95.5	172.5	0	0	0	110.4	H313 F314 I316	H313-L324 WeakPolarHBondContact CA-O 3.4Å; F314-L324 HydrophobicContact CD2-CB 3.98Å; F314-L324 HydrophobicContact CE2-CB 3.6Å; F314-L324 HydrophobicContact CE2-CD1 4.23Å; F314-L324 HydrophobicContact CZ-CB 4.31Å; F314-L324 PolarHBondContact N-O 2.9Å; F314-L324 PolarHBondContact O-N 2.91Å; I316-L324 HydrophobicContact CD1-CD1 3.76Å; I316-L324 HydrophobicContact CD1-CG 3.81Å; I316-L324 HydrophobicContact CG1-CD1 4.38Å; I316-L324 HydrophobicContact CG1-CG 4.26Å; I316-L324 HydrophobicContact CG2-CD1 4.27Å
325	F	62.7	Low	43.6	Very low	79 Å²	79	101.2 Å²	101.2	35%	0.346	60%	0.602	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.2	137.6	170.8	177	-105.2	0	0	0	109.6	P309 G311 W312 H313 P327	P309-F325 HydrophobicContact CB-CE1 4.24Å; P309-F325 HydrophobicContact CB-CZ 3.84Å; P309-F325 HydrophobicContact CG-CE1 3.98Å; P309-F325 HydrophobicContact CG-CE2 4.46Å; P309-F325 HydrophobicContact CG-CZ 3.67Å; G311-F325 VanDerWaalsContact CA-CE2 3.46Å; W312-F325 WeakPolarHBondContact O-CA 3.38Å; H313-F325 AromaticContact CE1-CD2 3.39Å; H313-F325 WeakPolarHBondContact CE1-CD2 3.37Å; H313-F325 AromaticContact CE1-CE2 3.71Å; H313-F325 AromaticContact ND1-CD2 3.8Å; H313-F325 AromaticContact NE2-CD2 3.61Å; F325-P327 HydrophobicContact CE1-CB 4.12Å
326	C	46.5	Very low	43.2	Very low	55 Å²	55	107.9 Å²	107.9	37%	0.372	62%	0.619	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-130.8	114.7	175	-175.4	0	0	0	0	108.8	G311 W312 F314	G311-C326 CarbonylContact C-O 3.56Å; G311-C326 WeakPolarHBondContact CA-O 3.19Å; W312-C326 PolarHBondContact N-O 3.39Å; W312-C326 PolarHBondContact O-N 2.83Å; F314-C326 HydrophobicContact CE1-CB 3.59Å; F314-C326 HydrophobicContact CZ-CB 3.97Å
327	P	51.1	Low	42.1	Very low	63 Å²	63	114.4 Å²	114.4	41%	0.409	64%	0.642	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-63	147.9	-178.4	27.2	-34.3	0	0	0	111.4	F325 T329	F325-P327 HydrophobicContact CE1-CB 4.12Å; P327-T329 PolarHBondContact O-N 3.32Å
328	S	45.7	Very low	41.9	Very low	61 Å²	61	118.7 Å²	118.7	43%	0.427	66%	0.663	S	S	.	*			trans	-79.9	108.4	177.6	62.9	0	0	0	0	111	K310 A330	K310-S328 PolarHBondContact O-N 2.71Å; K310-S328 PolarHBondContact O-OG 2.75Å; S328-A330 PolarHBondContact O-N 3.08Å
329	T	42.7	Very low	42.1	Very low	133 Å²	133	120.8 Å²	120.8	82%	0.816	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-59.4	130.6	163.7	33.4	0	0	0	0	110	P327	P327-T329 PolarHBondContact O-N 3.32Å
330	A	38.2	Very low	41.7	Very low	95 Å²	95	122.7 Å²	122.7	79%	0.785	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-98.7	121.6	177.1	0	0	0	0	0	109.3	S328	S328-A330 PolarHBondContact O-N 3.08Å
331	F	34.9	Very low	41.5	Very low	195 Å²	195	125.4 Å²	125.4	86%	0.855	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-64.3	134.5	171.3	-65.6	-84.3	0	0	0	110	S333	F331-S333 PolarHBondContact O-N 2.96Å
332	P	40.7	Very low	41.5	Very low	124 Å²	124	125 Å²	125	81%	0.805	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-67.8	124.2	177.7	27.2	-33.5	0	0	0	110.6	M334	P332-M334 PolarHBondContact O-N 2.93Å
333	S	36.2	Very low	41.3	Very low	114 Å²	114	131.4 Å²	131.4	80%	0.797	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-68.6	119	172.4	54.9	0	0	0	0	110.2	F331 S335	F331-S333 PolarHBondContact O-N 2.96Å; S333-S335 PolarHBondContact O-N 3.2Å
334	M	34.4	Very low	41.1	Very low	180 Å²	180	135.7 Å²	135.7	89%	0.887	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-53	121.6	176	-88.3	-167.7	166.5	0	0	111.9	P332	P332-M334 PolarHBondContact O-N 2.93Å
335	S	32.1	Very low	40.8	Very low	92 Å²	92	137.7 Å²	137.7	64%	0.643	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-98.1	127.1	162.1	-175.1	0	0	0	0	108.9	S333 Y337	S333-S335 PolarHBondContact O-N 3.2Å; S335-Y337 VanDerWaalsContact C-N 3.33Å; S335-Y337 PolarHBondContact O-N 3.34Å
336	Y	37	Very low	39.9	Very low	206 Å²	206	142.7 Å²	142.7	81%	0.808	75%	0.751	S	S	*	*	S	Bend	trans	-92.6	17.1	-170.1	-136.1	-89.4	0	0	0	114.1
337	Y	32.3	Very low	39.9	Very low	192 Å²	192	148.5 Å²	148.5	75%	0.753	77%	0.773	S	S	*	*	S	Bend	trans	-136.7	130.3	177.3	-75.6	-81.8	0	0	0	110.9	S335 H339	S335-Y337 VanDerWaalsContact C-N 3.33Å; S335-Y337 PolarHBondContact O-N 3.34Å; Y337-H339 PolarHBondContact O-N 3.03Å
338	P	36.5	Very low	40	Very low	126 Å²	126	149.6 Å²	149.6	82%	0.818	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-70.8	121.2	174.1	29.2	-32.7	0	0	0	109.5
339	H	34.7	Very low	40.8	Very low	167 Å²	167	148 Å²	148	77%	0.773	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-67.7	146.4	163.3	-82.4	-97.7	0	0	0	109.4	Y337	Y337-H339 PolarHBondContact O-N 3.03Å
340	S	38.4	Very low	42.3	Very low	105 Å²	105	149 Å²	149	73%	0.734	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-57.2	136	-174.8	47.8	0	0	0	0	112.2	E342	S340-E342 PolarHBondContact O-N 3.25Å
341	L	44	Very low	44.9	Very low	174 Å²	174	145.5 Å²	145.5	91%	0.911	72%	0.721	S	S	*	*			trans	-58.4	101.3	174.8	-75.1	87.9	0	0	0	111.2
342	E	40.3	Very low	47.6	Very low	169 Å²	169	140.4 Å²	140.4	79%	0.79	71%	0.706	S	S	*	*			trans	-66.6	147	143.3	-61.3	-164.2	156.8	0	0	107.9	S340 E344	S340-E342 PolarHBondContact O-N 3.25Å; E342-E344 VanDerWaalsContact C-N 3.32Å; E342-E344 PolarHBondContact O-N 3.45Å
343	R	44.9	Very low	50.2	Low	251 Å²	251	138.3 Å²	138.3	95%	0.947	68%	0.682	S	S	*	*			trans	-77.9	89.1	175.8	-78.2	-176.1	176.6	171.7	-1.8	108.8	T345	R343-T345 PolarHBondContact O-N 3.22Å
344	E	43.4	Very low	52.9	Low	182 Å²	182	134.8 Å²	134.8	85%	0.85	65%	0.653	S	S	*	*			trans	-52.2	129.9	168.1	-66.3	-176.1	156.9	0	0	109.6	E342 F346	E342-E344 VanDerWaalsContact C-N 3.32Å; E342-E344 PolarHBondContact O-N 3.45Å; E344-F346 PolarHBondContact O-N 3.01Å
345	T	39.6	Very low	55.7	Low	129 Å²	129	130.9 Å²	130.9	79%	0.791	63%	0.633	S	S	*	*			trans	-67.7	114.8	171	47.1	0	0	0	0	107.8	R343 Q347	R343-T345 PolarHBondContact O-N 3.22Å; T345-Q347 PolarHBondContact O-N 2.89Å
346	F	43.7	Very low	58.4	Low	183 Å²	183	130 Å²	130	80%	0.803	62%	0.62	S	S	*	*			trans	-53	107.3	177.5	65.7	-82.6	0	0	0	110	E344 V348	E344-F346 PolarHBondContact O-N 3.01Å; F346-V348 HydrophobicContact CD2-CG2 3.94Å; F346-V348 HydrophobicContact CE2-CG2 3.87Å; F346-V348 PolarHBondContact O-N 2.88Å
347	Q	45.9	Very low	59.8	Low	178 Å²	178	122.5 Å²	122.5	83%	0.832	60%	0.598	S	S	*	*			trans	-81.2	118.3	178	-166.1	168.5	21.7	0	0	107.1	T345 V349	T345-Q347 PolarHBondContact O-N 2.89Å; Q347-V349 PolarHBondContact O-N 3.44Å
348	V	53.7	Low	60.7	Low	85 Å²	85	121.8 Å²	121.8	52%	0.515	60%	0.601	S	S	.	*			trans	-79.9	91.8	-170.2	-155	0	0	0	0	109.4	F346 W350	F346-V348 HydrophobicContact CD2-CG2 3.94Å; F346-V348 HydrophobicContact CE2-CG2 3.87Å; F346-V348 PolarHBondContact O-N 2.88Å; V348-W350 HydrophobicContact CG1-CD2 4.5Å; V348-W350 HydrophobicContact CG1-CZ2 4.14Å; V348-W350 PolarHBondContact O-N 3.36Å; V348-W350 VanDerWaalsContact O-N 3.1Å
349	V	64	Low	60.7	Low	27 Å²	27	121.7 Å²	121.7	16%	0.164	60%	0.598	C	S	.	*			trans	-66.3	104.4	177.9	-178.9	0	0	0	0	109.2	Q347 L769 D773 M777	Q347-V349 PolarHBondContact O-N 3.44Å; V349-L769 HydrophobicContact CG1-CD1 3.73Å; V349-L769 HydrophobicContact CG1-CD2 3.65Å; V349-L769 HydrophobicContact CG1-CG 4.34Å; V349-D773 HydrophobicContact CG1-CB 4.1Å; V349-D773 HydrophobicContact CG2-CB 4.44Å; V349-M777 HydrophobicContact CB-CE 4.49Å; V349-M777 HydrophobicContact CB-SD 4.2Å; V349-M777 HydrophobicContact CG1-CE 3.9Å; V349-M777 HydrophobicContact CG1-SD 4.21Å
350	W	73.5	Confident	60.9	Low	156 Å²	156	123.1 Å²	123.1	59%	0.591	61%	0.605	S	S	*	*			trans	-121.9	145.9	171.8	-69.4	121.6	0	0	0	110.2	V348 M784	V348-W350 HydrophobicContact CG1-CD2 4.5Å; V348-W350 HydrophobicContact CG1-CZ2 4.14Å; V348-W350 PolarHBondContact O-N 3.36Å; V348-W350 VanDerWaalsContact O-N 3.1Å; W350-M784 HydrophobicContact CZ3-SD 4.24Å
351	R	91.8	Very high	60.6	Low	20 Å²	20	124.1 Å²	124.1	8%	0.075	61%	0.607	C	S	.	*			trans	-75.4	125	164.7	-59.1	-175.2	63.7	-154.4	-2.4	108.9	E419 L766 S767 L769 F785 S791	R351-E419 IonicContact NH1-OE1 3.26Å; R351-L766 HydrophobicContact CB-CD1 3.76Å; R351-L766 HydrophobicContact CB-CG 4.08Å; R351-S767 PolarHBondContact NE-O 3.1Å; R351-S767 PolarHBondContact NH2-O 3.19Å; R351-L769 HydrophobicContact CG-CD1 4.03Å; R351-L769 HydrophobicContact CG-CD2 4.32Å; R351-L769 HydrophobicContact CG-CG 3.96Å; R351-F785 HydrophobicContact CG-CZ 4.34Å; R351-S791 PolarHBondContact NH1-O 3.22Å; R351-S791 PolarHBondContact NH1-OG 3.33Å; R351-S791 PolarHBondContact NH2-O 3.32Å
352	V	91.8	Very high	60.1	Low	88 Å²	88	119.5 Å²	119.5	53%	0.533	59%	0.594	S	S	.	*			trans	-111.7	147.4	-170.8	-178.8	0	0	0	0	110.2	E354 S767	V352-E354 PolarHBondContact O-N 3.34Å; V352-S767 PolarHBondContact N-OG 2.75Å; V352-S767 WeakPolarHBondContact O-CB 3.47Å; V352-S767 PolarHBondContact O-N 3.26Å
353	W	95.3	Very high	59.9	Low	81 Å²	81	117.5 Å²	117.5	31%	0.307	60%	0.596	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.5	113.3	172.1	-171.3	-98.5	0	0	0	110.8	E355 L766 L793 K795	W353-E355 PolarHBondContact NE1-OE1 3.16Å; W353-L766 HydrophobicContact CE3-CB 4.28Å; W353-L766 HydrophobicContact CZ3-CB 4.35Å; W353-L793 HydrophobicContact CZ3-CD2 3.94Å; W353-L793 HydrophobicContact CZ3-CG 4.01Å; W353-K795 HydrophobicContact CH2-CB 3.67Å; W353-K795 HydrophobicContact CZ2-CB 3.52Å; W353-K795 HydrophobicContact CZ2-CD 4.22Å; W353-K795 HydrophobicContact CZ2-CG 4.5Å
354	E	93.4	Very high	59.5	Low	40 Å²	40	113.3 Å²	113.3	19%	0.187	59%	0.587	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.1	110.2	174.4	-62.9	-178.4	177	0	0	109.6	V352 L356 G764 R765 S767	V352-E354 PolarHBondContact O-N 3.34Å; E354-L356 HydrophobicContact CB-CD2 4.46Å; E354-L356 PolarHBondContact O-N 3.42Å; E354-G764 CarbonylContact O-C 3.56Å; E354-G764 WeakPolarHBondContact O-CA 3.43Å; E354-R765 HydrophobicContact CB-CG 4.18Å; E354-R765 PolarHBondContact N-O 3.1Å; E354-R765 PolarHBondContact O-N 3.35Å; E354-R765 IonicContact OE1-NH2 3.1Å; E354-R765 IonicContact OE2-CZ 3.91Å; E354-R765 IonicContact OE2-NE 3.12Å; E354-R765 PolarHBondContact OE2-NE 2.69Å; E354-R765 IonicContact OE2-NH2 2.76Å; E354-R765 PolarHBondContact OE2-NH2 2.69Å; E354-S767 WeakPolarHBondContact OE1-CB 3.27Å
355	E	92.9	Very high	59.3	Low	98 Å²	98	109.9 Å²	109.9	46%	0.458	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.8	119.7	164.7	-84.1	-61.9	139.7	0	0	110	W353 S357	W353-E355 PolarHBondContact NE1-OE1 3.16Å; E355-S357 PolarHBondContact OE2-OG 2.61Å
356	L	88.4	Confident	59.6	Low	73 Å²	73	112.3 Å²	112.3	38%	0.382	59%	0.588	S	S	.	*			trans	-103.3	8.9	179.5	-57.8	174.3	0	0	0	111.4	E354 L762 L763 R765	E354-L356 HydrophobicContact CB-CD2 4.46Å; E354-L356 PolarHBondContact O-N 3.42Å; L356-L762 HydrophobicContact CD1-CD2 3.59Å; L356-L762 HydrophobicContact CD1-CG 3.98Å; L356-L763 CarbonylContact C-O 3.59Å; L356-L763 WeakPolarHBondContact CA-O 3.41Å; L356-L763 WeakPolarHBondContact CB-O 3.22Å; L356-L763 PolarHBondContact N-O 3.07Å; L356-R765 HydrophobicContact CD1-CG 4.08Å
357	S	67.4	Low	59.7	Low	48 Å²	48	111.8 Å²	111.8	34%	0.336	59%	0.588	S	S	.	*			trans	-91.1	-6.2	-167.7	63.4	0	0	0	0	114.7	E355 L763	E355-S357 PolarHBondContact OE2-OG 2.61Å; S357-L763 PolarHBondContact N-O 3.39Å
358	E	51.4	Low	59.5	Low	178 Å²	178	114.7 Å²	114.7	83%	0.832	59%	0.591	S	S	*	*			trans	-116.9	86.2	-176.9	-64	-160.8	154.7	0	0	114.6
359	T	37	Very low	58.8	Low	123 Å²	123	116.2 Å²	116.2	76%	0.755	60%	0.602	S	S	*	*	S	Bend	trans	-137.3	112	154.8	56.8	0	0	0	0	111.8	T361	T359-T361 PolarHBondContact O-N 2.88Å; T359-T361 VanDerWaalsContact O-N 3.12Å
360	H	37.9	Very low	58	Low	198 Å²	198	120.3 Å²	120.3	92%	0.917	63%	0.63	S	S	*	*			trans	11.2	78.8	164.7	-57.1	-67.7	0	0	0	118.5	A362	H360-A362 PolarHBondContact O-N 2.83Å
361	T	32.1	Very low	57.1	Low	126 Å²	126	116.4 Å²	116.4	77%	0.773	63%	0.626	S	S	*	*			trans	-80.3	110.6	148.5	-48.4	0	0	0	0	107.3	T359	T359-T361 PolarHBondContact O-N 2.88Å; T359-T361 VanDerWaalsContact O-N 3.12Å
362	A	33	Very low	55.3	Low	77 Å²	77	123.8 Å²	123.8	64%	0.636	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-58.6	145.7	167.2	0	0	0	0	0	109	H360 E364	H360-A362 PolarHBondContact O-N 2.83Å; A362-E364 PolarHBondContact O-N 3.48Å; A362-E364 VanDerWaalsContact O-N 3.08Å
363	P	36.5	Very low	53.7	Low	127 Å²	127	125.5 Å²	125.5	83%	0.825	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-57.5	119.6	-174.2	23	-33.8	0	0	0	110.7
364	E	36.5	Very low	52.4	Low	163 Å²	163	124.9 Å²	124.9	76%	0.762	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-58.4	137.2	175	-79.3	-160	134.7	0	0	109.7	A362 L366	A362-E364 PolarHBondContact O-N 3.48Å; A362-E364 VanDerWaalsContact O-N 3.08Å; E364-L366 PolarHBondContact O-N 2.81Å
365	P	39	Very low	51.8	Low	110 Å²	110	125.5 Å²	125.5	71%	0.714	68%	0.68	S	S	*	*			trans	-66.2	108.9	179.4	26.6	-33.4	0	0	0	109.9	Q367	P365-Q367 PolarHBondContact O-N 2.8Å
366	L	46.5	Very low	51.6	Low	180 Å²	180	125.4 Å²	125.4	94%	0.942	68%	0.682	S	S	*	*			trans	-40.5	103.8	-177.8	-69.9	166.1	0	0	0	113.3	E364	E364-L366 PolarHBondContact O-N 2.81Å
367	Q	45.8	Very low	51.8	Low	172 Å²	172	122.2 Å²	122.2	80%	0.804	67%	0.665	S	S	*	*			trans	-131.1	110	170.8	-69.5	-160.3	16.4	0	0	112.2	P365	P365-Q367 PolarHBondContact O-N 2.8Å
368	R	41.3	Very low	53.2	Low	238 Å²	238	122.3 Å²	122.3	90%	0.898	66%	0.661	S	S	*	*	S	Bend	trans	73.2	145.3	-176.9	-58	-178.5	-179.2	158.3	3.3	114.7
369	P	40	Very low	55.4	Low	117 Å²	117	113.9 Å²	113.9	76%	0.76	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-65	143.7	170.6	29.2	-34.9	0	0	0	109.6	S371	P369-S371 PolarHBondContact O-N 3Å
370	P	46.6	Very low	58.4	Low	113 Å²	113	109.1 Å²	109.1	73%	0.734	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-58.8	135.5	167.7	-21.4	33	0	0	0	110.4
371	S	54.2	Low	61.3	Low	74 Å²	74	99.7 Å²	99.7	52%	0.517	55%	0.549	S	S	.	.	S	Bend	trans	-55.5	144.4	143.5	51.9	0	0	0	0	108.2	P369 Q754	P369-S371 PolarHBondContact O-N 3Å; S371-Q754 VanDerWaalsContact CB-NE2 3.29Å; S371-Q754 PolarHBondContact OG-NE2 2.85Å
372	E	53.6	Low	64.5	Low	175 Å²	175	93.7 Å²	93.7	82%	0.818	51%	0.512	S	S	*	.			trans	-43	139	-166.1	-63.6	-169.7	162.8	0	0	114.6	R374	E372-R374 PolarHBondContact O-N 2.88Å
373	P	58.6	Low	67.6	Low	124 Å²	124	90 Å²	90	81%	0.805	48%	0.482	S	S	*	.			trans	-60.9	113.9	-176.5	26	-34.1	0	0	0	109.8
374	R	68	Low	70.6	Confident	68 Å²	68	84 Å²	84	26%	0.257	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-59	139.4	177.6	-64.5	179.4	179.3	-129.4	-3.2	109.5	E372 L376 N801	E372-R374 PolarHBondContact O-N 2.88Å; R374-L376 PolarHBondContact O-N 3.35Å; R374-N801 PolarHBondContact NH1-OD1 2.89Å
375	P	80.8	Confident	73.5	Confident	54 Å²	54	76.2 Å²	76.2	35%	0.351	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-59.7	130.3	174.8	17.3	-22.6	0	0	0	109.9	A516 L800	P375-A516 HydrophobicContact CG-CB 4.37Å; P375-L800 HydrophobicContact CB-CD1 4.33Å; P375-L800 HydrophobicContact CG-CB 4.12Å; P375-L800 VanDerWaalsContact O-CB 3.3Å; P375-L800 WeakPolarHBondContact O-CB 3.47Å; P375-L800 PolarHBondContact O-N 3.41Å
376	L	88.9	Confident	76.4	Confident	95 Å²	95	71 Å²	71	50%	0.497	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	147.1	176	-64.4	172.9	0	0	0	109.3	R374 Q797	R374-L376 PolarHBondContact O-N 3.35Å; L376-Q797 HydrophobicContact CB-CG 4.48Å; L376-Q797 HydrophobicContact CD2-CG 4.39Å
377	F	93.3	Very high	78.9	Confident	6 Å²	6	62.5 Å²	62.5	3%	0.026	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	103.4	175.8	-175.1	-91.1	0	0	0	109.5	F379 R474 F475 P506 I507 I508 Q797 L798 L800	F377-F379 HydrophobicContact CD1-CB 4.2Å; F377-F379 AromaticContact CD1-CD1 3.79Å; F377-F379 HydrophobicContact CD1-CD1 3.79Å; F377-F379 HydrophobicContact CD1-CG 4.33Å; F377-F379 HydrophobicContact CE1-CB 3.74Å; F377-F379 AromaticContact CE1-CD1 3.9Å; F377-F379 HydrophobicContact CE1-CD1 3.9Å; F377-F379 HydrophobicContact CE1-CG 4.01Å; F377-R474 HydrophobicContact CZ-CB 4.29Å; F377-F475 AromaticContact CE1-CE1 3.85Å; F377-F475 HydrophobicContact CE1-CE1 3.85Å; F377-F475 HydrophobicContact CE1-CE2 4.24Å; F377-F475 AromaticContact CE1-CZ 3.54Å; F377-F475 HydrophobicContact CE1-CZ 3.54Å; F377-F475 HydrophobicContact CZ-CE1 4.13Å; F377-F475 HydrophobicContact CZ-CE2 4.06Å; F377-F475 AromaticContact CZ-CZ 3.78Å; F377-F475 HydrophobicContact CZ-CZ 3.78Å; F377-P506 HydrophobicContact CD1-CB 4.13Å; F377-P506 HydrophobicContact CE1-CB 3.87Å; F377-P506 HydrophobicContact CE2-CB 4.39Å; F377-P506 HydrophobicContact CG-CB 4.5Å; F377-P506 HydrophobicContact CZ-CB 4Å; F377-I507 WeakPolarHBondContact CE2-O 3.48Å; F377-I508 HydrophobicContact CD2-CG1 4.35Å; F377-Q797 WeakPolarHBondContact O-CA 3.45Å; F377-L798 HydrophobicContact CB-CD1 3.8Å; F377-L798 HydrophobicContact CB-CG 4.32Å; F377-L798 HydrophobicContact CD1-CD1 4.28Å; F377-L798 HydrophobicContact CD1-CG 4.3Å; F377-L798 HydrophobicContact CG-CD1 4.4Å; F377-L798 PolarHBondContact N-O 3.03Å; F377-L798 PolarHBondContact O-N 3.07Å; F377-L800 HydrophobicContact CB-CD1 3.94Å; F377-L800 HydrophobicContact CB-CD2 3.65Å; F377-L800 HydrophobicContact CB-CG 3.71Å; F377-L800 HydrophobicContact CD2-CD1 4.23Å; F377-L800 HydrophobicContact CD2-CD2 4.31Å; F377-L800 HydrophobicContact CG-CD2 4.1Å
378	D	96.2	Very high	81.4	Confident	50 Å²	50	54.4 Å²	54.4	27%	0.267	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	131	171.6	-81.3	22.6	0	0	0	109.3	R474 L763 K795 F796 Q797	D378-R474 PolarHBondContact O-NH2 3.48Å; D378-L763 WeakPolarHBondContact OD2-CD1 3.31Å; D378-K795 WeakPolarHBondContact OD2-CE 3.41Å; D378-K795 IonicContact OD2-NZ 2.69Å; D378-K795 PolarHBondContact OD2-NZ 3.37Å; D378-F796 CarbonylContact C-O 3.58Å; D378-F796 VanDerWaalsContact CA-O 3.28Å; D378-F796 WeakPolarHBondContact CA-O 3.42Å; D378-Q797 WeakPolarHBondContact OD1-CG 3.3Å; D378-Q797 PolarHBondContact OD1-NE2 3.1Å
379	F	98.2	Very high	84.1	Confident	1 Å²	1	43.7 Å²	43.7	0%	0.004	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	152.5	176	69.2	-78.4	0	0	0	113	F377 V381 D426 I427 F475 L521 L760 K795 F796 L798	F377-F379 HydrophobicContact CD1-CB 4.2Å; F377-F379 AromaticContact CD1-CD1 3.79Å; F377-F379 HydrophobicContact CD1-CD1 3.79Å; F377-F379 HydrophobicContact CD1-CG 4.33Å; F377-F379 HydrophobicContact CE1-CB 3.74Å; F377-F379 AromaticContact CE1-CD1 3.9Å; F377-F379 HydrophobicContact CE1-CD1 3.9Å; F377-F379 HydrophobicContact CE1-CG 4.01Å; F379-V381 HydrophobicContact CD2-CG2 3.9Å; F379-V381 HydrophobicContact CE2-CG2 3.64Å; F379-D426 WeakPolarHBondContact CA-OD2 3.38Å; F379-D426 HydrophobicContact CB-CB 4.31Å; F379-D426 WeakPolarHBondContact CB-OD2 3.34Å; F379-I427 HydrophobicContact CD2-CD1 4.09Å; F379-I427 HydrophobicContact CE2-CD1 4.16Å; F379-F475 HydrophobicContact CB-CZ 4.01Å; F379-F475 AromaticContact CD2-CZ 3.92Å; F379-F475 HydrophobicContact CD2-CZ 3.92Å; F379-F475 AromaticContact CG-CZ 3.98Å; F379-F475 HydrophobicContact CG-CZ 3.98Å; F379-L521 HydrophobicContact CD2-CD2 4.48Å; F379-L521 HydrophobicContact CE2-CD2 3.65Å; F379-L521 HydrophobicContact CZ-CD1 4.29Å; F379-L521 HydrophobicContact CZ-CD2 3.73Å; F379-L760 HydrophobicContact CE1-CD2 4.07Å; F379-L760 HydrophobicContact CZ-CD1 3.99Å; F379-L760 HydrophobicContact CZ-CD2 4.08Å; F379-K795 CarbonylContact O-C 3.58Å; F379-K795 WeakPolarHBondContact O-CA 3.47Å; F379-F796 HydrophobicContact CD1-CB 4.2Å; F379-F796 HydrophobicContact CE1-CB 3.68Å; F379-F796 HydrophobicContact CE2-CB 4.26Å; F379-F796 HydrophobicContact CE2-CD2 4.23Å; F379-F796 HydrophobicContact CZ-CB 3.72Å; F379-F796 HydrophobicContact CZ-CD2 4.35Å; F379-F796 HydrophobicContact CZ-CG 4.35Å; F379-F796 PolarHBondContact N-O 3.03Å; F379-F796 PolarHBondContact O-N 3.14Å; F379-L798 HydrophobicContact CE1-CD2 3.84Å; F379-L798 HydrophobicContact CE1-CG 4.3Å
380	T	98.8	Very high	86.9	Confident	23 Å²	23	41.1 Å²	41.1	14%	0.141	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	147	177.2	43.7	0	0	0	0	112.4	P425 D426 I427 A794 K795	T380-P425 WeakPolarHBondContact OG1-CA 3.18Å; T380-D426 PolarHBondContact N-OD2 3.25Å; T380-D426 WeakPolarHBondContact O-CB 3.16Å; T380-D426 PolarHBondContact O-N 3.45Å; T380-D426 PolarHBondContact OG1-N 3.16Å; T380-D426 PolarHBondContact OG1-OD2 3.45Å; T380-I427 PolarHBondContact O-N 2.81Å; T380-I427 VanDerWaalsContact O-N 3.13Å; T380-A794 CarbonylContact C-O 3.39Å; T380-A794 WeakPolarHBondContact CA-O 3.37Å; T380-K795 HydrophobicContact CG2-CB 3.98Å; T380-K795 HydrophobicContact CG2-CG 4.09Å
381	V	98.9	Very high	89.3	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	127	171.7	-172.6	0	0	0	0	109	F379 I427 V566 I736 L793 A794 F796	F379-V381 HydrophobicContact CD2-CG2 3.9Å; F379-V381 HydrophobicContact CE2-CG2 3.64Å; V381-I427 CarbonylContact C-O 3.49Å; V381-I427 WeakPolarHBondContact CA-O 3.27Å; V381-I427 HydrophobicContact CG1-CB 4.26Å; V381-I427 HydrophobicContact CG1-CG2 4.18Å; V381-I427 HydrophobicContact CG2-CB 4.24Å; V381-I427 HydrophobicContact CG2-CD1 4.26Å; V381-V566 HydrophobicContact CG1-CG1 4.16Å; V381-V566 HydrophobicContact CG2-CG1 4.46Å; V381-I736 WeakPolarHBondContact O-CD1 3.45Å; V381-L793 WeakPolarHBondContact O-CA 3.47Å; V381-A794 PolarHBondContact N-O 3.43Å; V381-A794 PolarHBondContact O-N 3.28Å; V381-F796 HydrophobicContact CB-CE2 4.27Å; V381-F796 HydrophobicContact CG2-CD2 3.98Å; V381-F796 HydrophobicContact CG2-CE2 4.06Å
382	M	98.9	Very high	91.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	141	170.3	-175.2	176.2	-79.9	0	0	110.7	Y384 F420 W423 P425 I427 L428 C429 L792 L793	M382-Y384 HydrophobicContact SD-CD1 4.47Å; M382-F420 HydrophobicContact SD-CD1 3.86Å; M382-F420 HydrophobicContact SD-CE1 3.89Å; M382-W423 HydrophobicContact CE-CB 4.01Å; M382-W423 HydrophobicContact CE-CG 4.22Å; M382-P425 HydrophobicContact CB-CB 3.69Å; M382-P425 HydrophobicContact CB-CG 3.97Å; M382-P425 HydrophobicContact CE-CB 4.47Å; M382-P425 HydrophobicContact CE-CG 4.02Å; M382-P425 HydrophobicContact SD-CG 4.15Å; M382-I427 PolarHBondContact N-O 3.46Å; M382-L428 HydrophobicContact CB-CD2 4.17Å; M382-L428 HydrophobicContact CG-CD2 4.36Å; M382-L428 HydrophobicContact SD-CD2 3.72Å; M382-C429 PolarHBondContact O-N 2.96Å; M382-L792 CarbonylContact C-O 3.47Å; M382-L792 WeakPolarHBondContact CA-O 3.35Å; M382-L792 WeakPolarHBondContact CG-O 3.31Å; M382-L793 HydrophobicContact CB-CD1 4.03Å; M382-L793 HydrophobicContact CE-CD1 4.34Å
383	S	98.9	Very high	93.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	128.9	164.8	-167.1	0	0	0	0	109	C429 G569 L792	S383-C429 VanDerWaalsContact CA-O 3.28Å; S383-C429 WeakPolarHBondContact CA-O 3.47Å; S383-G569 PolarHBondContact OG-N 2.57Å; S383-L792 PolarHBondContact N-O 3.42Å; S383-L792 PolarHBondContact O-N 3.5Å
384	Y	98.9	Very high	95.3	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	117.8	-174.3	-163.9	-174.2	0	0	0	112.7	M382 I386 L416 E419 F420 C429 L430 Q431 S787 H789	M382-Y384 HydrophobicContact SD-CD1 4.47Å; Y384-I386 HydrophobicContact CD1-CG2 4.05Å; Y384-I386 HydrophobicContact CG-CG2 4.1Å; Y384-I386 PolarHBondContact O-N 3.44Å; Y384-L416 HydrophobicContact CD1-CD2 4.31Å; Y384-L416 HydrophobicContact CE1-CD2 3.59Å; Y384-E419 WeakPolarHBondContact CE1-OE2 3.38Å; Y384-F420 HydrophobicContact CD1-CE1 4.18Å; Y384-C429 PolarHBondContact N-O 2.86Å; Y384-L430 VanDerWaalsContact O-CA 3.29Å; Y384-L430 WeakPolarHBondContact O-CA 3.49Å; Y384-Q431 PolarHBondContact O-N 2.82Å; Y384-Q431 PolarHBondContact O-OE1 3.32Å; Y384-S787 WeakPolarHBondContact OH-CB 3.39Å; Y384-H789 HydrophobicContact CE2-CB 4.35Å; Y384-H789 VanDerWaalsContact CE2-O 3.28Å; Y384-H789 WeakPolarHBondContact CE2-O 3.46Å
385	N	98.9	Very high	96.7	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	118	159.1	-174	-5.7	0	0	0	109.3	L387 Q431 E432 S787 H789	N385-L387 PolarHBondContact OD1-N 3.23Å; N385-Q431 HydrophobicContact CB-CB 4.05Å; N385-Q431 PolarHBondContact OD1-O 2.86Å; N385-E432 PolarHBondContact ND2-OE1 2.88Å; N385-E432 WeakPolarHBondContact OD1-CB 3.35Å; N385-E432 VanDerWaalsContact OD1-CD 3.24Å; N385-E432 WeakPolarHBondContact OD1-CG 3.35Å; N385-S787 WeakPolarHBondContact O-CB 3.29Å; N385-S787 PolarHBondContact O-OG 3.28Å; N385-H789 HydrophobicContact CB-CB 4.01Å; N385-H789 PolarHBondContact ND2-NE2 2.93Å
386	I	98.8	Very high	97.3	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.01	17%	0.165	C	C	.	.			trans	-96.2	5.2	-173.7	69.8	169	0	0	0	114	Y384 W409 R412 L416 F420 L430 Q431 V433 L442	Y384-I386 HydrophobicContact CD1-CG2 4.05Å; Y384-I386 HydrophobicContact CG-CG2 4.1Å; Y384-I386 PolarHBondContact O-N 3.44Å; I386-W409 HydrophobicContact CD1-CH2 4.35Å; I386-R412 PolarHBondContact O-NH1 3.49Å; I386-L416 HydrophobicContact CB-CD1 4.07Å; I386-L416 HydrophobicContact CB-CD2 3.98Å; I386-L416 HydrophobicContact CD1-CD1 4.45Å; I386-L416 HydrophobicContact CG2-CD2 3.91Å; I386-F420 HydrophobicContact CG2-CZ 4.39Å; I386-L430 HydrophobicContact CG2-CD2 4.1Å; I386-Q431 PolarHBondContact N-O 3.25Å; I386-V433 HydrophobicContact CD1-CB 4.44Å; I386-V433 HydrophobicContact CD1-CG1 4.28Å; I386-V433 HydrophobicContact CD1-CG2 3.98Å; I386-V433 HydrophobicContact CG1-CG2 4.3Å; I386-L442 HydrophobicContact CD1-CD2 3.89Å
387	L	98.6	Very high	97.6	Very high	1 Å²	1	31 Å²	31	1%	0.005	17%	0.165	C	C	.	.			trans	57.6	104.6	-177.6	179.4	59.5	0	0	0	112.8	N385 L392 Y399 R412 P781 D788	N385-L387 PolarHBondContact OD1-N 3.23Å; L387-L392 HydrophobicContact CD1-CB 4.07Å; L387-L392 HydrophobicContact CD2-CB 4.23Å; L387-L392 HydrophobicContact CD2-CD1 3.69Å; L387-L392 HydrophobicContact CD2-CG 3.93Å; L387-L392 HydrophobicContact CG-CB 4.06Å; L387-L392 HydrophobicContact CG-CD1 4.17Å; L387-L392 HydrophobicContact CG-CG 4.31Å; L387-Y399 WeakPolarHBondContact CD1-OH 3.39Å; L387-Y399 HydrophobicContact CD2-CE1 4.26Å; L387-R412 PolarHBondContact O-NH1 3.19Å; L387-R412 VanDerWaalsContact O-NH1 3.09Å; L387-R412 PolarHBondContact O-NH2 3.03Å; L387-P781 HydrophobicContact CD2-CG 3.72Å; L387-D788 HydrophobicContact CD2-CB 4.43Å
388	A	98.6	Very high	97.7	Very high	2 Å²	2	31.9 Å²	31.9	2%	0.017	17%	0.17	C	C	.	.			trans	-66.2	140.3	177.6	0	0	0	0	0	110.2	D390 L391 L392 E432 Q434 D464	A388-D390 VanDerWaalsContact C-N 3.34Å; A388-D390 PolarHBondContact O-N 3.46Å; A388-L391 HydrophobicContact CB-CB 4.06Å; A388-L391 HydrophobicContact CB-CD1 3.98Å; A388-L391 HydrophobicContact CB-CG 3.88Å; A388-L391 PolarHBondContact O-N 3.45Å; A388-L391 VanDerWaalsContact O-N 3.14Å; A388-L392 WeakPolarHBondContact O-CB 3.47Å; A388-L392 PolarHBondContact O-N 2.8Å; A388-E432 HydrophobicContact CB-CB 3.97Å; A388-E432 WeakPolarHBondContact CB-O 3.36Å; A388-E432 PolarHBondContact N-OE2 3.17Å; A388-Q434 HydrophobicContact CB-CB 4.28Å; A388-D464 HydrophobicContact CB-CB 3.92Å
389	Q	98.6	Very high	97.7	Very high	13 Å²	13	30.1 Å²	30.1	6%	0.061	16%	0.16	C	C	.	.	H	α-helix	trans	-65	-40.8	-179.3	-166.4	64.8	20.3	0	0	111.3	L391 L392 E393 L407 W409	Q389-L391 PolarHBondContact O-N 2.86Å; Q389-L392 PolarHBondContact O-N 2.84Å; Q389-E393 HydrophobicContact CG-CG 4.45Å; Q389-E393 WeakPolarHBondContact CG-OE1 3.23Å; Q389-E393 PolarHBondContact NE2-OE1 2.9Å; Q389-E393 WeakPolarHBondContact O-CB 3.42Å; Q389-E393 WeakPolarHBondContact O-CG 3.27Å; Q389-E393 PolarHBondContact O-N 2.81Å; Q389-L407 PolarHBondContact NE2-O 2.9Å; Q389-L407 VanDerWaalsContact NE2-O 3.08Å; Q389-L407 PolarHBondContact OE1-O 2.87Å; Q389-W409 HydrophobicContact CB-CB 4.42Å; Q389-W409 HydrophobicContact CG-CB 4.11Å
390	D	98.4	Very high	97.6	Very high	62 Å²	62	35.5 Å²	35.5	33%	0.332	19%	0.192	S	C	.	.	H	α-helix	trans	-62.3	-29.2	175.4	-61.8	-7.9	0	0	0	112.5	A388 A394 Q434 T463	A388-D390 VanDerWaalsContact C-N 3.34Å; A388-D390 PolarHBondContact O-N 3.46Å; D390-A394 WeakPolarHBondContact O-CB 3.44Å; D390-A394 PolarHBondContact O-N 2.97Å; D390-Q434 PolarHBondContact OD1-NE2 2.92Å; D390-Q434 PolarHBondContact OD1-OE1 2.98Å; D390-Q434 PolarHBondContact OD2-NE2 2.97Å; D390-T463 WeakPolarHBondContact OD2-CB 3.24Å; D390-T463 WeakPolarHBondContact OD2-CG2 3.41Å; D390-T463 PolarHBondContact OD2-OG1 3.48Å
391	L	97.8	Very high	97.4	Very high	32 Å²	32	36.2 Å²	36.2	17%	0.168	19%	0.194	C	C	.	.	H	α-helix	trans	-83.4	-40.1	178	-64	-178.2	0	0	0	111.2	A388 Q389 A394 N395 E432 D464	A388-L391 HydrophobicContact CB-CB 4.06Å; A388-L391 HydrophobicContact CB-CD1 3.98Å; A388-L391 HydrophobicContact CB-CG 3.88Å; A388-L391 PolarHBondContact O-N 3.45Å; A388-L391 VanDerWaalsContact O-N 3.14Å; Q389-L391 PolarHBondContact O-N 2.86Å; L391-A394 PolarHBondContact O-N 3.41Å; L391-N395 PolarHBondContact O-N 3.33Å; L391-N395 PolarHBondContact O-ND2 2.88Å; L391-E432 HydrophobicContact CD1-CG 4.05Å; L391-E432 WeakPolarHBondContact CD1-OE2 3.34Å; L391-D464 HydrophobicContact CD1-CB 4.17Å
392	L	97.9	Very high	97.3	Very high	3 Å²	3	36.7 Å²	36.7	2%	0.016	20%	0.197	C	C	.	.	H	α-helix	trans	-55.5	-52.4	170.1	-167.2	174.5	0	0	0	110.4	L387 A388 Q389 A394 N395 Q396 Y399 L407	L387-L392 HydrophobicContact CD1-CB 4.07Å; L387-L392 HydrophobicContact CD2-CB 4.23Å; L387-L392 HydrophobicContact CD2-CD1 3.69Å; L387-L392 HydrophobicContact CD2-CG 3.93Å; L387-L392 HydrophobicContact CG-CB 4.06Å; L387-L392 HydrophobicContact CG-CD1 4.17Å; L387-L392 HydrophobicContact CG-CG 4.31Å; A388-L392 WeakPolarHBondContact O-CB 3.47Å; A388-L392 PolarHBondContact O-N 2.8Å; Q389-L392 PolarHBondContact O-N 2.84Å; L392-A394 VanDerWaalsContact C-N 3.27Å; L392-A394 PolarHBondContact O-N 2.98Å; L392-N395 CarbonylContact O-C 3.55Å; L392-N395 PolarHBondContact O-N 2.91Å; L392-Q396 PolarHBondContact O-N 3.31Å; L392-Y399 HydrophobicContact CB-CE2 4.38Å; L392-Y399 HydrophobicContact CD2-CD2 3.95Å; L392-Y399 HydrophobicContact CD2-CE2 4.39Å; L392-Y399 HydrophobicContact CG-CD2 3.98Å; L392-Y399 HydrophobicContact CG-CE2 3.99Å; L392-L407 HydrophobicContact CD1-CB 4.24Å; L392-L407 HydrophobicContact CD1-CD2 4.22Å; L392-L407 WeakPolarHBondContact CD1-O 3.46Å; L392-L407 HydrophobicContact CD2-CB 4.14Å; L392-L407 HydrophobicContact CD2-CD1 4.3Å; L392-L407 HydrophobicContact CD2-CD2 4.33Å; L392-L407 HydrophobicContact CD2-CG 4.49Å
393	E	97.6	Very high	97	Very high	107 Å²	107	39.9 Å²	39.9	50%	0.5	22%	0.218	S	C	.	.	H	α-helix	trans	-71.4	-20.1	-176.8	-70.7	-179.2	-160.8	0	0	113.7	Q389 Q396	Q389-E393 HydrophobicContact CG-CG 4.45Å; Q389-E393 WeakPolarHBondContact CG-OE1 3.23Å; Q389-E393 PolarHBondContact NE2-OE1 2.9Å; Q389-E393 WeakPolarHBondContact O-CB 3.42Å; Q389-E393 WeakPolarHBondContact O-CG 3.27Å; Q389-E393 PolarHBondContact O-N 2.81Å; E393-Q396 WeakPolarHBondContact O-CG 3.35Å; E393-Q396 PolarHBondContact O-NE2 2.96Å; E393-Q396 VanDerWaalsContact O-NE2 3.16Å
394	A	97.3	Very high	96.7	Very high	68 Å²	68	46.8 Å²	46.8	56%	0.562	25%	0.254	S	S	*	.	H	α-helix	trans	-83.6	-14.2	173	0	0	0	0	0	114.5	D390 L391 L392	D390-A394 WeakPolarHBondContact O-CB 3.44Å; D390-A394 PolarHBondContact O-N 2.97Å; L391-A394 PolarHBondContact O-N 3.41Å; L392-A394 VanDerWaalsContact C-N 3.27Å; L392-A394 PolarHBondContact O-N 2.98Å
395	N	96.3	Very high	96.5	Very high	61 Å²	61	49.3 Å²	49.3	33%	0.326	28%	0.28	S	S	.	.			trans	-134.7	43.5	-177	-50.6	-97	0	0	0	111.1	L391 L392 E397 L398	L391-N395 PolarHBondContact O-N 3.33Å; L391-N395 PolarHBondContact O-ND2 2.88Å; L392-N395 CarbonylContact O-C 3.55Å; L392-N395 PolarHBondContact O-N 2.91Å; N395-E397 WeakPolarHBondContact CA-OE1 3.36Å; N395-E397 WeakPolarHBondContact CA-OE2 3.37Å; N395-E397 PolarHBondContact O-N 3.44Å; N395-E397 VanDerWaalsContact O-N 3.07Å; N395-L398 HydrophobicContact CB-CD1 3.78Å; N395-L398 HydrophobicContact CB-CG 4.04Å; N395-L398 WeakPolarHBondContact O-CB 3.48Å; N395-L398 WeakPolarHBondContact O-CG 3.48Å; N395-L398 PolarHBondContact O-N 2.92Å
396	Q	93.8	Very high	96.4	Very high	113 Å²	113	49.6 Å²	49.6	53%	0.528	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-58.5	-23.9	-172.7	-65.8	179.7	18	0	0	114.1	L392 E393 L398 Y399	L392-Q396 PolarHBondContact O-N 3.31Å; E393-Q396 WeakPolarHBondContact O-CG 3.35Å; E393-Q396 PolarHBondContact O-NE2 2.96Å; E393-Q396 VanDerWaalsContact O-NE2 3.16Å; Q396-L398 PolarHBondContact O-N 2.86Å; Q396-Y399 PolarHBondContact O-N 2.91Å; Q396-Y399 VanDerWaalsContact O-N 3.08Å
397	E	95.5	Very high	96.3	Very high	108 Å²	108	50.2 Å²	50.2	51%	0.505	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-55.8	-32.8	173.2	63.7	-77.4	-179.3	0	0	113.2	N395 Y399 T400 S727	N395-E397 WeakPolarHBondContact CA-OE1 3.36Å; N395-E397 WeakPolarHBondContact CA-OE2 3.37Å; N395-E397 PolarHBondContact O-N 3.44Å; N395-E397 VanDerWaalsContact O-N 3.07Å; E397-Y399 PolarHBondContact O-N 3.39Å; E397-T400 PolarHBondContact O-OG1 2.89Å; E397-S727 PolarHBondContact O-OG 3.5Å
398	L	95.1	Very high	96.3	Very high	24 Å²	24	52.4 Å²	52.4	13%	0.126	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-69.3	-16.7	179.1	-55.4	-174.9	0	0	0	113	N395 Q396 H401 H726 S727 E728	N395-L398 HydrophobicContact CB-CD1 3.78Å; N395-L398 HydrophobicContact CB-CG 4.04Å; N395-L398 WeakPolarHBondContact O-CB 3.48Å; N395-L398 WeakPolarHBondContact O-CG 3.48Å; N395-L398 PolarHBondContact O-N 2.92Å; Q396-L398 PolarHBondContact O-N 2.86Å; L398-H401 PolarHBondContact O-CE1 2.98Å; L398-H726 HydrophobicContact CB-CB 4.31Å; L398-S727 VanDerWaalsContact CA-OG 3.31Å; L398-S727 WeakPolarHBondContact CA-OG 3.48Å; L398-S727 VanDerWaalsContact O-CB 3.3Å; L398-S727 WeakPolarHBondContact O-CB 3.21Å; L398-S727 PolarHBondContact O-N 2.74Å; L398-S727 PolarHBondContact O-OG 2.95Å; L398-E728 HydrophobicContact CD2-CG 3.96Å
399	Y	96.7	Very high	96.3	Very high	13 Å²	13	53 Å²	53	5%	0.051	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-121.3	20.1	-172.3	-48.4	-64.4	0	0	0	112.9	L387 L392 Q396 E397 H401 C402 L407 H726 D788	L387-Y399 WeakPolarHBondContact CD1-OH 3.39Å; L387-Y399 HydrophobicContact CD2-CE1 4.26Å; L392-Y399 HydrophobicContact CB-CE2 4.38Å; L392-Y399 HydrophobicContact CD2-CD2 3.95Å; L392-Y399 HydrophobicContact CD2-CE2 4.39Å; L392-Y399 HydrophobicContact CG-CD2 3.98Å; L392-Y399 HydrophobicContact CG-CE2 3.99Å; Q396-Y399 PolarHBondContact O-N 2.91Å; Q396-Y399 VanDerWaalsContact O-N 3.08Å; E397-Y399 PolarHBondContact O-N 3.39Å; Y399-H401 PolarHBondContact O-N 3.43Å; Y399-C402 VanDerWaalsContact O-CB 3.3Å; Y399-C402 WeakPolarHBondContact O-CB 3.44Å; Y399-C402 PolarHBondContact O-N 3.24Å; Y399-L407 HydrophobicContact CG-CD2 4.39Å; Y399-H726 HydrophobicContact CE1-CB 4.17Å; Y399-D788 HydrophobicContact CE1-CB 3.84Å; Y399-D788 VanDerWaalsContact CE1-OD2 3.25Å; Y399-D788 WeakPolarHBondContact CE1-OD2 3.4Å; Y399-D788 PolarHBondContact OH-OD2 2.93Å
400	T	95.3	Very high	96.2	Very high	113 Å²	113	58.3 Å²	58.3	69%	0.693	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-15.2	-177.9	44	0	0	0	0	114.7	E397	E397-T400 PolarHBondContact O-OG1 2.89Å
401	H	94.9	Very high	96.1	Very high	39 Å²	39	59.2 Å²	59.2	18%	0.181	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-19.6	169.3	55.5	-74.3	0	0	0	113.5	L398 Y399 S727 W775 N778 L780	L398-H401 PolarHBondContact O-CE1 2.98Å; Y399-H401 PolarHBondContact O-N 3.43Å; H401-S727 PolarHBondContact CE1-N 3.02Å; H401-W775 HydrophobicContact CB-CZ3 4.31Å; H401-W775 AromaticContact CD2-CZ3 3.82Å; H401-W775 AromaticContact CG-CZ3 3.96Å; H401-N778 PolarHBondContact CD2-O 2.98Å; H401-N778 PolarHBondContact O-ND2 3.35Å; H401-L780 PolarHBondContact NE2-O 3.43Å
402	C	95.6	Very high	96.2	Very high	10 Å²	10	57.7 Å²	57.7	7%	0.068	32%	0.322	C	S	.	.	S	Bend	trans	-82.7	139.9	-173.9	-58.6	0	0	0	0	112.5	Y399 L404 V406 L407 P781	Y399-C402 VanDerWaalsContact O-CB 3.3Å; Y399-C402 WeakPolarHBondContact O-CB 3.44Å; Y399-C402 PolarHBondContact O-N 3.24Å; C402-L404 PolarHBondContact O-N 3.24Å; C402-V406 HydrophobicContact CB-CG2 4.4Å; C402-L407 HydrophobicContact CB-CD1 4.05Å; C402-L407 HydrophobicContact CB-CD2 3.66Å; C402-L407 HydrophobicContact CB-CG 3.93Å; C402-P781 PolarHBondContact SG-O 3.06Å
403	P	93.8	Very high	96.2	Very high	66 Å²	66	58.9 Å²	58.9	43%	0.429	33%	0.327	S	S	.	.			trans	-60.9	125.9	167.1	-21.7	32.7	0	0	0	111.1	G405 V406	P403-G405 PolarHBondContact O-N 3.3Å; P403-V406 HydrophobicContact CB-CG1 4.49Å; P403-V406 VanDerWaalsContact O-CG2 3.3Å; P403-V406 WeakPolarHBondContact O-CG2 3.49Å; P403-V406 PolarHBondContact O-N 3.29Å
404	L	93.1	Very high	96.2	Very high	146 Å²	146	56.9 Å²	56.9	76%	0.764	32%	0.324	S	S	*	.	H	α-helix	trans	-52.5	-28.9	-176	-62	177.6	0	0	0	114.3	C402 V406 L407	C402-L404 PolarHBondContact O-N 3.24Å; L404-V406 PolarHBondContact O-N 2.92Å; L404-L407 HydrophobicContact CD2-CD1 4.37Å; L404-L407 PolarHBondContact O-N 3.47Å
405	G	94.3	Very high	96.3	Very high	52 Å²	52	55.2 Å²	55.2	54%	0.536	31%	0.305	S	S	.	.	H	α-helix	trans	-65.4	-30.9	176.2	0	0	0	0	0	114.8	P403 Y411	P403-G405 PolarHBondContact O-N 3.3Å; G405-Y411 WeakPolarHBondContact O-CB 3.32Å
406	V	96.1	Very high	96.4	Very high	6 Å²	6	52.3 Å²	52.3	4%	0.036	29%	0.29	C	S	.	.	H	α-helix	trans	-83.1	-14.1	179.3	-50.2	0	0	0	0	113.2	C402 P403 L404 Y411 R412 E783	C402-V406 HydrophobicContact CB-CG2 4.4Å; P403-V406 HydrophobicContact CB-CG1 4.49Å; P403-V406 VanDerWaalsContact O-CG2 3.3Å; P403-V406 WeakPolarHBondContact O-CG2 3.49Å; P403-V406 PolarHBondContact O-N 3.29Å; L404-V406 PolarHBondContact O-N 2.92Å; V406-Y411 HydrophobicContact CB-CD1 3.86Å; V406-Y411 HydrophobicContact CB-CE1 3.77Å; V406-Y411 HydrophobicContact CG1-CD1 4.2Å; V406-Y411 HydrophobicContact CG1-CE1 3.7Å; V406-R412 WeakPolarHBondContact O-CD 3.35Å; V406-R412 WeakPolarHBondContact O-CG 3.35Å; V406-E783 HydrophobicContact CG1-CG 3.91Å
407	L	97.5	Very high	96.6	Very high	16 Å²	16	47.5 Å²	47.5	8%	0.084	27%	0.268	C	S	.	.	H	α-helix	trans	-82	-18.5	178.9	-62.9	-179.3	0	0	0	113.2	Q389 L392 Y399 C402 L404 R412 P781	Q389-L407 PolarHBondContact NE2-O 2.9Å; Q389-L407 VanDerWaalsContact NE2-O 3.08Å; Q389-L407 PolarHBondContact OE1-O 2.87Å; L392-L407 HydrophobicContact CD1-CB 4.24Å; L392-L407 HydrophobicContact CD1-CD2 4.22Å; L392-L407 WeakPolarHBondContact CD1-O 3.46Å; L392-L407 HydrophobicContact CD2-CB 4.14Å; L392-L407 HydrophobicContact CD2-CD1 4.3Å; L392-L407 HydrophobicContact CD2-CD2 4.33Å; L392-L407 HydrophobicContact CD2-CG 4.49Å; Y399-L407 HydrophobicContact CG-CD2 4.39Å; C402-L407 HydrophobicContact CB-CD1 4.05Å; C402-L407 HydrophobicContact CB-CD2 3.66Å; C402-L407 HydrophobicContact CB-CG 3.93Å; L404-L407 HydrophobicContact CD2-CD1 4.37Å; L404-L407 PolarHBondContact O-N 3.47Å; L407-R412 PolarHBondContact O-NE 2.78Å; L407-P781 HydrophobicContact CD2-CB 4.41Å; L407-P781 HydrophobicContact CD2-CG 3.99Å
408	S	97.8	Very high	96.6	Very high	46 Å²	46	48.5 Å²	48.5	32%	0.322	27%	0.273	S	S	.	.	S	Bend	trans	-65	135.2	177.5	179.5	0	0	0	0	111.4	D410 Y411 R412	S408-D410 PolarHBondContact O-N 3.21Å; S408-D410 PolarHBondContact OG-N 3.04Å; S408-Y411 WeakPolarHBondContact O-CA 3.44Å; S408-Y411 WeakPolarHBondContact O-CB 3.38Å; S408-Y411 PolarHBondContact O-N 2.92Å; S408-R412 WeakPolarHBondContact O-CG 3.34Å; S408-R412 PolarHBondContact O-N 3Å
409	W	98.3	Very high	96.7	Very high	16 Å²	16	48.4 Å²	48.4	6%	0.061	27%	0.272	C	S	.	.	H	α-helix	trans	-55	-35.2	173.9	-179.6	-113.4	0	0	0	112.8	I386 Q389 Y411 R412 F413 L416 H437	I386-W409 HydrophobicContact CD1-CH2 4.35Å; Q389-W409 HydrophobicContact CB-CB 4.42Å; Q389-W409 HydrophobicContact CG-CB 4.11Å; W409-Y411 PolarHBondContact O-N 3.4Å; W409-R412 HydrophobicContact CE3-CB 4.46Å; W409-R412 PolarHBondContact O-N 3.37Å; W409-F413 HydrophobicContact CD2-CB 4.01Å; W409-F413 HydrophobicContact CE3-CB 4.43Å; W409-F413 HydrophobicContact CH2-CB 4.2Å; W409-F413 AromaticContact CH2-CD2 3.97Å; W409-F413 HydrophobicContact CH2-CD2 3.97Å; W409-F413 HydrophobicContact CH2-CG 4.5Å; W409-F413 HydrophobicContact CZ2-CB 3.73Å; W409-F413 AromaticContact CZ2-CD2 3.47Å; W409-F413 HydrophobicContact CZ2-CD2 3.47Å; W409-F413 VanDerWaalsContact CZ2-CD2 3.47Å; W409-F413 HydrophobicContact CZ2-CE2 4.38Å; W409-F413 AromaticContact CZ2-CG 3.83Å; W409-F413 HydrophobicContact CZ2-CG 3.83Å; W409-F413 VanDerWaalsContact O-CB 3.24Å; W409-F413 WeakPolarHBondContact O-CB 3.2Å; W409-F413 PolarHBondContact O-N 2.79Å; W409-L416 HydrophobicContact CH2-CD1 3.84Å; W409-L416 HydrophobicContact CZ3-CD1 3.65Å; W409-H437 AromaticContact CD1-CD2 3.61Å; W409-H437 AromaticContact CD1-CE1 3.82Å; W409-H437 AromaticContact CD1-CG 3.84Å; W409-H437 AromaticContact CD1-ND1 3.94Å; W409-H437 AromaticContact CD1-NE2 3.64Å; W409-H437 AromaticContact CD2-ND1 3.85Å; W409-H437 AromaticContact CE2-CG 3.61Å; W409-H437 AromaticContact CE2-ND1 3.81Å; W409-H437 AromaticContact CG-CE1 3.87Å; W409-H437 AromaticContact CG-ND1 3.96Å; W409-H437 HydrophobicContact CH2-CB 4.45Å; W409-H437 HydrophobicContact CZ2-CB 3.64Å; W409-H437 AromaticContact NE1-CD2 3.45Å; W409-H437 PolarHBondContact NE1-CD2 3.12Å; W409-H437 AromaticContact NE1-CG 3.39Å; W409-H437 AromaticContact NE1-ND1 3.83Å; W409-H437 AromaticContact NE1-NE2 3.97Å
410	D	97.1	Very high	96.8	Very high	124 Å²	124	47.8 Å²	47.8	66%	0.663	27%	0.269	S	S	*	.	H	α-helix	trans	-62.7	-22.1	175.7	-69.2	-35.2	0	0	0	113.6	S408 P414	S408-D410 PolarHBondContact O-N 3.21Å; S408-D410 PolarHBondContact OG-N 3.04Å; D410-P414 WeakPolarHBondContact O-CD 3.15Å; D410-P414 VanDerWaalsContact O-CG 3.28Å; D410-P414 WeakPolarHBondContact O-CG 3.44Å
411	Y	97.5	Very high	96.9	Very high	81 Å²	81	48.4 Å²	48.4	32%	0.318	26%	0.262	S	S	.	.	H	α-helix	trans	-91.3	-42.9	172.8	-171.9	-85.2	0	0	0	111.6	G405 V406 S408 W409 P414 E783	G405-Y411 WeakPolarHBondContact O-CB 3.32Å; V406-Y411 HydrophobicContact CB-CD1 3.86Å; V406-Y411 HydrophobicContact CB-CE1 3.77Å; V406-Y411 HydrophobicContact CG1-CD1 4.2Å; V406-Y411 HydrophobicContact CG1-CE1 3.7Å; S408-Y411 WeakPolarHBondContact O-CA 3.44Å; S408-Y411 WeakPolarHBondContact O-CB 3.38Å; S408-Y411 PolarHBondContact O-N 2.92Å; W409-Y411 PolarHBondContact O-N 3.4Å; Y411-P414 WeakPolarHBondContact O-CD 3.41Å; Y411-E783 WeakPolarHBondContact OH-CA 3.38Å; Y411-E783 WeakPolarHBondContact OH-CB 3.23Å; Y411-E783 PolarHBondContact OH-O 3.3Å
412	R	98.5	Very high	97	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-69.7	-39.9	-176.7	-61.4	-171.8	-45.2	105.8	-9.2	112.5	I386 L387 V406 L407 S408 W409 N415 L416 P786	I386-R412 PolarHBondContact O-NH1 3.49Å; L387-R412 PolarHBondContact O-NH1 3.19Å; L387-R412 VanDerWaalsContact O-NH1 3.09Å; L387-R412 PolarHBondContact O-NH2 3.03Å; V406-R412 WeakPolarHBondContact O-CD 3.35Å; V406-R412 WeakPolarHBondContact O-CG 3.35Å; L407-R412 PolarHBondContact O-NE 2.78Å; S408-R412 WeakPolarHBondContact O-CG 3.34Å; S408-R412 PolarHBondContact O-N 3Å; W409-R412 HydrophobicContact CE3-CB 4.46Å; W409-R412 PolarHBondContact O-N 3.37Å; R412-N415 PolarHBondContact O-N 2.99Å; R412-L416 WeakPolarHBondContact O-CG 3.38Å; R412-L416 PolarHBondContact O-N 3.11Å; R412-P786 HydrophobicContact CB-CB 3.88Å; R412-P786 VanDerWaalsContact CD-O 3.28Å; R412-P786 WeakPolarHBondContact CD-O 3.08Å; R412-P786 HydrophobicContact CG-CB 4.28Å; R412-P786 PolarHBondContact NH1-O 2.57Å; R412-P786 WeakPolarHBondContact O-CB 3.48Å
413	F	98.5	Very high	97	Very high	27 Å²	27	55 Å²	55	12%	0.118	29%	0.288	C	S	.	.	H	α-helix	trans	-65.4	-43.8	-176	175.7	-113	0	0	0	114.9	W409 N415 L416 T417 Q441 L442 V445	W409-F413 HydrophobicContact CD2-CB 4.01Å; W409-F413 HydrophobicContact CE3-CB 4.43Å; W409-F413 HydrophobicContact CH2-CB 4.2Å; W409-F413 AromaticContact CH2-CD2 3.97Å; W409-F413 HydrophobicContact CH2-CD2 3.97Å; W409-F413 HydrophobicContact CH2-CG 4.5Å; W409-F413 HydrophobicContact CZ2-CB 3.73Å; W409-F413 AromaticContact CZ2-CD2 3.47Å; W409-F413 HydrophobicContact CZ2-CD2 3.47Å; W409-F413 VanDerWaalsContact CZ2-CD2 3.47Å; W409-F413 HydrophobicContact CZ2-CE2 4.38Å; W409-F413 AromaticContact CZ2-CG 3.83Å; W409-F413 HydrophobicContact CZ2-CG 3.83Å; W409-F413 VanDerWaalsContact O-CB 3.24Å; W409-F413 WeakPolarHBondContact O-CB 3.2Å; W409-F413 PolarHBondContact O-N 2.79Å; F413-N415 VanDerWaalsContact C-N 3.31Å; F413-N415 PolarHBondContact O-N 2.77Å; F413-L416 PolarHBondContact O-N 2.75Å; F413-T417 VanDerWaalsContact O-CB 3.28Å; F413-T417 WeakPolarHBondContact O-CB 3.43Å; F413-T417 PolarHBondContact O-N 2.75Å; F413-T417 PolarHBondContact O-OG1 3.06Å; F413-Q441 HydrophobicContact CD1-CB 4.47Å; F413-Q441 HydrophobicContact CE1-CB 3.88Å; F413-Q441 HydrophobicContact CE2-CB 4.23Å; F413-Q441 HydrophobicContact CZ-CB 3.75Å; F413-L442 HydrophobicContact CE2-CB 3.97Å; F413-L442 HydrophobicContact CE2-CD1 3.98Å; F413-V445 HydrophobicContact CZ-CB 4.25Å; F413-V445 HydrophobicContact CZ-CG1 4.46Å; F413-V445 HydrophobicContact CZ-CG2 3.98Å
414	P	98.1	Very high	97.2	Very high	66 Å²	66	58.2 Å²	58.2	43%	0.429	30%	0.297	S	S	.	.	H	α-helix	trans	-58.2	-41.1	170.6	-27.6	36.2	0	0	0	113.1	D410 Y411 T417 Q418	D410-P414 WeakPolarHBondContact O-CD 3.15Å; D410-P414 VanDerWaalsContact O-CG 3.28Å; D410-P414 WeakPolarHBondContact O-CG 3.44Å; Y411-P414 WeakPolarHBondContact O-CD 3.41Å; P414-T417 WeakPolarHBondContact O-CB 3.47Å; P414-T417 PolarHBondContact O-N 2.96Å; P414-Q418 WeakPolarHBondContact O-CB 3.3Å; P414-Q418 PolarHBondContact O-N 2.91Å
415	N	97.9	Very high	97.4	Very high	33 Å²	33	51.2 Å²	51.2	18%	0.176	26%	0.261	C	S	.	.	H	α-helix	trans	-68.7	-43.9	179.2	-77.8	6.7	0	0	0	112	R412 F413 T417 Q418 E419 E783 P786	R412-N415 PolarHBondContact O-N 2.99Å; F413-N415 VanDerWaalsContact C-N 3.31Å; F413-N415 PolarHBondContact O-N 2.77Å; N415-T417 VanDerWaalsContact C-N 3.31Å; N415-T417 PolarHBondContact O-N 3.16Å; N415-Q418 PolarHBondContact O-N 2.66Å; N415-Q418 VanDerWaalsContact O-N 3.13Å; N415-E419 PolarHBondContact O-N 3.14Å; N415-E783 PolarHBondContact ND2-O 3.48Å; N415-E783 VanDerWaalsContact ND2-O 3.1Å; N415-P786 HydrophobicContact CB-CB 3.74Å; N415-P786 HydrophobicContact CB-CG 3.9Å
416	L	98.4	Very high	97.7	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-56.2	-48	171.5	-75.3	167.7	0	0	0	110.5	Y384 I386 W409 R412 F413 Q418 E419 F420 P786	Y384-L416 HydrophobicContact CD1-CD2 4.31Å; Y384-L416 HydrophobicContact CE1-CD2 3.59Å; I386-L416 HydrophobicContact CB-CD1 4.07Å; I386-L416 HydrophobicContact CB-CD2 3.98Å; I386-L416 HydrophobicContact CD1-CD1 4.45Å; I386-L416 HydrophobicContact CG2-CD2 3.91Å; W409-L416 HydrophobicContact CH2-CD1 3.84Å; W409-L416 HydrophobicContact CZ3-CD1 3.65Å; R412-L416 WeakPolarHBondContact O-CG 3.38Å; R412-L416 PolarHBondContact O-N 3.11Å; F413-L416 PolarHBondContact O-N 2.75Å; L416-Q418 VanDerWaalsContact C-N 3.29Å; L416-Q418 PolarHBondContact O-N 3.48Å; L416-E419 PolarHBondContact O-N 2.87Å; L416-E419 VanDerWaalsContact O-N 3.15Å; L416-F420 HydrophobicContact CB-CE2 4.08Å; L416-F420 HydrophobicContact CB-CZ 4.4Å; L416-F420 HydrophobicContact CD2-CZ 4.43Å; L416-F420 WeakPolarHBondContact O-CD2 3.33Å; L416-F420 VanDerWaalsContact O-CG 3.29Å; L416-F420 WeakPolarHBondContact O-CG 3.4Å; L416-F420 PolarHBondContact O-N 2.97Å; L416-P786 HydrophobicContact CB-CG 4.36Å; L416-P786 HydrophobicContact CD2-CB 4.42Å; L416-P786 HydrophobicContact CD2-CG 3.63Å; L416-P786 HydrophobicContact CG-CB 4Å; L416-P786 HydrophobicContact CG-CG 3.59Å
417	T	97.9	Very high	97.8	Very high	12 Å²	12	49.3 Å²	49.3	7%	0.074	24%	0.238	C	C	.	.	H	α-helix	trans	-60.4	-37.3	176.8	-64.4	0	0	0	0	112.2	F413 P414 N415 K421 V445 M449	F413-T417 VanDerWaalsContact O-CB 3.28Å; F413-T417 WeakPolarHBondContact O-CB 3.43Å; F413-T417 PolarHBondContact O-N 2.75Å; F413-T417 PolarHBondContact O-OG1 3.06Å; P414-T417 WeakPolarHBondContact O-CB 3.47Å; P414-T417 PolarHBondContact O-N 2.96Å; N415-T417 VanDerWaalsContact C-N 3.31Å; N415-T417 PolarHBondContact O-N 3.16Å; T417-K421 HydrophobicContact CG2-CD 4.16Å; T417-K421 WeakPolarHBondContact O-CB 3.43Å; T417-K421 VanDerWaalsContact O-CG 3.25Å; T417-K421 WeakPolarHBondContact O-CG 3.29Å; T417-K421 PolarHBondContact O-N 2.83Å; T417-K421 VanDerWaalsContact O-N 3.11Å; T417-V445 HydrophobicContact CG2-CG1 3.66Å; T417-M449 HydrophobicContact CG2-CE 3.99Å
418	Q	97.3	Very high	97.9	Very high	129 Å²	129	48.5 Å²	48.5	60%	0.603	23%	0.234	S	C	*	.	H	α-helix	trans	-70.3	-37.3	175.4	-175.4	173.7	-4.8	0	0	111.9	P414 N415 L416 K421 K422	P414-Q418 WeakPolarHBondContact O-CB 3.3Å; P414-Q418 PolarHBondContact O-N 2.91Å; N415-Q418 PolarHBondContact O-N 2.66Å; N415-Q418 VanDerWaalsContact O-N 3.13Å; L416-Q418 VanDerWaalsContact C-N 3.29Å; L416-Q418 PolarHBondContact O-N 3.48Å; Q418-K421 PolarHBondContact O-N 2.96Å; Q418-K422 VanDerWaalsContact O-CB 3.28Å; Q418-K422 WeakPolarHBondContact O-CB 3.47Å; Q418-K422 PolarHBondContact O-N 2.81Å
419	E	97.1	Very high	97.9	Very high	22 Å²	22	46.3 Å²	46.3	10%	0.103	22%	0.218	C	C	.	.	H	α-helix	trans	-66.5	-42.4	175.8	-172.9	163.3	-156	0	0	111.9	R351 Y384 N415 L416 K421 K422 W423 S791	R351-E419 IonicContact NH1-OE1 3.26Å; Y384-E419 WeakPolarHBondContact CE1-OE2 3.38Å; N415-E419 PolarHBondContact O-N 3.14Å; L416-E419 PolarHBondContact O-N 2.87Å; L416-E419 VanDerWaalsContact O-N 3.15Å; E419-K421 PolarHBondContact O-N 3.26Å; E419-K422 PolarHBondContact O-N 2.94Å; E419-W423 VanDerWaalsContact O-CD1 3.28Å; E419-W423 PolarHBondContact O-N 3.44Å; E419-W423 PolarHBondContact OE1-NE1 3.23Å; E419-S791 PolarHBondContact OE1-OG 3.29Å
420	F	98	Very high	97.9	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.2	-42.1	173.2	-55.8	-38.9	0	0	0	112.1	M382 Y384 I386 L416 K422 E424 L428 L430 L442 L446 M449	M382-F420 HydrophobicContact SD-CD1 3.86Å; M382-F420 HydrophobicContact SD-CE1 3.89Å; Y384-F420 HydrophobicContact CD1-CE1 4.18Å; I386-F420 HydrophobicContact CG2-CZ 4.39Å; L416-F420 HydrophobicContact CB-CE2 4.08Å; L416-F420 HydrophobicContact CB-CZ 4.4Å; L416-F420 HydrophobicContact CD2-CZ 4.43Å; L416-F420 WeakPolarHBondContact O-CD2 3.33Å; L416-F420 VanDerWaalsContact O-CG 3.29Å; L416-F420 WeakPolarHBondContact O-CG 3.4Å; L416-F420 PolarHBondContact O-N 2.97Å; F420-K422 VanDerWaalsContact C-N 3.33Å; F420-K422 PolarHBondContact O-N 2.98Å; F420-E424 PolarHBondContact O-N 3.3Å; F420-L428 HydrophobicContact CD1-CD2 3.57Å; F420-L428 HydrophobicContact CE1-CD2 3.75Å; F420-L428 HydrophobicContact CG-CD2 4.35Å; F420-L430 HydrophobicContact CE1-CD2 4.05Å; F420-L430 HydrophobicContact CZ-CD1 4.14Å; F420-L430 HydrophobicContact CZ-CD2 4.1Å; F420-L442 HydrophobicContact CD2-CD1 4.4Å; F420-L442 HydrophobicContact CE2-CD1 3.83Å; F420-L446 HydrophobicContact CD2-CD2 4.1Å; F420-L446 HydrophobicContact CG-CD2 4.49Å; F420-M449 HydrophobicContact CB-SD 4.38Å
421	K	97.2	Very high	98	Very high	126 Å²	126	39.7 Å²	39.7	55%	0.548	18%	0.184	S	C	.	.	H	α-helix	trans	-68.1	-27	175.1	-73.4	171.7	-177.4	176.1	0	114	T417 Q418 E419 M449	T417-K421 HydrophobicContact CG2-CD 4.16Å; T417-K421 WeakPolarHBondContact O-CB 3.43Å; T417-K421 VanDerWaalsContact O-CG 3.25Å; T417-K421 WeakPolarHBondContact O-CG 3.29Å; T417-K421 PolarHBondContact O-N 2.83Å; T417-K421 VanDerWaalsContact O-N 3.11Å; Q418-K421 PolarHBondContact O-N 2.96Å; E419-K421 PolarHBondContact O-N 3.26Å; K421-M449 HydrophobicContact CD-CE 4.35Å; K421-M449 HydrophobicContact CG-CE 3.78Å; K421-M449 HydrophobicContact CG-SD 3.96Å
422	K	96.1	Very high	98.1	Very high	129 Å²	129	36.8 Å²	36.8	56%	0.561	17%	0.173	S	C	*	.	H	α-helix	trans	-76	-36.1	179.8	176.6	-177.2	173.4	-174.6	0	112.2	Q418 E419 F420	Q418-K422 VanDerWaalsContact O-CB 3.28Å; Q418-K422 WeakPolarHBondContact O-CB 3.47Å; Q418-K422 PolarHBondContact O-N 2.81Å; E419-K422 PolarHBondContact O-N 2.94Å; F420-K422 VanDerWaalsContact C-N 3.33Å; F420-K422 PolarHBondContact O-N 2.98Å
423	W	96.7	Very high	98.1	Very high	57 Å²	57	36.8 Å²	36.8	22%	0.216	17%	0.174	C	C	.	.	H	α-helix	trans	-105.2	-15.9	-171.9	-63.9	125	0	0	0	114.8	M382 E419 P425 L766 L793	M382-W423 HydrophobicContact CE-CB 4.01Å; M382-W423 HydrophobicContact CE-CG 4.22Å; E419-W423 VanDerWaalsContact O-CD1 3.28Å; E419-W423 PolarHBondContact O-N 3.44Å; E419-W423 PolarHBondContact OE1-NE1 3.23Å; W423-P425 VanDerWaalsContact C-CD 3.44Å; W423-P425 VanDerWaalsContact C-N 3.34Å; W423-L766 HydrophobicContact CD2-CD2 4.27Å; W423-L766 HydrophobicContact CH2-CD1 3.41Å; W423-L766 VanDerWaalsContact CH2-CD1 3.41Å; W423-L766 HydrophobicContact CH2-CD2 4.11Å; W423-L766 HydrophobicContact CH2-CG 4.38Å; W423-L766 HydrophobicContact CZ2-CD1 3.53Å; W423-L766 HydrophobicContact CZ2-CD2 3.45Å; W423-L766 VanDerWaalsContact CZ2-CD2 3.45Å; W423-L766 HydrophobicContact CZ2-CG 4.14Å; W423-L766 HydrophobicContact CZ3-CD1 4.18Å; W423-L793 HydrophobicContact CB-CD2 3.72Å; W423-L793 HydrophobicContact CD2-CD2 3.79Å; W423-L793 HydrophobicContact CE3-CD2 3.94Å; W423-L793 HydrophobicContact CG-CD2 3.71Å
424	E	97.8	Very high	98.1	Very high	134 Å²	134	35.9 Å²	35.9	63%	0.626	17%	0.17	S	C	*	.			trans	39.8	52.7	-178.9	-57	-167.8	116.2	0	0	113.9	F420 D426	F420-E424 PolarHBondContact O-N 3.3Å; E424-D426 PolarHBondContact O-N 3.06Å
425	P	98.4	Very high	98.2	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.167	C	C	.	.			trans	-69.7	120.9	-172.7	29.2	-36	0	0	0	112.1	T380 M382 W423 I427 L428 Y451 L793	T380-P425 WeakPolarHBondContact OG1-CA 3.18Å; M382-P425 HydrophobicContact CB-CB 3.69Å; M382-P425 HydrophobicContact CB-CG 3.97Å; M382-P425 HydrophobicContact CE-CB 4.47Å; M382-P425 HydrophobicContact CE-CG 4.02Å; M382-P425 HydrophobicContact SD-CG 4.15Å; W423-P425 VanDerWaalsContact C-CD 3.44Å; W423-P425 VanDerWaalsContact C-N 3.34Å; P425-I427 PolarHBondContact O-N 3.25Å; P425-L428 HydrophobicContact CG-CD1 4.47Å; P425-L428 HydrophobicContact CG-CD2 3.51Å; P425-L428 HydrophobicContact CG-CG 3.79Å; P425-Y451 WeakPolarHBondContact O-CE1 3.33Å; P425-Y451 PolarHBondContact O-OH 3Å; P425-L793 HydrophobicContact CB-CD1 3.85Å
426	D	98.8	Very high	98.2	Very high	17 Å²	17	37.8 Å²	37.8	9%	0.091	17%	0.173	C	C	.	.	S	Bend	trans	-58	-26.9	-174.2	-63.8	-62.9	0	0	0	114	F379 T380 E424 Y470 R471 R474 F475	F379-D426 WeakPolarHBondContact CA-OD2 3.38Å; F379-D426 HydrophobicContact CB-CB 4.31Å; F379-D426 WeakPolarHBondContact CB-OD2 3.34Å; T380-D426 PolarHBondContact N-OD2 3.25Å; T380-D426 WeakPolarHBondContact O-CB 3.16Å; T380-D426 PolarHBondContact O-N 3.45Å; T380-D426 PolarHBondContact OG1-N 3.16Å; T380-D426 PolarHBondContact OG1-OD2 3.45Å; E424-D426 PolarHBondContact O-N 3.06Å; D426-Y470 CarbonylContact O-C 3.57Å; D426-Y470 WeakPolarHBondContact O-CA 3.42Å; D426-R471 HydrophobicContact CB-CG 4.5Å; D426-R471 PolarHBondContact O-N 2.88Å; D426-R474 VanDerWaalsContact OD1-CD 3.24Å; D426-R474 WeakPolarHBondContact OD1-CD 3.31Å; D426-R474 IonicContact OD1-CZ 2.75Å; D426-R474 IonicContact OD1-NE 3.85Å; D426-R474 IonicContact OD1-NH1 3.81Å; D426-R474 PolarHBondContact OD1-NH1 2.81Å; D426-R474 IonicContact OD2-CZ 3.4Å; D426-R474 IonicContact OD2-NH1 3.15Å; D426-R474 PolarHBondContact OD2-NH1 2.95Å; D426-F475 HydrophobicContact CB-CE2 4.04Å
427	I	98.9	Very high	98.2	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	129.5	174.5	-58.5	171.9	0	0	0	108.8	F379 T380 V381 M382 P425 I468 C469 F475 L504 L521 V523	F379-I427 HydrophobicContact CD2-CD1 4.09Å; F379-I427 HydrophobicContact CE2-CD1 4.16Å; T380-I427 PolarHBondContact O-N 2.81Å; T380-I427 VanDerWaalsContact O-N 3.13Å; V381-I427 CarbonylContact C-O 3.49Å; V381-I427 WeakPolarHBondContact CA-O 3.27Å; V381-I427 HydrophobicContact CG1-CB 4.26Å; V381-I427 HydrophobicContact CG1-CG2 4.18Å; V381-I427 HydrophobicContact CG2-CB 4.24Å; V381-I427 HydrophobicContact CG2-CD1 4.26Å; M382-I427 PolarHBondContact N-O 3.46Å; P425-I427 PolarHBondContact O-N 3.25Å; I427-I468 HydrophobicContact CG2-CG2 4.27Å; I427-C469 CarbonylContact C-O 3.56Å; I427-C469 WeakPolarHBondContact CA-O 3.33Å; I427-F475 HydrophobicContact CD1-CE1 4.03Å; I427-F475 HydrophobicContact CD1-CE2 4.08Å; I427-F475 HydrophobicContact CD1-CZ 3.71Å; I427-F475 HydrophobicContact CG1-CD2 4.45Å; I427-F475 HydrophobicContact CG1-CE2 3.99Å; I427-F475 HydrophobicContact CG1-CZ 4.14Å; I427-L504 HydrophobicContact CD1-CD1 4.06Å; I427-L504 HydrophobicContact CG1-CD1 4.42Å; I427-L521 HydrophobicContact CD1-CD2 3.88Å; I427-V523 HydrophobicContact CD1-CG2 4.05Å; I427-V523 HydrophobicContact CG2-CG1 3.99Å
428	L	98.8	Very high	98.2	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	128.4	173	-68.4	143.7	0	0	0	109.3	M382 F420 P425 L430 L446 Y451 I468 C469	M382-L428 HydrophobicContact CB-CD2 4.17Å; M382-L428 HydrophobicContact CG-CD2 4.36Å; M382-L428 HydrophobicContact SD-CD2 3.72Å; F420-L428 HydrophobicContact CD1-CD2 3.57Å; F420-L428 HydrophobicContact CE1-CD2 3.75Å; F420-L428 HydrophobicContact CG-CD2 4.35Å; P425-L428 HydrophobicContact CG-CD1 4.47Å; P425-L428 HydrophobicContact CG-CD2 3.51Å; P425-L428 HydrophobicContact CG-CG 3.79Å; L428-L430 HydrophobicContact CB-CD2 4.44Å; L428-L430 HydrophobicContact CB-CG 4.36Å; L428-L430 HydrophobicContact CD2-CD2 4.21Å; L428-L446 HydrophobicContact CD1-CD2 3.88Å; L428-Y451 HydrophobicContact CD1-CD1 4.04Å; L428-Y451 HydrophobicContact CD1-CD2 4.08Å; L428-Y451 HydrophobicContact CD1-CE1 3.81Å; L428-Y451 HydrophobicContact CD1-CE2 3.87Å; L428-Y451 HydrophobicContact CD1-CG 4.2Å; L428-I468 CarbonylContact O-C 3.56Å; L428-I468 VanDerWaalsContact O-CA 3.31Å; L428-I468 WeakPolarHBondContact O-CA 3.46Å; L428-C469 HydrophobicContact CB-CB 4.13Å; L428-C469 HydrophobicContact CD1-CB 4.11Å; L428-C469 PolarHBondContact N-O 2.86Å; L428-C469 PolarHBondContact O-N 2.85Å
429	C	98.9	Very high	98.3	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	101	169.3	-68.6	0	0	0	0	108.5	M382 S383 Y384 Q431 V467 C568	M382-C429 PolarHBondContact O-N 2.96Å; S383-C429 VanDerWaalsContact CA-O 3.28Å; S383-C429 WeakPolarHBondContact CA-O 3.47Å; Y384-C429 PolarHBondContact N-O 2.86Å; C429-Q431 VanDerWaalsContact C-NE2 3.25Å; C429-Q431 PolarHBondContact O-NE2 2.82Å; C429-V467 CarbonylContact C-O 3.55Å; C429-V467 WeakPolarHBondContact CA-O 3.46Å; C429-C568 HydrophobicContact CB-CB 3.48Å; C429-C568 VanDerWaalsContact CB-CB 3.48Å
430	L	98.9	Very high	98.3	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	145.2	-173.9	-53.3	180	0	0	0	112.1	Y384 I386 F420 L428 V433 L442 C466 V467	Y384-L430 VanDerWaalsContact O-CA 3.29Å; Y384-L430 WeakPolarHBondContact O-CA 3.49Å; I386-L430 HydrophobicContact CG2-CD2 4.1Å; F420-L430 HydrophobicContact CE1-CD2 4.05Å; F420-L430 HydrophobicContact CZ-CD1 4.14Å; F420-L430 HydrophobicContact CZ-CD2 4.1Å; L428-L430 HydrophobicContact CB-CD2 4.44Å; L428-L430 HydrophobicContact CB-CG 4.36Å; L428-L430 HydrophobicContact CD2-CD2 4.21Å; L430-V433 HydrophobicContact CB-CG2 3.48Å; L430-V433 VanDerWaalsContact CB-CG2 3.48Å; L430-V433 HydrophobicContact CD1-CG2 4.4Å; L430-L442 HydrophobicContact CD1-CD2 4.19Å; L430-C466 VanDerWaalsContact O-CA 3.27Å; L430-C466 WeakPolarHBondContact O-CA 3.26Å; L430-V467 HydrophobicContact CB-CB 4.26Å; L430-V467 PolarHBondContact N-O 2.92Å; L430-V467 PolarHBondContact O-N 3.42Å
431	Q	98.9	Very high	98.3	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	157.5	176.1	-57.8	73.5	61.3	0	0	110	Y384 N385 I386 C429 V433 T525 T526 H527 D570	Y384-Q431 PolarHBondContact O-N 2.82Å; Y384-Q431 PolarHBondContact O-OE1 3.32Å; N385-Q431 HydrophobicContact CB-CB 4.05Å; N385-Q431 PolarHBondContact OD1-O 2.86Å; I386-Q431 PolarHBondContact N-O 3.25Å; C429-Q431 VanDerWaalsContact C-NE2 3.25Å; C429-Q431 PolarHBondContact O-NE2 2.82Å; Q431-V433 VanDerWaalsContact C-N 3.27Å; Q431-V433 PolarHBondContact O-N 3.37Å; Q431-T525 PolarHBondContact NE2-OG1 3.32Å; Q431-T526 WeakPolarHBondContact CG-O 3.19Å; Q431-H527 HydrophobicContact CB-CB 4.27Å; Q431-H527 HydrophobicContact CG-CB 4.22Å; Q431-D570 HydrophobicContact CG-CB 4.4Å
432	E	98.8	Very high	98.4	Very high	20 Å²	20	39 Å²	39	9%	0.093	19%	0.186	C	C	.	.	S	Bend	trans	52.9	38.2	-172.2	-59.1	-171.8	-157	0	0	115	N385 A388 L391 Q434 G465 H527	N385-E432 PolarHBondContact ND2-OE1 2.88Å; N385-E432 WeakPolarHBondContact OD1-CB 3.35Å; N385-E432 VanDerWaalsContact OD1-CD 3.24Å; N385-E432 WeakPolarHBondContact OD1-CG 3.35Å; A388-E432 HydrophobicContact CB-CB 3.97Å; A388-E432 WeakPolarHBondContact CB-O 3.36Å; A388-E432 PolarHBondContact N-OE2 3.17Å; L391-E432 HydrophobicContact CD1-CG 4.05Å; L391-E432 WeakPolarHBondContact CD1-OE2 3.34Å; E432-Q434 PolarHBondContact O-N 3.13Å; E432-G465 PolarHBondContact N-O 3.47Å; E432-G465 VanDerWaalsContact N-O 3.1Å; E432-H527 IonicContact OE1-CE1 3.72Å; E432-H527 PolarHBondContact OE1-CE1 2.9Å; E432-H527 VanDerWaalsContact OE1-CE1 3.31Å; E432-H527 IonicContact OE1-ND1 3.72Å
433	V	98.9	Very high	98.5	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.006	17%	0.171	C	C	.	.			trans	-80.5	108	176.1	-167.2	0	0	0	0	109.6	I386 L430 Q431 F438 L442 Y455 D464 G465 V467	I386-V433 HydrophobicContact CD1-CB 4.44Å; I386-V433 HydrophobicContact CD1-CG1 4.28Å; I386-V433 HydrophobicContact CD1-CG2 3.98Å; I386-V433 HydrophobicContact CG1-CG2 4.3Å; L430-V433 HydrophobicContact CB-CG2 3.48Å; L430-V433 VanDerWaalsContact CB-CG2 3.48Å; L430-V433 HydrophobicContact CD1-CG2 4.4Å; Q431-V433 VanDerWaalsContact C-N 3.27Å; Q431-V433 PolarHBondContact O-N 3.37Å; V433-F438 HydrophobicContact CG1-CB 3.87Å; V433-F438 HydrophobicContact CG1-CD2 3.79Å; V433-F438 HydrophobicContact CG1-CG 4.17Å; V433-L442 HydrophobicContact CG1-CD2 3.9Å; V433-Y455 HydrophobicContact CB-CE2 4.11Å; V433-Y455 HydrophobicContact CG1-CE2 4.43Å; V433-Y455 VanDerWaalsContact O-CE2 3.28Å; V433-Y455 WeakPolarHBondContact O-CE2 3.48Å; V433-Y455 PolarHBondContact O-OH 3.3Å; V433-D464 CarbonylContact O-C 3.47Å; V433-G465 PolarHBondContact N-O 2.97Å; V433-G465 PolarHBondContact O-N 3.2Å; V433-V467 HydrophobicContact CB-CG2 3.84Å; V433-V467 HydrophobicContact CG1-CG2 3.81Å; V433-V467 HydrophobicContact CG2-CB 4.27Å; V433-V467 HydrophobicContact CG2-CG2 3.71Å
434	Q	98.8	Very high	98.6	Very high	8 Å²	8	34.3 Å²	34.3	4%	0.037	17%	0.172	C	C	.	.			trans	-71.7	137.6	-179.4	-165.6	174.6	-43	0	0	112.3	A388 D390 E432 N436 H437 F438 T463	A388-Q434 HydrophobicContact CB-CB 4.28Å; D390-Q434 PolarHBondContact OD1-NE2 2.92Å; D390-Q434 PolarHBondContact OD1-OE1 2.98Å; D390-Q434 PolarHBondContact OD2-NE2 2.97Å; E432-Q434 PolarHBondContact O-N 3.13Å; Q434-N436 WeakPolarHBondContact CG-OD1 3.4Å; Q434-N436 PolarHBondContact NE2-OD1 3.29Å; Q434-N436 PolarHBondContact O-N 2.96Å; Q434-H437 HydrophobicContact CB-CB 4.39Å; Q434-H437 PolarHBondContact NE2-CE1 3.37Å; Q434-H437 PolarHBondContact O-N 3.17Å; Q434-F438 VanDerWaalsContact O-CB 3.32Å; Q434-F438 WeakPolarHBondContact O-CB 3.45Å; Q434-F438 PolarHBondContact O-N 3.38Å; Q434-T463 WeakPolarHBondContact CA-O 3.34Å
435	E	98.6	Very high	98.6	Very high	78 Å²	78	29.8 Å²	29.8	36%	0.364	15%	0.153	S	C	.	.	H	α-helix	trans	-62.7	-44.1	-166.1	-172.7	165.8	-115.8	0	0	115.1	T439 Y455 R457 T463	E435-T439 WeakPolarHBondContact O-CB 3.48Å; E435-T439 PolarHBondContact O-N 2.79Å; E435-T439 PolarHBondContact O-OG1 3.28Å; E435-Y455 WeakPolarHBondContact CA-OH 3.44Å; E435-Y455 HydrophobicContact CB-CE1 4.33Å; E435-Y455 HydrophobicContact CG-CE1 4.16Å; E435-Y455 PolarHBondContact N-OH 3.33Å; E435-R457 VanDerWaalsContact OE1-CD 3.26Å; E435-R457 WeakPolarHBondContact OE1-CD 3.21Å; E435-R457 IonicContact OE1-CZ 3.95Å; E435-R457 IonicContact OE1-NE 3.68Å; E435-R457 PolarHBondContact OE1-NE 2.93Å; E435-R457 WeakPolarHBondContact OE2-CD 3.34Å; E435-R457 IonicContact OE2-CZ 3.63Å; E435-R457 IonicContact OE2-NE 3.97Å; E435-R457 PolarHBondContact OE2-NE 3.28Å; E435-R457 IonicContact OE2-NH2 2.66Å; E435-T463 PolarHBondContact N-O 3.08Å
436	N	98.3	Very high	98.6	Very high	60 Å²	60	29.8 Å²	29.8	32%	0.321	15%	0.153	S	C	.	.	H	α-helix	trans	-68.9	-50.9	177.3	68.1	-50.6	0	0	0	110.5	Q434 F438 T439 E440	Q434-N436 WeakPolarHBondContact CG-OD1 3.4Å; Q434-N436 PolarHBondContact NE2-OD1 3.29Å; Q434-N436 PolarHBondContact O-N 2.96Å; N436-F438 VanDerWaalsContact C-N 3.25Å; N436-F438 PolarHBondContact O-N 3.23Å; N436-T439 PolarHBondContact O-N 2.92Å; N436-E440 WeakPolarHBondContact O-CB 3.48Å; N436-E440 WeakPolarHBondContact O-CG 3.46Å; N436-E440 PolarHBondContact O-N 2.96Å
437	H	98.5	Very high	98.6	Very high	24 Å²	24	35.1 Å²	35.1	11%	0.111	17%	0.172	C	C	.	.	H	α-helix	trans	-61.2	-32.4	178.1	-60.7	152	0	0	0	112.8	W409 Q434 Q441 L442	W409-H437 AromaticContact CD1-CD2 3.61Å; W409-H437 AromaticContact CD1-CE1 3.82Å; W409-H437 AromaticContact CD1-CG 3.84Å; W409-H437 AromaticContact CD1-ND1 3.94Å; W409-H437 AromaticContact CD1-NE2 3.64Å; W409-H437 AromaticContact CD2-ND1 3.85Å; W409-H437 AromaticContact CE2-CG 3.61Å; W409-H437 AromaticContact CE2-ND1 3.81Å; W409-H437 AromaticContact CG-CE1 3.87Å; W409-H437 AromaticContact CG-ND1 3.96Å; W409-H437 HydrophobicContact CH2-CB 4.45Å; W409-H437 HydrophobicContact CZ2-CB 3.64Å; W409-H437 AromaticContact NE1-CD2 3.45Å; W409-H437 PolarHBondContact NE1-CD2 3.12Å; W409-H437 AromaticContact NE1-CG 3.39Å; W409-H437 AromaticContact NE1-ND1 3.83Å; W409-H437 AromaticContact NE1-NE2 3.97Å; Q434-H437 HydrophobicContact CB-CB 4.39Å; Q434-H437 PolarHBondContact NE2-CE1 3.37Å; Q434-H437 PolarHBondContact O-N 3.17Å; H437-Q441 PolarHBondContact O-N 2.99Å; H437-L442 PolarHBondContact O-N 3.38Å
438	F	98.7	Very high	98.5	Very high	14 Å²	14	41.8 Å²	41.8	6%	0.061	21%	0.208	C	C	.	.	I	π-helix	trans	-62.5	-57.3	168.5	-176.2	-110.7	0	0	0	111.2	V433 Q434 N436 E440 L442 H443 C453 Y455 V467	V433-F438 HydrophobicContact CG1-CB 3.87Å; V433-F438 HydrophobicContact CG1-CD2 3.79Å; V433-F438 HydrophobicContact CG1-CG 4.17Å; Q434-F438 VanDerWaalsContact O-CB 3.32Å; Q434-F438 WeakPolarHBondContact O-CB 3.45Å; Q434-F438 PolarHBondContact O-N 3.38Å; N436-F438 VanDerWaalsContact C-N 3.25Å; N436-F438 PolarHBondContact O-N 3.23Å; F438-E440 PolarHBondContact O-N 2.87Å; F438-L442 HydrophobicContact CD2-CD2 4.46Å; F438-H443 HydrophobicContact CD1-CB 4.26Å; F438-H443 HydrophobicContact CD2-CB 4.12Å; F438-H443 HydrophobicContact CE1-CB 3.95Å; F438-H443 HydrophobicContact CE2-CB 3.82Å; F438-H443 HydrophobicContact CG-CB 4.35Å; F438-H443 HydrophobicContact CZ-CB 3.72Å; F438-H443 AromaticContact CZ-CG 3.97Å; F438-H443 WeakPolarHBondContact O-CB 3.35Å; F438-H443 PolarHBondContact O-N 3.32Å; F438-C453 HydrophobicContact CE2-CB 4.47Å; F438-C453 HydrophobicContact CZ-CB 4.14Å; F438-Y455 AromaticContact CD1-CD1 3.96Å; F438-Y455 HydrophobicContact CD1-CD1 3.96Å; F438-Y455 HydrophobicContact CD1-CD2 4.42Å; F438-Y455 AromaticContact CD1-CG 3.9Å; F438-Y455 HydrophobicContact CD1-CG 3.9Å; F438-Y455 HydrophobicContact CE1-CD1 4.25Å; F438-Y455 AromaticContact CE1-CG 3.92Å; F438-Y455 HydrophobicContact CE1-CG 3.92Å; F438-Y455 HydrophobicContact CG-CD2 4.49Å; F438-Y455 HydrophobicContact CG-CG 4.41Å; F438-Y455 HydrophobicContact CZ-CG 4.44Å; F438-V467 HydrophobicContact CD2-CG2 3.83Å; F438-V467 HydrophobicContact CE2-CG1 4.1Å; F438-V467 HydrophobicContact CE2-CG2 3.6Å; F438-V467 HydrophobicContact CZ-CG2 4.26Å
439	T	98.3	Very high	98.4	Very high	86 Å²	86	43.4 Å²	43.4	53%	0.528	22%	0.216	S	C	.	.	I	π-helix	trans	-66.2	-40.7	-169.9	-56.5	0	0	0	0	112.5	E435 N436	E435-T439 WeakPolarHBondContact O-CB 3.48Å; E435-T439 PolarHBondContact O-N 2.79Å; E435-T439 PolarHBondContact O-OG1 3.28Å; N436-T439 PolarHBondContact O-N 2.92Å
440	E	98.2	Very high	98.4	Very high	133 Å²	133	45 Å²	45	62%	0.621	23%	0.232	S	C	*	.	I	π-helix	trans	-90.3	-31.1	-170	-65.3	165.9	-150.9	0	0	113.4	N436 F438	N436-E440 WeakPolarHBondContact O-CB 3.48Å; N436-E440 WeakPolarHBondContact O-CG 3.46Å; N436-E440 PolarHBondContact O-N 2.96Å; F438-E440 PolarHBondContact O-N 2.87Å
441	Q	97.8	Very high	98.4	Very high	56 Å²	56	45.4 Å²	45.4	26%	0.262	23%	0.234	S	C	.	.	I	π-helix	trans	-129.4	-58.7	-168.3	-66.5	169.7	-47.3	0	0	113.2	F413 H437 P444 V445	F413-Q441 HydrophobicContact CD1-CB 4.47Å; F413-Q441 HydrophobicContact CE1-CB 3.88Å; F413-Q441 HydrophobicContact CE2-CB 4.23Å; F413-Q441 HydrophobicContact CZ-CB 3.75Å; H437-Q441 PolarHBondContact O-N 2.99Å; Q441-P444 WeakPolarHBondContact O-CD 3.43Å; Q441-V445 WeakPolarHBondContact O-CB 3.29Å; Q441-V445 WeakPolarHBondContact O-CG2 3.33Å; Q441-V445 PolarHBondContact O-N 2.73Å
442	L	98.4	Very high	98.4	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	25%	0.253	C	S	.	.	I	π-helix	trans	-72.1	-42.4	-171.4	180	64.3	0	0	0	113.1	I386 F413 F420 L430 V433 H437 F438 V445 L446	I386-L442 HydrophobicContact CD1-CD2 3.89Å; F413-L442 HydrophobicContact CE2-CB 3.97Å; F413-L442 HydrophobicContact CE2-CD1 3.98Å; F420-L442 HydrophobicContact CD2-CD1 4.4Å; F420-L442 HydrophobicContact CE2-CD1 3.83Å; L430-L442 HydrophobicContact CD1-CD2 4.19Å; V433-L442 HydrophobicContact CG1-CD2 3.9Å; H437-L442 PolarHBondContact O-N 3.38Å; F438-L442 HydrophobicContact CD2-CD2 4.46Å; L442-V445 PolarHBondContact O-N 3.39Å; L442-L446 HydrophobicContact CD1-CD1 3.8Å; L442-L446 HydrophobicContact CD1-CG 3.92Å; L442-L446 HydrophobicContact CD2-CD1 4.48Å; L442-L446 HydrophobicContact CG-CD1 3.83Å; L442-L446 HydrophobicContact CG-CG 4.31Å; L442-L446 WeakPolarHBondContact O-CB 3.46Å; L442-L446 WeakPolarHBondContact O-CG 3.37Å; L442-L446 PolarHBondContact O-N 2.9Å
443	H	98.6	Very high	98.3	Very high	52 Å²	52	48.6 Å²	48.6	24%	0.241	26%	0.255	C	S	.	.	H	α-helix	trans	-65.3	-47.4	178	173	-152.8	0	0	0	112.5	F438 V445 L446 R447	F438-H443 HydrophobicContact CD1-CB 4.26Å; F438-H443 HydrophobicContact CD2-CB 4.12Å; F438-H443 HydrophobicContact CE1-CB 3.95Å; F438-H443 HydrophobicContact CE2-CB 3.82Å; F438-H443 HydrophobicContact CG-CB 4.35Å; F438-H443 HydrophobicContact CZ-CB 3.72Å; F438-H443 AromaticContact CZ-CG 3.97Å; F438-H443 WeakPolarHBondContact O-CB 3.35Å; F438-H443 PolarHBondContact O-N 3.32Å; H443-V445 VanDerWaalsContact C-N 3.33Å; H443-V445 PolarHBondContact O-N 2.82Å; H443-L446 PolarHBondContact O-N 3.27Å; H443-R447 PolarHBondContact CE1-NH2 3.04Å; H443-R447 PolarHBondContact ND1-NH2 3.4Å; H443-R447 PolarHBondContact NE2-NE 3.08Å; H443-R447 PolarHBondContact NE2-NH2 3.48Å; H443-R447 VanDerWaalsContact O-CB 3.28Å; H443-R447 WeakPolarHBondContact O-CB 3.31Å; H443-R447 PolarHBondContact O-N 3.01Å
444	P	98.5	Very high	98.3	Very high	37 Å²	37	49.2 Å²	49.2	24%	0.24	26%	0.259	C	S	.	.	H	α-helix	trans	-52.2	-50	170.5	-27.9	35.2	0	0	0	112.6	Q441 L446 R447 D448	Q441-P444 WeakPolarHBondContact O-CD 3.43Å; P444-L446 PolarHBondContact O-N 3.34Å; P444-R447 WeakPolarHBondContact O-CB 3.22Å; P444-R447 PolarHBondContact O-N 2.75Å; P444-D448 PolarHBondContact O-N 3.33Å
445	V	98.3	Very high	98.3	Very high	39 Å²	39	50.9 Å²	50.9	24%	0.236	27%	0.265	C	S	.	.	H	α-helix	trans	-64.6	-37.6	-177.3	163.1	0	0	0	0	113	F413 T417 Q441 L442 H443 M449	F413-V445 HydrophobicContact CZ-CB 4.25Å; F413-V445 HydrophobicContact CZ-CG1 4.46Å; F413-V445 HydrophobicContact CZ-CG2 3.98Å; T417-V445 HydrophobicContact CG2-CG1 3.66Å; Q441-V445 WeakPolarHBondContact O-CB 3.29Å; Q441-V445 WeakPolarHBondContact O-CG2 3.33Å; Q441-V445 PolarHBondContact O-N 2.73Å; L442-V445 PolarHBondContact O-N 3.39Å; H443-V445 VanDerWaalsContact C-N 3.33Å; H443-V445 PolarHBondContact O-N 2.82Å; V445-M449 HydrophobicContact CG1-CE 3.51Å; V445-M449 WeakPolarHBondContact O-CG 3.47Å; V445-M449 PolarHBondContact O-N 3.4Å
446	L	98.4	Very high	98.3	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-73.1	-35.4	173.8	-69.6	175.8	0	0	0	112.3	F420 L428 L442 H443 P444 D448 M449 G450 Y451	F420-L446 HydrophobicContact CD2-CD2 4.1Å; F420-L446 HydrophobicContact CG-CD2 4.49Å; L428-L446 HydrophobicContact CD1-CD2 3.88Å; L442-L446 HydrophobicContact CD1-CD1 3.8Å; L442-L446 HydrophobicContact CD1-CG 3.92Å; L442-L446 HydrophobicContact CD2-CD1 4.48Å; L442-L446 HydrophobicContact CG-CD1 3.83Å; L442-L446 HydrophobicContact CG-CG 4.31Å; L442-L446 WeakPolarHBondContact O-CB 3.46Å; L442-L446 WeakPolarHBondContact O-CG 3.37Å; L442-L446 PolarHBondContact O-N 2.9Å; H443-L446 PolarHBondContact O-N 3.27Å; P444-L446 PolarHBondContact O-N 3.34Å; L446-D448 VanDerWaalsContact C-N 3.33Å; L446-D448 PolarHBondContact O-N 2.96Å; L446-M449 HydrophobicContact CD2-CE 4.47Å; L446-M449 HydrophobicContact CD2-SD 4.38Å; L446-M449 CarbonylContact O-C 3.55Å; L446-M449 WeakPolarHBondContact O-CA 3.47Å; L446-M449 WeakPolarHBondContact O-CB 3.34Å; L446-M449 PolarHBondContact O-N 3.24Å; L446-M449 VanDerWaalsContact O-N 3.11Å; L446-G450 PolarHBondContact O-N 3.26Å; L446-Y451 HydrophobicContact CB-CD2 4.09Å; L446-Y451 HydrophobicContact CD2-CD2 3.85Å; L446-Y451 HydrophobicContact CD2-CE2 4.13Å; L446-Y451 WeakPolarHBondContact O-CB 3.4Å; L446-Y451 VanDerWaalsContact O-CD2 3.29Å; L446-Y451 WeakPolarHBondContact O-CD2 3.41Å; L446-Y451 PolarHBondContact O-N 3.31Å; L446-Y451 VanDerWaalsContact O-N 3.08Å
447	R	98.3	Very high	98.4	Very high	128 Å²	128	49.5 Å²	49.5	48%	0.483	25%	0.253	S	S	.	.	H	α-helix	trans	-62.8	-41.2	175.7	-164.9	-167.7	-49.6	142.1	13.4	111.4	H443 P444 M449 G450	H443-R447 PolarHBondContact CE1-NH2 3.04Å; H443-R447 PolarHBondContact ND1-NH2 3.4Å; H443-R447 PolarHBondContact NE2-NE 3.08Å; H443-R447 PolarHBondContact NE2-NH2 3.48Å; H443-R447 VanDerWaalsContact O-CB 3.28Å; H443-R447 WeakPolarHBondContact O-CB 3.31Å; H443-R447 PolarHBondContact O-N 3.01Å; P444-R447 WeakPolarHBondContact O-CB 3.22Å; P444-R447 PolarHBondContact O-N 2.75Å; R447-M449 PolarHBondContact O-N 3.15Å; R447-G450 WeakPolarHBondContact O-CA 3.41Å; R447-G450 PolarHBondContact O-N 2.81Å
448	D	97.9	Very high	98.4	Very high	140 Å²	140	50 Å²	50	75%	0.749	26%	0.255	S	S	*	.	H	α-helix	trans	-67.5	-22	175.7	-69.1	-8.5	0	0	0	112.6	P444 L446 G450	P444-D448 PolarHBondContact O-N 3.33Å; L446-D448 VanDerWaalsContact C-N 3.33Å; L446-D448 PolarHBondContact O-N 2.96Å; D448-G450 VanDerWaalsContact C-N 3.27Å
449	M	97.4	Very high	98.3	Very high	34 Å²	34	50.3 Å²	50.3	17%	0.167	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	5.6	167.8	-64.9	-175.9	-142.3	0	0	114	T417 F420 K421 V445 L446 R447 Y451 R471	T417-M449 HydrophobicContact CG2-CE 3.99Å; F420-M449 HydrophobicContact CB-SD 4.38Å; K421-M449 HydrophobicContact CD-CE 4.35Å; K421-M449 HydrophobicContact CG-CE 3.78Å; K421-M449 HydrophobicContact CG-SD 3.96Å; V445-M449 HydrophobicContact CG1-CE 3.51Å; V445-M449 WeakPolarHBondContact O-CG 3.47Å; V445-M449 PolarHBondContact O-N 3.4Å; L446-M449 HydrophobicContact CD2-CE 4.47Å; L446-M449 HydrophobicContact CD2-SD 4.38Å; L446-M449 CarbonylContact O-C 3.55Å; L446-M449 WeakPolarHBondContact O-CA 3.47Å; L446-M449 WeakPolarHBondContact O-CB 3.34Å; L446-M449 PolarHBondContact O-N 3.24Å; L446-M449 VanDerWaalsContact O-N 3.11Å; R447-M449 PolarHBondContact O-N 3.15Å; M449-Y451 HydrophobicContact CB-CD2 3.7Å; M449-Y451 HydrophobicContact CB-CE2 3.64Å; M449-Y451 HydrophobicContact SD-CE2 4.15Å; M449-R471 PolarHBondContact O-NH1 3.31Å
450	G	97.6	Very high	98.2	Very high	34 Å²	34	48.8 Å²	48.8	35%	0.351	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.9	14.1	178.9	0	0	0	0	0	115.2	L446 R447 D448 G472	L446-G450 PolarHBondContact O-N 3.26Å; R447-G450 WeakPolarHBondContact O-CA 3.41Å; R447-G450 PolarHBondContact O-N 2.81Å; D448-G450 VanDerWaalsContact C-N 3.27Å; G450-G472 PolarHBondContact O-N 2.96Å
451	Y	98.7	Very high	98.1	Very high	8 Å²	8	49 Å²	49	3%	0.031	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	138.8	174.6	-63.7	-72.5	0	0	0	112.5	P425 L428 L446 M449 C469 Y470 R471	P425-Y451 WeakPolarHBondContact O-CE1 3.33Å; P425-Y451 PolarHBondContact O-OH 3Å; L428-Y451 HydrophobicContact CD1-CD1 4.04Å; L428-Y451 HydrophobicContact CD1-CD2 4.08Å; L428-Y451 HydrophobicContact CD1-CE1 3.81Å; L428-Y451 HydrophobicContact CD1-CE2 3.87Å; L428-Y451 HydrophobicContact CD1-CG 4.2Å; L446-Y451 HydrophobicContact CB-CD2 4.09Å; L446-Y451 HydrophobicContact CD2-CD2 3.85Å; L446-Y451 HydrophobicContact CD2-CE2 4.13Å; L446-Y451 WeakPolarHBondContact O-CB 3.4Å; L446-Y451 VanDerWaalsContact O-CD2 3.29Å; L446-Y451 WeakPolarHBondContact O-CD2 3.41Å; L446-Y451 PolarHBondContact O-N 3.31Å; L446-Y451 VanDerWaalsContact O-N 3.08Å; M449-Y451 HydrophobicContact CB-CD2 3.7Å; M449-Y451 HydrophobicContact CB-CE2 3.64Å; M449-Y451 HydrophobicContact SD-CE2 4.15Å; Y451-C469 HydrophobicContact CD1-CB 4.27Å; Y451-C469 HydrophobicContact CG-CB 4.29Å; Y451-Y470 WeakPolarHBondContact CA-O 3.28Å; Y451-R471 HydrophobicContact CD1-CG 4.12Å; Y451-R471 HydrophobicContact CE1-CG 3.68Å
452	T	98.6	Very high	98	Very high	65 Å²	65	49.9 Å²	49.9	40%	0.399	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	137.8	155.8	-54.7	0	0	0	0	108	C469 Y470	T452-C469 CarbonylContact O-C 3.56Å; T452-C469 WeakPolarHBondContact O-CA 3.46Å; T452-Y470 HydrophobicContact CG2-CE1 4.15Å; T452-Y470 HydrophobicContact CG2-CE2 4.5Å; T452-Y470 WeakPolarHBondContact CG2-OH 3.19Å; T452-Y470 PolarHBondContact N-O 2.8Å; T452-Y470 PolarHBondContact O-N 3.31Å
453	C	98.6	Very high	98	Very high	22 Å²	22	52.3 Å²	52.3	15%	0.149	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	135.6	-173.5	-64.7	0	0	0	0	112	F438 V467 C469	F438-C453 HydrophobicContact CE2-CB 4.47Å; F438-C453 HydrophobicContact CZ-CB 4.14Å; C453-V467 HydrophobicContact CB-CG1 4.14Å; C453-C469 HydrophobicContact CB-CB 4.08Å; C453-C469 WeakPolarHBondContact CB-SG 3.31Å; C453-C469 WeakPolarHBondContact SG-CB 3.28Å; C453-C469 CovalentContact SG-SG 2.04Å; C453-C469 PolarHBondContact SG-SG 3.21Å
454	V	98.8	Very high	98	Very high	15 Å²	15	49.9 Å²	49.9	9%	0.091	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	123.9	171.3	-179.4	0	0	0	0	108.4	V467 I468 L482 I500 L502	V454-V467 WeakPolarHBondContact O-CA 3.38Å; V454-I468 PolarHBondContact N-O 2.9Å; V454-I468 PolarHBondContact O-N 3.08Å; V454-L482 HydrophobicContact CG1-CD2 3.73Å; V454-I500 HydrophobicContact CG1-CG2 4.39Å; V454-I500 WeakPolarHBondContact O-CD1 3.43Å; V454-L502 HydrophobicContact CB-CD1 4.27Å; V454-L502 HydrophobicContact CB-CD2 4.19Å; V454-L502 HydrophobicContact CG1-CD2 4.21Å; V454-L502 HydrophobicContact CG2-CD1 4Å; V454-L502 HydrophobicContact CG2-CD2 3.99Å
455	Y	98.9	Very high	98	Very high	42 Å²	42	48.2 Å²	48.2	17%	0.165	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	142.9	-178.3	176.5	-123.6	0	0	0	111.5	V433 E435 F438 R457 C466 V467	V433-Y455 HydrophobicContact CB-CE2 4.11Å; V433-Y455 HydrophobicContact CG1-CE2 4.43Å; V433-Y455 VanDerWaalsContact O-CE2 3.28Å; V433-Y455 WeakPolarHBondContact O-CE2 3.48Å; V433-Y455 PolarHBondContact O-OH 3.3Å; E435-Y455 WeakPolarHBondContact CA-OH 3.44Å; E435-Y455 HydrophobicContact CB-CE1 4.33Å; E435-Y455 HydrophobicContact CG-CE1 4.16Å; E435-Y455 PolarHBondContact N-OH 3.33Å; F438-Y455 AromaticContact CD1-CD1 3.96Å; F438-Y455 HydrophobicContact CD1-CD1 3.96Å; F438-Y455 HydrophobicContact CD1-CD2 4.42Å; F438-Y455 AromaticContact CD1-CG 3.9Å; F438-Y455 HydrophobicContact CD1-CG 3.9Å; F438-Y455 HydrophobicContact CE1-CD1 4.25Å; F438-Y455 AromaticContact CE1-CG 3.92Å; F438-Y455 HydrophobicContact CE1-CG 3.92Å; F438-Y455 HydrophobicContact CG-CD2 4.49Å; F438-Y455 HydrophobicContact CG-CG 4.41Å; F438-Y455 HydrophobicContact CZ-CG 4.44Å; Y455-R457 HydrophobicContact CE1-CB 3.8Å; Y455-C466 WeakPolarHBondContact CD2-O 3.21Å; Y455-V467 HydrophobicContact CD2-CG2 3.52Å; Y455-V467 HydrophobicContact CE2-CG2 4.29Å; Y455-V467 HydrophobicContact CG-CG2 4.32Å
456	K	98.8	Very high	98.1	Very high	36 Å²	36	46.4 Å²	46.4	16%	0.157	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	103.1	167.8	-179.7	53.3	177.8	171.3	0	109.4	G465 C466 L482 E484 V498 I500	K456-G465 CarbonylContact O-C 3.59Å; K456-G465 VanDerWaalsContact O-CA 3.23Å; K456-G465 WeakPolarHBondContact O-CA 3.24Å; K456-C466 PolarHBondContact N-O 3.16Å; K456-C466 PolarHBondContact O-N 3.34Å; K456-L482 HydrophobicContact CB-CD2 4.43Å; K456-L482 HydrophobicContact CD-CB 4.17Å; K456-L482 HydrophobicContact CD-CD1 4.41Å; K456-L482 HydrophobicContact CG-CB 4.34Å; K456-E484 IonicContact NZ-OE1 3.15Å; K456-E484 PolarHBondContact NZ-OE1 2.93Å; K456-V498 HydrophobicContact CG-CB 3.88Å; K456-V498 HydrophobicContact CG-CG1 4.13Å; K456-V498 HydrophobicContact CG-CG2 4.01Å; K456-I500 HydrophobicContact CB-CD1 3.82Å; K456-I500 HydrophobicContact CB-CG1 3.7Å
457	R	98.7	Very high	98.1	Very high	73 Å²	73	46.4 Å²	46.4	28%	0.275	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	146.6	163.2	-166.5	170.2	57	84.5	-12.6	110.4	E435 Y455 G460 K462 D464	E435-R457 VanDerWaalsContact OE1-CD 3.26Å; E435-R457 WeakPolarHBondContact OE1-CD 3.21Å; E435-R457 IonicContact OE1-CZ 3.95Å; E435-R457 IonicContact OE1-NE 3.68Å; E435-R457 PolarHBondContact OE1-NE 2.93Å; E435-R457 WeakPolarHBondContact OE2-CD 3.34Å; E435-R457 IonicContact OE2-CZ 3.63Å; E435-R457 IonicContact OE2-NE 3.97Å; E435-R457 PolarHBondContact OE2-NE 3.28Å; E435-R457 IonicContact OE2-NH2 2.66Å; Y455-R457 HydrophobicContact CE1-CB 3.8Å; R457-G460 PolarHBondContact NH1-O 2.84Å; R457-K462 WeakPolarHBondContact CD-O 3.49Å; R457-K462 VanDerWaalsContact CG-O 3.3Å; R457-K462 WeakPolarHBondContact CG-O 3.49Å; R457-K462 PolarHBondContact NH1-O 2.91Å; R457-D464 WeakPolarHBondContact CG-O 3.18Å
458	R	98.6	Very high	98.1	Very high	36 Å²	36	40.3 Å²	40.3	14%	0.136	23%	0.232	C	C	.	.			trans	-59.6	157.7	167.4	-72.5	164.9	75.9	174.7	8.5	111.3	K462 D464 D496 V498	R458-K462 HydrophobicContact CB-CB 3.52Å; R458-K462 HydrophobicContact CB-CG 4.26Å; R458-D464 WeakPolarHBondContact CB-O 3.34Å; R458-D464 VanDerWaalsContact CD-CG 3.45Å; R458-D464 WeakPolarHBondContact CD-OD1 3.09Å; R458-D464 WeakPolarHBondContact CD-OD2 3.41Å; R458-D464 WeakPolarHBondContact CG-O 3.3Å; R458-D464 IonicContact CZ-OD1 2.8Å; R458-D464 IonicContact CZ-OD2 3.96Å; R458-D464 PolarHBondContact N-O 3.35Å; R458-D464 IonicContact NE-OD1 2.76Å; R458-D464 IonicContact NE-OD2 3.66Å; R458-D464 IonicContact NH1-OD1 3.05Å; R458-D464 PolarHBondContact NH1-OD1 2.66Å; R458-D464 IonicContact NH1-OD2 3.7Å; R458-D464 PolarHBondContact NH1-OD2 3.35Å; R458-D496 WeakPolarHBondContact CB-O 3.39Å; R458-D496 WeakPolarHBondContact CG-O 3.39Å; R458-V498 HydrophobicContact CG-CG2 3.78Å
459	T	97.5	Very high	98.2	Very high	19 Å²	19	33.7 Å²	33.7	12%	0.117	20%	0.196	C	C	.	.	S	Bend	trans	-77.1	176.6	179.8	56.8	0	0	0	0	112.1	T461 K462 E484 D496	T459-T461 PolarHBondContact O-N 2.94Å; T459-K462 PolarHBondContact O-N 2.04Å; T459-E484 HydrophobicContact CG2-CB 4.2Å; T459-E484 VanDerWaalsContact CG2-CD 3.48Å; T459-E484 HydrophobicContact CG2-CG 3.71Å; T459-D496 WeakPolarHBondContact CB-OD1 3.42Å; T459-D496 PolarHBondContact N-O 2.9Å; T459-D496 WeakPolarHBondContact O-CB 3.1Å; T459-D496 WeakPolarHBondContact OG1-CA 3.34Å; T459-D496 WeakPolarHBondContact OG1-CB 3.36Å; T459-D496 PolarHBondContact OG1-OD1 2.81Å
460	G	95.4	Very high	98.2	Very high	55 Å²	55	32.8 Å²	32.8	57%	0.567	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.5	-137.8	177.9	0	0	0	0	0	112.6	R457 K462 D496	R457-G460 PolarHBondContact NH1-O 2.84Å; G460-K462 VanDerWaalsContact C-N 3.32Å; G460-K462 PolarHBondContact O-N 2.88Å; G460-D496 PolarHBondContact N-OD1 2.94Å
461	T	95.6	Very high	98.3	Very high	136 Å²	136	34 Å²	34	83%	0.834	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.8	15	-175.5	58.1	0	0	0	0	114	T459	T459-T461 PolarHBondContact O-N 2.94Å
462	K	97.7	Very high	98.1	Very high	75 Å²	75	35.3 Å²	35.3	33%	0.326	20%	0.201	S	C	.	.			trans	-85.7	125.4	179.4	-64.5	-58.2	179.1	-173.5	0	111.3	R457 R458 T459 G460 D496	R457-K462 WeakPolarHBondContact CD-O 3.49Å; R457-K462 VanDerWaalsContact CG-O 3.3Å; R457-K462 WeakPolarHBondContact CG-O 3.49Å; R457-K462 PolarHBondContact NH1-O 2.91Å; R458-K462 HydrophobicContact CB-CB 3.52Å; R458-K462 HydrophobicContact CB-CG 4.26Å; T459-K462 PolarHBondContact O-N 2.04Å; G460-K462 VanDerWaalsContact C-N 3.32Å; G460-K462 PolarHBondContact O-N 2.88Å; K462-D496 HydrophobicContact CG-CB 4.25Å
463	T	97.9	Very high	97.9	Very high	53 Å²	53	35.8 Å²	35.8	33%	0.325	20%	0.201	S	C	.	.			trans	-86.1	-14.5	-178.8	48.4	0	0	0	0	113	D390 Q434 E435	D390-T463 WeakPolarHBondContact OD2-CB 3.24Å; D390-T463 WeakPolarHBondContact OD2-CG2 3.41Å; D390-T463 PolarHBondContact OD2-OG1 3.48Å; Q434-T463 WeakPolarHBondContact CA-O 3.34Å; E435-T463 PolarHBondContact N-O 3.08Å
464	D	98.7	Very high	97.8	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.005	21%	0.205	C	C	.	.			trans	-96.9	163.8	-179	74.1	-69.9	0	0	0	113.3	A388 L391 V433 R457 R458	A388-D464 HydrophobicContact CB-CB 3.92Å; L391-D464 HydrophobicContact CD1-CB 4.17Å; V433-D464 CarbonylContact O-C 3.47Å; R457-D464 WeakPolarHBondContact CG-O 3.18Å; R458-D464 WeakPolarHBondContact CB-O 3.34Å; R458-D464 VanDerWaalsContact CD-CG 3.45Å; R458-D464 WeakPolarHBondContact CD-OD1 3.09Å; R458-D464 WeakPolarHBondContact CD-OD2 3.41Å; R458-D464 WeakPolarHBondContact CG-O 3.3Å; R458-D464 IonicContact CZ-OD1 2.8Å; R458-D464 IonicContact CZ-OD2 3.96Å; R458-D464 PolarHBondContact N-O 3.35Å; R458-D464 IonicContact NE-OD1 2.76Å; R458-D464 IonicContact NE-OD2 3.66Å; R458-D464 IonicContact NH1-OD1 3.05Å; R458-D464 PolarHBondContact NH1-OD1 2.66Å; R458-D464 IonicContact NH1-OD2 3.7Å; R458-D464 PolarHBondContact NH1-OD2 3.35Å
465	G	98.7	Very high	97.7	Very high	2 Å²	2	37.1 Å²	37.1	2%	0.021	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.5	-170.5	-175.8	0	0	0	0	0	114.5	E432 V433 K456	E432-G465 PolarHBondContact N-O 3.47Å; E432-G465 VanDerWaalsContact N-O 3.1Å; V433-G465 PolarHBondContact N-O 2.97Å; V433-G465 PolarHBondContact O-N 3.2Å; K456-G465 CarbonylContact O-C 3.59Å; K456-G465 VanDerWaalsContact O-CA 3.23Å; K456-G465 WeakPolarHBondContact O-CA 3.24Å
466	C	98.9	Very high	97.6	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.007	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	150.5	172.5	-64.5	0	0	0	0	111	L430 Y455 K456 I500 T525	L430-C466 VanDerWaalsContact O-CA 3.27Å; L430-C466 WeakPolarHBondContact O-CA 3.26Å; Y455-C466 WeakPolarHBondContact CD2-O 3.21Å; K456-C466 PolarHBondContact N-O 3.16Å; K456-C466 PolarHBondContact O-N 3.34Å; C466-I500 HydrophobicContact CB-CD1 4.18Å; C466-I500 HydrophobicContact CB-CG1 4.42Å; C466-I500 VanDerWaalsContact O-CD1 3.31Å; C466-I500 WeakPolarHBondContact O-CD1 3.48Å; C466-T525 HydrophobicContact CB-CG2 3.85Å
467	V	98.9	Very high	97.6	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	140.5	168.9	178.7	0	0	0	0	109.3	C429 L430 V433 F438 C453 V454 Y455 C469	C429-V467 CarbonylContact C-O 3.55Å; C429-V467 WeakPolarHBondContact CA-O 3.46Å; L430-V467 HydrophobicContact CB-CB 4.26Å; L430-V467 PolarHBondContact N-O 2.92Å; L430-V467 PolarHBondContact O-N 3.42Å; V433-V467 HydrophobicContact CB-CG2 3.84Å; V433-V467 HydrophobicContact CG1-CG2 3.81Å; V433-V467 HydrophobicContact CG2-CB 4.27Å; V433-V467 HydrophobicContact CG2-CG2 3.71Å; F438-V467 HydrophobicContact CD2-CG2 3.83Å; F438-V467 HydrophobicContact CE2-CG1 4.1Å; F438-V467 HydrophobicContact CE2-CG2 3.6Å; F438-V467 HydrophobicContact CZ-CG2 4.26Å; C453-V467 HydrophobicContact CB-CG1 4.14Å; V454-V467 WeakPolarHBondContact O-CA 3.38Å; Y455-V467 HydrophobicContact CD2-CG2 3.52Å; Y455-V467 HydrophobicContact CE2-CG2 4.29Å; Y455-V467 HydrophobicContact CG-CG2 4.32Å; V467-C469 WeakPolarHBondContact CG1-SG 3.49Å
468	I	98.9	Very high	97.5	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	121	154.3	-55.7	-176.1	0	0	0	108.3	I427 L428 V454 I500 L502 V523 T525	I427-I468 HydrophobicContact CG2-CG2 4.27Å; L428-I468 CarbonylContact O-C 3.56Å; L428-I468 VanDerWaalsContact O-CA 3.31Å; L428-I468 WeakPolarHBondContact O-CA 3.46Å; V454-I468 PolarHBondContact N-O 2.9Å; V454-I468 PolarHBondContact O-N 3.08Å; I468-I500 HydrophobicContact CD1-CB 3.96Å; I468-I500 HydrophobicContact CD1-CG2 3.79Å; I468-I500 HydrophobicContact CG1-CB 4.14Å; I468-I500 HydrophobicContact CG1-CG2 4.04Å; I468-L502 HydrophobicContact CB-CD1 3.83Å; I468-L502 HydrophobicContact CB-CG 4.3Å; I468-L502 HydrophobicContact CD1-CG 4.23Å; I468-L502 HydrophobicContact CG2-CD1 3.71Å; I468-L502 HydrophobicContact CG2-CG 4.37Å; I468-V523 HydrophobicContact CD1-CG1 4.17Å; I468-V523 HydrophobicContact CG2-CG1 4.23Å; I468-T525 HydrophobicContact CD1-CG2 3.83Å; I468-T525 HydrophobicContact CG1-CG2 3.44Å; I468-T525 VanDerWaalsContact CG1-CG2 3.44Å
469	C	98.8	Very high	97.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	150.3	168.2	-57.1	0	0	0	0	110.8	I427 L428 Y451 T452 C453 V467	I427-C469 CarbonylContact C-O 3.56Å; I427-C469 WeakPolarHBondContact CA-O 3.33Å; L428-C469 HydrophobicContact CB-CB 4.13Å; L428-C469 HydrophobicContact CD1-CB 4.11Å; L428-C469 PolarHBondContact N-O 2.86Å; L428-C469 PolarHBondContact O-N 2.85Å; Y451-C469 HydrophobicContact CD1-CB 4.27Å; Y451-C469 HydrophobicContact CG-CB 4.29Å; T452-C469 CarbonylContact O-C 3.56Å; T452-C469 WeakPolarHBondContact O-CA 3.46Å; C453-C469 HydrophobicContact CB-CB 4.08Å; C453-C469 WeakPolarHBondContact CB-SG 3.31Å; C453-C469 WeakPolarHBondContact SG-CB 3.28Å; C453-C469 CovalentContact SG-SG 2.04Å; C453-C469 PolarHBondContact SG-SG 3.21Å; V467-C469 WeakPolarHBondContact CG1-SG 3.49Å
470	Y	98.9	Very high	97.5	Very high	15 Å²	15	43 Å²	43	6%	0.059	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	150.8	176.9	63.7	-93.5	0	0	0	111.6	D426 Y451 T452 G472 F475 Q477 L502 L504	D426-Y470 CarbonylContact O-C 3.57Å; D426-Y470 WeakPolarHBondContact O-CA 3.42Å; Y451-Y470 WeakPolarHBondContact CA-O 3.28Å; T452-Y470 HydrophobicContact CG2-CE1 4.15Å; T452-Y470 HydrophobicContact CG2-CE2 4.5Å; T452-Y470 WeakPolarHBondContact CG2-OH 3.19Å; T452-Y470 PolarHBondContact N-O 2.8Å; T452-Y470 PolarHBondContact O-N 3.31Å; Y470-G472 PolarHBondContact O-N 2.81Å; Y470-F475 HydrophobicContact CD2-CB 3.87Å; Y470-F475 WeakPolarHBondContact CE2-O 3.23Å; Y470-F475 HydrophobicContact CG-CB 4.49Å; Y470-Q477 HydrophobicContact CE1-CB 4.23Å; Y470-Q477 WeakPolarHBondContact OH-CB 3.2Å; Y470-L502 HydrophobicContact CD1-CD1 4.12Å; Y470-L502 HydrophobicContact CE1-CD1 4.23Å; Y470-L504 HydrophobicContact CD1-CD1 4.19Å; Y470-L504 HydrophobicContact CD1-CD2 3.71Å; Y470-L504 HydrophobicContact CD2-CD2 4.43Å; Y470-L504 HydrophobicContact CE1-CD2 3.85Å; Y470-L504 HydrophobicContact CG-CD1 3.98Å; Y470-L504 HydrophobicContact CG-CD2 4.03Å
471	R	98.1	Very high	97.7	Very high	61 Å²	61	41.6 Å²	41.6	23%	0.23	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	109.6	174.9	-79.1	-61.6	-59.5	-128.8	-19.3	111.1	D426 M449 Y451 D473 R474 F475	D426-R471 HydrophobicContact CB-CG 4.5Å; D426-R471 PolarHBondContact O-N 2.88Å; M449-R471 PolarHBondContact O-NH1 3.31Å; Y451-R471 HydrophobicContact CD1-CG 4.12Å; Y451-R471 HydrophobicContact CE1-CG 3.68Å; R471-D473 WeakPolarHBondContact CB-OD1 3.26Å; R471-D473 IonicContact CZ-OD1 3.85Å; R471-D473 IonicContact CZ-OD2 2.95Å; R471-D473 IonicContact NE-OD1 2.7Å; R471-D473 PolarHBondContact NE-OD1 3.08Å; R471-D473 IonicContact NE-OD2 2.76Å; R471-D473 IonicContact NH2-OD1 3.96Å; R471-D473 PolarHBondContact NH2-OD1 3.33Å; R471-D473 IonicContact NH2-OD2 3.51Å; R471-D473 PolarHBondContact NH2-OD2 2.99Å; R471-D473 PolarHBondContact O-N 2.76Å; R471-R474 HydrophobicContact CB-CB 4.02Å; R471-R474 HydrophobicContact CB-CG 4.07Å; R471-R474 PolarHBondContact O-N 3.32Å; R471-F475 PolarHBondContact O-N 2.81Å
472	G	95.1	Very high	97.8	Very high	35 Å²	35	38.7 Å²	38.7	36%	0.361	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-19.6	-173.5	0	0	0	0	0	114.5	G450 Y470 R474	G450-G472 PolarHBondContact O-N 2.96Å; Y470-G472 PolarHBondContact O-N 2.81Å; G472-R474 VanDerWaalsContact C-N 3.28Å
473	D	94.9	Very high	97.9	Very high	75 Å²	75	35.9 Å²	35.9	40%	0.401	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-12.7	170.2	57.1	-39.7	0	0	0	113.4	R471	R471-D473 WeakPolarHBondContact CB-OD1 3.26Å; R471-D473 IonicContact CZ-OD1 3.85Å; R471-D473 IonicContact CZ-OD2 2.95Å; R471-D473 IonicContact NE-OD1 2.7Å; R471-D473 PolarHBondContact NE-OD1 3.08Å; R471-D473 IonicContact NE-OD2 2.76Å; R471-D473 IonicContact NH2-OD1 3.96Å; R471-D473 PolarHBondContact NH2-OD1 3.33Å; R471-D473 IonicContact NH2-OD2 3.51Å; R471-D473 PolarHBondContact NH2-OD2 2.99Å; R471-D473 PolarHBondContact O-N 2.76Å
474	R	96.1	Very high	97.9	Very high	63 Å²	63	37.4 Å²	37.4	24%	0.238	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.4	-22.7	-173.4	-59.3	-159.4	63.5	-166.7	-10.8	114.6	F377 D378 D426 R471 G472 I507	F377-R474 HydrophobicContact CZ-CB 4.29Å; D378-R474 PolarHBondContact O-NH2 3.48Å; D426-R474 VanDerWaalsContact OD1-CD 3.24Å; D426-R474 WeakPolarHBondContact OD1-CD 3.31Å; D426-R474 IonicContact OD1-CZ 2.75Å; D426-R474 IonicContact OD1-NE 3.85Å; D426-R474 IonicContact OD1-NH1 3.81Å; D426-R474 PolarHBondContact OD1-NH1 2.81Å; D426-R474 IonicContact OD2-CZ 3.4Å; D426-R474 IonicContact OD2-NH1 3.15Å; D426-R474 PolarHBondContact OD2-NH1 2.95Å; R471-R474 HydrophobicContact CB-CB 4.02Å; R471-R474 HydrophobicContact CB-CG 4.07Å; R471-R474 PolarHBondContact O-N 3.32Å; G472-R474 VanDerWaalsContact C-N 3.28Å; R474-I507 VanDerWaalsContact C-CG1 3.45Å; R474-I507 WeakPolarHBondContact O-CG1 3.25Å; R474-I507 PolarHBondContact O-N 3.08Å
475	F	97.6	Very high	97.9	Very high	1 Å²	1	37.3 Å²	37.3	0%	0.004	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	137.8	177.6	-60	-94.2	0	0	0	110.9	F377 F379 D426 I427 Y470 R471 L504 Q505 P506 L521	F377-F475 AromaticContact CE1-CE1 3.85Å; F377-F475 HydrophobicContact CE1-CE1 3.85Å; F377-F475 HydrophobicContact CE1-CE2 4.24Å; F377-F475 AromaticContact CE1-CZ 3.54Å; F377-F475 HydrophobicContact CE1-CZ 3.54Å; F377-F475 HydrophobicContact CZ-CE1 4.13Å; F377-F475 HydrophobicContact CZ-CE2 4.06Å; F377-F475 AromaticContact CZ-CZ 3.78Å; F377-F475 HydrophobicContact CZ-CZ 3.78Å; F379-F475 HydrophobicContact CB-CZ 4.01Å; F379-F475 AromaticContact CD2-CZ 3.92Å; F379-F475 HydrophobicContact CD2-CZ 3.92Å; F379-F475 AromaticContact CG-CZ 3.98Å; F379-F475 HydrophobicContact CG-CZ 3.98Å; D426-F475 HydrophobicContact CB-CE2 4.04Å; I427-F475 HydrophobicContact CD1-CE1 4.03Å; I427-F475 HydrophobicContact CD1-CE2 4.08Å; I427-F475 HydrophobicContact CD1-CZ 3.71Å; I427-F475 HydrophobicContact CG1-CD2 4.45Å; I427-F475 HydrophobicContact CG1-CE2 3.99Å; I427-F475 HydrophobicContact CG1-CZ 4.14Å; Y470-F475 HydrophobicContact CD2-CB 3.87Å; Y470-F475 WeakPolarHBondContact CE2-O 3.23Å; Y470-F475 HydrophobicContact CG-CB 4.49Å; R471-F475 PolarHBondContact O-N 2.81Å; F475-L504 HydrophobicContact CB-CB 4.3Å; F475-L504 HydrophobicContact CB-CD1 4.28Å; F475-L504 HydrophobicContact CD1-CB 3.99Å; F475-L504 HydrophobicContact CD1-CD1 4.22Å; F475-L504 HydrophobicContact CG-CB 4.49Å; F475-L504 HydrophobicContact CG-CD1 4.25Å; F475-Q505 WeakPolarHBondContact CA-O 3.46Å; F475-P506 HydrophobicContact CD1-CB 4.35Å; F475-P506 HydrophobicContact CD1-CG 4.2Å; F475-P506 HydrophobicContact CE1-CB 4.24Å; F475-P506 HydrophobicContact CE1-CG 4.01Å; F475-L521 HydrophobicContact CE1-CD2 3.82Å; F475-L521 HydrophobicContact CZ-CD2 4.5Å
476	S	96.5	Very high	97.8	Very high	50 Å²	50	41.7 Å²	41.7	35%	0.35	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	137.8	163.7	51.1	0	0	0	0	110.8	Q505	S476-Q505 PolarHBondContact N-O 2.88Å; S476-Q505 PolarHBondContact O-N 2.72Å
477	Q	97.8	Very high	97.7	Very high	63 Å²	63	46.9 Å²	46.9	29%	0.294	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	133.6	174.4	177.3	169.9	-52	0	0	110.5	Y470 E480 L504	Y470-Q477 HydrophobicContact CE1-CB 4.23Å; Y470-Q477 WeakPolarHBondContact OH-CB 3.2Å; Q477-E480 PolarHBondContact NE2-OE2 3.25Å; Q477-L504 HydrophobicContact CB-CD2 4.21Å
478	V	97.7	Very high	97.3	Very high	72 Å²	72	51 Å²	51	44%	0.436	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	-39.4	179.3	-175.1	0	0	0	0	111.1	L503 Q505	V478-L503 HydrophobicContact CB-CB 4.26Å; V478-L503 HydrophobicContact CB-CD2 4Å; V478-L503 HydrophobicContact CB-CG 4.01Å; V478-L503 WeakPolarHBondContact CB-O 3.34Å; V478-L503 HydrophobicContact CG1-CD2 3.88Å; V478-L503 HydrophobicContact CG1-CG 4.45Å; V478-L503 HydrophobicContact CG2-CG 4.49Å; V478-L503 PolarHBondContact N-O 2.78Å; V478-Q505 HydrophobicContact CG2-CB 3.6Å
479	S	98.1	Very high	96.9	Very high	45 Å²	45	57.9 Å²	57.9	32%	0.315	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	158.3	173.6	60.2	0	0	0	0	111.2	L503	S479-L503 PolarHBondContact N-O 2.81Å; S479-L503 PolarHBondContact O-N 2.69Å; S479-L503 WeakPolarHBondContact OG-CB 3.08Å
480	E	98.1	Very high	96.6	Very high	99 Å²	99	58.2 Å²	58.2	46%	0.463	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	145.3	173.2	60.1	-177.3	-140.3	0	0	110.2	Q477 L502	Q477-E480 PolarHBondContact NE2-OE2 3.25Å; E480-L502 HydrophobicContact CB-CD2 3.42Å; E480-L502 VanDerWaalsContact CB-CD2 3.42Å
481	S	98.6	Very high	96.3	Very high	27 Å²	27	66.5 Å²	66.5	19%	0.189	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	113.3	173.8	-64.6	0	0	0	0	108.6	V501 E548	S481-V501 PolarHBondContact N-O 2.86Å; S481-V501 PolarHBondContact O-N 2.86Å; S481-E548 VanDerWaalsContact CB-OE1 3.24Å; S481-E548 WeakPolarHBondContact CB-OE1 3.04Å; S481-E548 PolarHBondContact OG-OE1 2.74Å
482	L	98.8	Very high	96.1	Very high	74 Å²	74	64.7 Å²	64.7	39%	0.387	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	112.8	178.2	-49.9	-174.8	0	0	0	108.9	V454 K456 I500	V454-L482 HydrophobicContact CG1-CD2 3.73Å; K456-L482 HydrophobicContact CB-CD2 4.43Å; K456-L482 HydrophobicContact CD-CB 4.17Å; K456-L482 HydrophobicContact CD-CD1 4.41Å; K456-L482 HydrophobicContact CG-CB 4.34Å; L482-I500 HydrophobicContact CD2-CG1 4.15Å; L482-I500 HydrophobicContact CD2-CG2 4.01Å
483	L	98.5	Very high	96.2	Very high	17 Å²	17	63 Å²	63	9%	0.089	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	127.2	-172.3	-63.1	179.6	0	0	0	111.7	F485 V498 G499 V501 L545 E548	L483-F485 HydrophobicContact CB-CE1 4.05Å; L483-F485 HydrophobicContact CD1-CE1 4.19Å; L483-V498 WeakPolarHBondContact O-CA 3.16Å; L483-V498 VanDerWaalsContact O-CB 3.26Å; L483-V498 WeakPolarHBondContact O-CB 3.37Å; L483-G499 PolarHBondContact N-O 3.11Å; L483-G499 PolarHBondContact O-N 3.28Å; L483-V501 HydrophobicContact CD1-CG2 4.14Å; L483-L545 HydrophobicContact CD1-CB 4.49Å; L483-L545 HydrophobicContact CD1-CD1 3.71Å; L483-E548 HydrophobicContact CD1-CB 3.85Å; L483-E548 HydrophobicContact CD1-CG 4.21Å; L483-E548 HydrophobicContact CD2-CB 4.11Å; L483-E548 HydrophobicContact CD2-CG 4.03Å; L483-E548 HydrophobicContact CG-CB 4.49Å; L483-E548 HydrophobicContact CG-CG 4.42Å
484	E	98.5	Very high	96.2	Very high	84 Å²	84	62 Å²	62	39%	0.393	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	119.4	165.6	-63.2	-179.5	172.9	0	0	108.8	K456 T459 R487 V498 M544	K456-E484 IonicContact NZ-OE1 3.15Å; K456-E484 PolarHBondContact NZ-OE1 2.93Å; T459-E484 HydrophobicContact CG2-CB 4.2Å; T459-E484 VanDerWaalsContact CG2-CD 3.48Å; T459-E484 HydrophobicContact CG2-CG 3.71Å; E484-R487 PolarHBondContact O-NH2 3.06Å; E484-R487 VanDerWaalsContact O-NH2 3.16Å; E484-V498 HydrophobicContact CG-CG1 4.48Å; E484-M544 WeakPolarHBondContact O-CE 3.19Å
485	F	98.2	Very high	96.3	Very high	0 Å²	0	63 Å²	63	0%	0	31%	0.314	C	S	.	.			trans	-84.8	-22	177.4	-54.2	-46.2	0	0	0	112.7	L483 R487 L493 N497 V498 L528 Q541 M544 L545	L483-F485 HydrophobicContact CB-CE1 4.05Å; L483-F485 HydrophobicContact CD1-CE1 4.19Å; F485-R487 PolarHBondContact O-N 2.8Å; F485-L493 WeakPolarHBondContact O-CB 3.38Å; F485-N497 WeakPolarHBondContact CB-O 3.24Å; F485-N497 VanDerWaalsContact CD2-C 3.44Å; F485-N497 HydrophobicContact CD2-CB 3.78Å; F485-N497 VanDerWaalsContact CD2-O 3.25Å; F485-N497 WeakPolarHBondContact CD2-O 3.47Å; F485-N497 HydrophobicContact CE2-CB 4.47Å; F485-N497 PolarHBondContact N-O 2.88Å; F485-N497 VanDerWaalsContact N-O 3.16Å; F485-V498 VanDerWaalsContact CE2-C 3.48Å; F485-L528 HydrophobicContact CE2-CD2 4.36Å; F485-Q541 HydrophobicContact CB-CB 4.5Å; F485-Q541 HydrophobicContact CB-CG 3.81Å; F485-Q541 HydrophobicContact CD1-CB 4.49Å; F485-Q541 HydrophobicContact CD2-CB 3.88Å; F485-Q541 HydrophobicContact CD2-CG 3.81Å; F485-Q541 WeakPolarHBondContact CE1-O 3.44Å; F485-Q541 HydrophobicContact CE2-CB 4.2Å; F485-Q541 HydrophobicContact CG-CB 4.05Å; F485-Q541 HydrophobicContact CG-CG 3.88Å; F485-M544 HydrophobicContact CB-SD 4.26Å; F485-M544 HydrophobicContact CD1-CB 3.73Å; F485-M544 HydrophobicContact CD1-CE 4.12Å; F485-M544 HydrophobicContact CD1-CG 4.44Å; F485-M544 HydrophobicContact CD1-SD 3.93Å; F485-M544 HydrophobicContact CE1-CB 3.83Å; F485-L545 HydrophobicContact CE1-CB 4.35Å; F485-L545 HydrophobicContact CZ-CB 4.2Å
486	Y	97.6	Very high	96.3	Very high	94 Å²	94	64.9 Å²	64.9	37%	0.369	32%	0.324	S	S	.	.			trans	-59.1	134.3	171.7	178.7	-105.7	0	0	0	111	P488 L493 R495	Y486-P488 HydrophobicContact CE1-CB 3.96Å; Y486-P488 HydrophobicContact CE1-CG 4.1Å; Y486-L493 WeakPolarHBondContact CA-O 3.4Å; Y486-L493 WeakPolarHBondContact CD2-O 3.25Å; Y486-R495 PolarHBondContact N-O 2.85Å
487	R	95.2	Very high	96.4	Very high	109 Å²	109	62.6 Å²	62.6	41%	0.411	31%	0.308	S	S	.	.			trans	-141.1	106.1	175.8	-64.4	-66	159.3	152.8	-3	109.9	E484 F485 E489 C490 L493	E484-R487 PolarHBondContact O-NH2 3.06Å; E484-R487 VanDerWaalsContact O-NH2 3.16Å; F485-R487 PolarHBondContact O-N 2.8Å; R487-E489 PolarHBondContact O-N 3.39Å; R487-E489 VanDerWaalsContact O-N 3.14Å; R487-C490 HydrophobicContact CB-CB 3.89Å; R487-C490 PolarHBondContact O-N 2.99Å; R487-L493 HydrophobicContact CB-CB 4.03Å; R487-L493 HydrophobicContact CB-CD1 4.14Å; R487-L493 HydrophobicContact CG-CB 4.37Å; R487-L493 HydrophobicContact CG-CD1 3.74Å; R487-L493 PolarHBondContact N-O 2.86Å; R487-L493 VanDerWaalsContact N-O 3.11Å
488	P	91.7	Very high	96.4	Very high	87 Å²	87	59.6 Å²	59.6	57%	0.565	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-20.9	-174.9	23.9	-30.6	0	0	0	113.4	Y486 C490	Y486-P488 HydrophobicContact CE1-CB 3.96Å; Y486-P488 HydrophobicContact CE1-CG 4.1Å; P488-C490 VanDerWaalsContact C-N 3.28Å; P488-C490 PolarHBondContact O-N 3.25Å
489	E	90.8	Very high	96.5	Very high	145 Å²	145	56.2 Å²	56.2	68%	0.678	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	4.5	174.8	-48.8	78.5	-173.7	0	0	113.7	R487	R487-E489 PolarHBondContact O-N 3.39Å; R487-E489 VanDerWaalsContact O-N 3.14Å
490	C	91.6	Very high	96.5	Very high	7 Å²	7	54 Å²	54	5%	0.047	26%	0.258	C	S	.	.			trans	-138.7	100.4	-173.5	-173.4	0	0	0	0	111.5	R487 P488 L492 L493 P619	R487-C490 HydrophobicContact CB-CB 3.89Å; R487-C490 PolarHBondContact O-N 2.99Å; P488-C490 VanDerWaalsContact C-N 3.28Å; P488-C490 PolarHBondContact O-N 3.25Å; C490-L492 PolarHBondContact O-N 3.35Å; C490-L493 HydrophobicContact CB-CB 4.32Å; C490-L493 PolarHBondContact O-N 3.23Å; C490-P619 WeakPolarHBondContact SG-CG 3.49Å
491	E	92.5	Very high	96.6	Very high	189 Å²	189	49.3 Å²	49.3	88%	0.883	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-55.2	-22.6	-179.1	-60.4	-179.7	169.1	0	0	114.5
492	L	94.4	Very high	96.6	Very high	22 Å²	22	48 Å²	48	12%	0.115	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-71.3	-31.4	175.2	176.3	61.9	0	0	0	112.9	C490 R534 D536 V537 T540 L617 W618	C490-L492 PolarHBondContact O-N 3.35Å; L492-R534 PolarHBondContact O-NH2 3.4Å; L492-R534 VanDerWaalsContact O-NH2 3.08Å; L492-D536 HydrophobicContact CD1-CB 3.97Å; L492-D536 WeakPolarHBondContact CD1-OD2 3.22Å; L492-V537 HydrophobicContact CD1-CG2 4.21Å; L492-V537 WeakPolarHBondContact O-CG2 3.4Å; L492-T540 HydrophobicContact CD2-CG2 4.24Å; L492-T540 WeakPolarHBondContact CD2-OG1 3.25Å; L492-L617 VanDerWaalsContact CD2-O 3.24Å; L492-L617 WeakPolarHBondContact CD2-O 3.31Å; L492-W618 HydrophobicContact CD2-CB 3.76Å
493	L	96.4	Very high	96.6	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-105.2	47.7	-173.5	-73.5	175.9	0	0	0	111	F485 Y486 R487 C490 R495 V537 T540 Q541 M544 V622	F485-L493 WeakPolarHBondContact O-CB 3.38Å; Y486-L493 WeakPolarHBondContact CA-O 3.4Å; Y486-L493 WeakPolarHBondContact CD2-O 3.25Å; R487-L493 HydrophobicContact CB-CB 4.03Å; R487-L493 HydrophobicContact CB-CD1 4.14Å; R487-L493 HydrophobicContact CG-CB 4.37Å; R487-L493 HydrophobicContact CG-CD1 3.74Å; R487-L493 PolarHBondContact N-O 2.86Å; R487-L493 VanDerWaalsContact N-O 3.11Å; C490-L493 HydrophobicContact CB-CB 4.32Å; C490-L493 PolarHBondContact O-N 3.23Å; L493-R495 PolarHBondContact O-N 2.96Å; L493-R495 VanDerWaalsContact O-N 3.16Å; L493-V537 HydrophobicContact CD2-CG1 4.38Å; L493-T540 HydrophobicContact CD1-CG2 4.03Å; L493-T540 HydrophobicContact CD2-CG2 3.73Å; L493-T540 HydrophobicContact CG-CG2 4.05Å; L493-Q541 HydrophobicContact CD2-CG 4.42Å; L493-M544 HydrophobicContact CD1-SD 3.71Å; L493-M544 HydrophobicContact CD2-SD 4.22Å; L493-V622 HydrophobicContact CD1-CG1 4.32Å; L493-V622 HydrophobicContact CD1-CG2 3.82Å
494	D	95.3	Very high	96.6	Very high	52 Å²	52	44 Å²	44	28%	0.278	21%	0.206	S	C	.	.			trans	-81.2	26.8	-179.3	66.4	-33.1	0	0	0	113.5	R534	D494-R534 IonicContact OD1-CZ 2.67Å; D494-R534 VanDerWaalsContact OD1-CZ 3.25Å; D494-R534 IonicContact OD1-NH1 3.48Å; D494-R534 PolarHBondContact OD1-NH1 2.84Å; D494-R534 IonicContact OD1-NH2 3.45Å; D494-R534 PolarHBondContact OD1-NH2 2.86Å; D494-R534 IonicContact OD2-CZ 3.14Å; D494-R534 IonicContact OD2-NH1 3.71Å; D494-R534 PolarHBondContact OD2-NH1 3.07Å; D494-R534 IonicContact OD2-NH2 2.73Å
495	R	97.7	Very high	96.5	Very high	85 Å²	85	41.2 Å²	41.2	32%	0.321	19%	0.193	S	C	.	.			trans	-139.9	131.6	-169.4	-66.7	-67	179.1	-84.8	-8.7	114.8	Y486 L493 N497 L529	Y486-R495 PolarHBondContact N-O 2.85Å; L493-R495 PolarHBondContact O-N 2.96Å; L493-R495 VanDerWaalsContact O-N 3.16Å; R495-N497 PolarHBondContact O-N 2.92Å; R495-L529 HydrophobicContact CB-CD1 4.32Å; R495-L529 HydrophobicContact CG-CD1 3.84Å; R495-L529 HydrophobicContact CG-CD2 4.03Å
496	D	97.9	Very high	96.4	Very high	40 Å²	40	41.2 Å²	41.2	21%	0.214	19%	0.193	C	C	.	.			trans	-72.5	18.4	-173.4	-55.8	-83.2	0	0	0	116.9	R458 T459 G460 K462	R458-D496 WeakPolarHBondContact CB-O 3.39Å; R458-D496 WeakPolarHBondContact CG-O 3.39Å; T459-D496 WeakPolarHBondContact CB-OD1 3.42Å; T459-D496 PolarHBondContact N-O 2.9Å; T459-D496 WeakPolarHBondContact O-CB 3.1Å; T459-D496 WeakPolarHBondContact OG1-CA 3.34Å; T459-D496 WeakPolarHBondContact OG1-CB 3.36Å; T459-D496 PolarHBondContact OG1-OD1 2.81Å; G460-D496 PolarHBondContact N-OD1 2.94Å; K462-D496 HydrophobicContact CG-CB 4.25Å
497	N	98.8	Very high	96.2	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.011	18%	0.179	C	C	.	.			trans	-67	150.9	176	-64.6	94.6	0	0	0	110.7	F485 R495 H527 L528 L529 Q541	F485-N497 WeakPolarHBondContact CB-O 3.24Å; F485-N497 VanDerWaalsContact CD2-C 3.44Å; F485-N497 HydrophobicContact CD2-CB 3.78Å; F485-N497 VanDerWaalsContact CD2-O 3.25Å; F485-N497 WeakPolarHBondContact CD2-O 3.47Å; F485-N497 HydrophobicContact CE2-CB 4.47Å; F485-N497 PolarHBondContact N-O 2.88Å; F485-N497 VanDerWaalsContact N-O 3.16Å; R495-N497 PolarHBondContact O-N 2.92Å; N497-H527 PolarHBondContact ND2-O 2.74Å; N497-L528 VanDerWaalsContact ND2-C 3.29Å; N497-L528 PolarHBondContact ND2-O 3.27Å; N497-L529 PolarHBondContact ND2-N 2.95Å; N497-L529 WeakPolarHBondContact OD1-CA 2.99Å; N497-Q541 PolarHBondContact OD1-NE2 3.22Å; N497-Q541 VanDerWaalsContact OD1-NE2 3.12Å
498	V	98.8	Very high	95.9	Very high	1 Å²	1	35 Å²	35	1%	0.006	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	162.5	-175.7	-67.2	0	0	0	0	110.9	K456 R458 L483 E484 F485 T526	K456-V498 HydrophobicContact CG-CB 3.88Å; K456-V498 HydrophobicContact CG-CG1 4.13Å; K456-V498 HydrophobicContact CG-CG2 4.01Å; R458-V498 HydrophobicContact CG-CG2 3.78Å; L483-V498 WeakPolarHBondContact O-CA 3.16Å; L483-V498 VanDerWaalsContact O-CB 3.26Å; L483-V498 WeakPolarHBondContact O-CB 3.37Å; E484-V498 HydrophobicContact CG-CG1 4.48Å; F485-V498 VanDerWaalsContact CE2-C 3.48Å; V498-T526 PolarHBondContact O-OG1 2.82Å
499	G	98.8	Very high	95.7	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	164.7	168.5	0	0	0	0	0	111.4	L483 T525	L483-G499 PolarHBondContact N-O 3.11Å; L483-G499 PolarHBondContact O-N 3.28Å; G499-T525 CarbonylContact C-O 3.57Å; G499-T525 WeakPolarHBondContact CA-O 3.33Å
500	I	98.9	Very high	95.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	137.7	171.7	-57.2	176.3	0	0	0	107.4	V454 K456 C466 I468 L482 L502 A524 T525	V454-I500 HydrophobicContact CG1-CG2 4.39Å; V454-I500 WeakPolarHBondContact O-CD1 3.43Å; K456-I500 HydrophobicContact CB-CD1 3.82Å; K456-I500 HydrophobicContact CB-CG1 3.7Å; C466-I500 HydrophobicContact CB-CD1 4.18Å; C466-I500 HydrophobicContact CB-CG1 4.42Å; C466-I500 VanDerWaalsContact O-CD1 3.31Å; C466-I500 WeakPolarHBondContact O-CD1 3.48Å; I468-I500 HydrophobicContact CD1-CB 3.96Å; I468-I500 HydrophobicContact CD1-CG2 3.79Å; I468-I500 HydrophobicContact CG1-CB 4.14Å; I468-I500 HydrophobicContact CG1-CG2 4.04Å; L482-I500 HydrophobicContact CD2-CG1 4.15Å; L482-I500 HydrophobicContact CD2-CG2 4.01Å; I500-L502 HydrophobicContact CG2-CD2 3.93Å; I500-L502 HydrophobicContact CG2-CG 4.04Å; I500-A524 CarbonylContact O-C 3.29Å; I500-A524 VanDerWaalsContact O-CA 3.25Å; I500-A524 WeakPolarHBondContact O-CA 3.49Å; I500-T525 HydrophobicContact CB-CG2 4.23Å; I500-T525 PolarHBondContact N-O 2.82Å; I500-T525 PolarHBondContact O-N 3.39Å
501	V	98.9	Very high	94.9	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	119	166.5	-167	0	0	0	0	108.9	S481 L483 C522 V523 A524 L545 E548 I549 I552	S481-V501 PolarHBondContact N-O 2.86Å; S481-V501 PolarHBondContact O-N 2.86Å; L483-V501 HydrophobicContact CD1-CG2 4.14Å; V501-C522 WeakPolarHBondContact CG1-SG 3.47Å; V501-V523 CarbonylContact C-O 3.54Å; V501-V523 WeakPolarHBondContact CA-O 3.38Å; V501-A524 HydrophobicContact CG1-CB 4.26Å; V501-A524 HydrophobicContact CG2-CB 4.07Å; V501-L545 HydrophobicContact CG2-CD1 3.77Å; V501-E548 HydrophobicContact CB-CG 4.12Å; V501-E548 HydrophobicContact CG2-CB 4.23Å; V501-E548 HydrophobicContact CG2-CG 3.84Å; V501-I549 HydrophobicContact CG1-CG1 4Å; V501-I549 HydrophobicContact CG2-CG1 4.09Å; V501-I552 HydrophobicContact CB-CD1 4.09Å; V501-I552 HydrophobicContact CG1-CD1 3.55Å
502	L	98.8	Very high	94.2	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	136.8	173	-60.5	-170.6	0	0	0	110	V454 I468 Y470 E480 I500 L504 C522 V523	V454-L502 HydrophobicContact CB-CD1 4.27Å; V454-L502 HydrophobicContact CB-CD2 4.19Å; V454-L502 HydrophobicContact CG1-CD2 4.21Å; V454-L502 HydrophobicContact CG2-CD1 4Å; V454-L502 HydrophobicContact CG2-CD2 3.99Å; I468-L502 HydrophobicContact CB-CD1 3.83Å; I468-L502 HydrophobicContact CB-CG 4.3Å; I468-L502 HydrophobicContact CD1-CG 4.23Å; I468-L502 HydrophobicContact CG2-CD1 3.71Å; I468-L502 HydrophobicContact CG2-CG 4.37Å; Y470-L502 HydrophobicContact CD1-CD1 4.12Å; Y470-L502 HydrophobicContact CE1-CD1 4.23Å; E480-L502 HydrophobicContact CB-CD2 3.42Å; E480-L502 VanDerWaalsContact CB-CD2 3.42Å; I500-L502 HydrophobicContact CG2-CD2 3.93Å; I500-L502 HydrophobicContact CG2-CG 4.04Å; L502-L504 HydrophobicContact CB-CD2 4.17Å; L502-L504 HydrophobicContact CB-CG 4.33Å; L502-L504 HydrophobicContact CD1-CD2 4.31Å; L502-C522 CarbonylContact O-C 3.43Å; L502-C522 WeakPolarHBondContact O-CA 3.24Å; L502-V523 PolarHBondContact N-O 2.99Å; L502-V523 PolarHBondContact O-N 3.35Å
503	L	98.8	Very high	93.8	Very high	7 Å²	7	40 Å²	40	4%	0.037	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	109	163.4	-174.8	63	0	0	0	108.4	V478 S479 P520 C522 I552	V478-L503 HydrophobicContact CB-CB 4.26Å; V478-L503 HydrophobicContact CB-CD2 4Å; V478-L503 HydrophobicContact CB-CG 4.01Å; V478-L503 WeakPolarHBondContact CB-O 3.34Å; V478-L503 HydrophobicContact CG1-CD2 3.88Å; V478-L503 HydrophobicContact CG1-CG 4.45Å; V478-L503 HydrophobicContact CG2-CG 4.49Å; V478-L503 PolarHBondContact N-O 2.78Å; S479-L503 PolarHBondContact N-O 2.81Å; S479-L503 PolarHBondContact O-N 2.69Å; S479-L503 WeakPolarHBondContact OG-CB 3.08Å; L503-P520 HydrophobicContact CD1-CB 3.74Å; L503-P520 HydrophobicContact CG-CB 4.41Å; L503-C522 HydrophobicContact CD1-CB 4.42Å; L503-I552 HydrophobicContact CB-CG2 4.18Å; L503-I552 HydrophobicContact CD1-CG2 3.86Å; L503-I552 HydrophobicContact CD2-CG2 4.21Å; L503-I552 HydrophobicContact CG-CG2 4.3Å
504	L	98.6	Very high	93.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	149.1	176.6	-59	-174.8	0	0	0	110.9	I427 Y470 F475 Q477 L502 L521 V523	I427-L504 HydrophobicContact CD1-CD1 4.06Å; I427-L504 HydrophobicContact CG1-CD1 4.42Å; Y470-L504 HydrophobicContact CD1-CD1 4.19Å; Y470-L504 HydrophobicContact CD1-CD2 3.71Å; Y470-L504 HydrophobicContact CD2-CD2 4.43Å; Y470-L504 HydrophobicContact CE1-CD2 3.85Å; Y470-L504 HydrophobicContact CG-CD1 3.98Å; Y470-L504 HydrophobicContact CG-CD2 4.03Å; F475-L504 HydrophobicContact CB-CB 4.3Å; F475-L504 HydrophobicContact CB-CD1 4.28Å; F475-L504 HydrophobicContact CD1-CB 3.99Å; F475-L504 HydrophobicContact CD1-CD1 4.22Å; F475-L504 HydrophobicContact CG-CB 4.49Å; F475-L504 HydrophobicContact CG-CD1 4.25Å; Q477-L504 HydrophobicContact CB-CD2 4.21Å; L502-L504 HydrophobicContact CB-CD2 4.17Å; L502-L504 HydrophobicContact CB-CG 4.33Å; L502-L504 HydrophobicContact CD1-CD2 4.31Å; L504-L521 PolarHBondContact N-O 3.4Å; L504-L521 PolarHBondContact O-N 3.06Å; L504-V523 HydrophobicContact CD1-CG2 3.87Å; L504-V523 HydrophobicContact CG-CG2 4.26Å
505	Q	96.6	Very high	92.9	Very high	25 Å²	25	42.1 Å²	42.1	12%	0.117	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	108.6	175.5	172.7	56.8	69.5	0	0	108.5	F475 S476 V478 I507 G518	F475-Q505 WeakPolarHBondContact CA-O 3.46Å; S476-Q505 PolarHBondContact N-O 2.88Å; S476-Q505 PolarHBondContact O-N 2.72Å; V478-Q505 HydrophobicContact CG2-CB 3.6Å; Q505-I507 HydrophobicContact CG-CG2 4.36Å; Q505-I507 PolarHBondContact O-N 3.28Å; Q505-G518 PolarHBondContact NE2-O 3.23Å
506	P	96.1	Very high	92.4	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	134.7	173.7	-21.1	31.3	0	0	0	111	F377 F475 K517 G518 P519 L521 L798 L800	F377-P506 HydrophobicContact CD1-CB 4.13Å; F377-P506 HydrophobicContact CE1-CB 3.87Å; F377-P506 HydrophobicContact CE2-CB 4.39Å; F377-P506 HydrophobicContact CG-CB 4.5Å; F377-P506 HydrophobicContact CZ-CB 4Å; F475-P506 HydrophobicContact CD1-CB 4.35Å; F475-P506 HydrophobicContact CD1-CG 4.2Å; F475-P506 HydrophobicContact CE1-CB 4.24Å; F475-P506 HydrophobicContact CE1-CG 4.01Å; P506-K517 WeakPolarHBondContact O-CA 3.46Å; P506-G518 PolarHBondContact O-N 3Å; P506-P519 WeakPolarHBondContact CD-O 3.13Å; P506-L521 HydrophobicContact CG-CB 4.48Å; P506-L798 HydrophobicContact CG-CD2 4.09Å; P506-L800 HydrophobicContact CB-CD2 4.3Å
507	I	94.1	Very high	92.1	Very high	15 Å²	15	41 Å²	41	8%	0.077	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	151.3	-179.1	54.2	172.4	0	0	0	111.5	F377 R474 Q505 T509 V514 A516 K517	F377-I507 WeakPolarHBondContact CE2-O 3.48Å; R474-I507 VanDerWaalsContact C-CG1 3.45Å; R474-I507 WeakPolarHBondContact O-CG1 3.25Å; R474-I507 PolarHBondContact O-N 3.08Å; Q505-I507 HydrophobicContact CG-CG2 4.36Å; Q505-I507 PolarHBondContact O-N 3.28Å; I507-T509 HydrophobicContact CD1-CG2 4.41Å; I507-V514 HydrophobicContact CB-CG1 4Å; I507-V514 HydrophobicContact CG2-CG1 3.86Å; I507-A516 WeakPolarHBondContact CA-O 3.39Å; I507-K517 HydrophobicContact CG2-CG 4.34Å
508	I	89.5	Confident	91.7	Very high	57 Å²	57	41.1 Å²	41.1	29%	0.292	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	132.9	157.6	-64.2	-177.7	0	0	0	107.6	F377 V514 T515 A516 L800	F377-I508 HydrophobicContact CD2-CG1 4.35Å; I508-V514 CarbonylContact O-C 3.59Å; I508-V514 WeakPolarHBondContact O-CA 3.28Å; I508-T515 PolarHBondContact O-N 3.04Å; I508-T515 PolarHBondContact O-OG1 3.47Å; I508-A516 HydrophobicContact CB-CB 4.2Å; I508-A516 PolarHBondContact N-O 3.05Å; I508-A516 PolarHBondContact O-N 2.86Å; I508-L800 HydrophobicContact CD1-CD1 3.33Å; I508-L800 HydrophobicContact CG1-CD1 3.68Å
509	T	86.1	Confident	91.5	Very high	58 Å²	58	41.8 Å²	41.8	36%	0.356	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	150.1	175.3	47.1	0	0	0	0	111.6	I507 E513 V514	I507-T509 HydrophobicContact CD1-CG2 4.41Å; T509-E513 CarbonylContact C-O 3.28Å; T509-E513 VanDerWaalsContact CA-O 3.23Å; T509-E513 WeakPolarHBondContact CA-O 3.36Å; T509-V514 HydrophobicContact CG2-CG2 4Å
510	Q	82.1	Confident	91.3	Very high	143 Å²	143	42.1 Å²	42.1	67%	0.668	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-128.8	109.2	162.5	-68.5	-174.7	3.3	0	0	107.6	S512 E513 T515	Q510-S512 PolarHBondContact O-N 3.05Å; Q510-E513 PolarHBondContact N-O 2.75Å; Q510-E513 PolarHBondContact O-N 3.47Å; Q510-T515 HydrophobicContact CB-CG2 3.86Å; Q510-T515 HydrophobicContact CG-CG2 3.86Å
511	G	83.3	Confident	91.3	Very high	75 Å²	75	42.1 Å²	42.1	77%	0.773	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.7	-126.2	-163.7	0	0	0	0	0	110.4
512	S	78.9	Confident	91.3	Very high	130 Å²	130	42.1 Å²	42.1	91%	0.909	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-3.4	-180	-52	0	0	0	0	114.5	Q510	Q510-S512 PolarHBondContact O-N 3.05Å
513	E	86.3	Confident	91.3	Very high	150 Å²	150	42.1 Å²	42.1	70%	0.701	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-101.4	139.9	-176.4	-64.8	-171.3	166.7	0	0	111.8	T509 Q510	T509-E513 CarbonylContact C-O 3.28Å; T509-E513 VanDerWaalsContact CA-O 3.23Å; T509-E513 WeakPolarHBondContact CA-O 3.36Å; Q510-E513 PolarHBondContact N-O 2.75Å; Q510-E513 PolarHBondContact O-N 3.47Å
514	V	86.5	Confident	91.3	Very high	49 Å²	49	41.8 Å²	41.8	30%	0.297	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	111.6	177.1	-178.9	0	0	0	0	109.2	I507 I508 T509 A516 K517 V803	I507-V514 HydrophobicContact CB-CG1 4Å; I507-V514 HydrophobicContact CG2-CG1 3.86Å; I508-V514 CarbonylContact O-C 3.59Å; I508-V514 WeakPolarHBondContact O-CA 3.28Å; T509-V514 HydrophobicContact CG2-CG2 4Å; V514-A516 WeakPolarHBondContact CG1-O 3.47Å; V514-K517 HydrophobicContact CG1-CD 4.42Å; V514-K517 HydrophobicContact CG1-CG 3.82Å; V514-V803 HydrophobicContact CG1-CG2 4.3Å; V514-V803 WeakPolarHBondContact O-CG2 3.24Å
515	T	85.8	Confident	91.3	Very high	48 Å²	48	41.8 Å²	41.8	29%	0.294	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	-20.4	-173.7	57.4	0	0	0	0	113.9	I508 Q510 V803	I508-T515 PolarHBondContact O-N 3.04Å; I508-T515 PolarHBondContact O-OG1 3.47Å; Q510-T515 HydrophobicContact CB-CG2 3.86Å; Q510-T515 HydrophobicContact CG-CG2 3.86Å; T515-V803 PolarHBondContact O-N 2.93Å
516	A	87.6	Confident	91.4	Very high	4 Å²	4	40.6 Å²	40.6	3%	0.033	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	149.4	172.8	0	0	0	0	0	111.9	P375 I507 I508 V514 L800 N801	P375-A516 HydrophobicContact CG-CB 4.37Å; I507-A516 WeakPolarHBondContact CA-O 3.39Å; I508-A516 HydrophobicContact CB-CB 4.2Å; I508-A516 PolarHBondContact N-O 3.05Å; I508-A516 PolarHBondContact O-N 2.86Å; V514-A516 WeakPolarHBondContact CG1-O 3.47Å; A516-L800 HydrophobicContact CB-CB 4.31Å; A516-L800 HydrophobicContact CB-CD1 3.88Å; A516-N801 CarbonylContact C-O 3.51Å; A516-N801 WeakPolarHBondContact CA-O 3.3Å
517	K	91.1	Very high	91.6	Very high	97 Å²	97	41.2 Å²	41.2	42%	0.422	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	134.7	178.5	-72.7	176.3	-175	172.6	0	111.1	P506 I507 V514 N801 V803	P506-K517 WeakPolarHBondContact O-CA 3.46Å; I507-K517 HydrophobicContact CG2-CG 4.34Å; V514-K517 HydrophobicContact CG1-CD 4.42Å; V514-K517 HydrophobicContact CG1-CG 3.82Å; K517-N801 PolarHBondContact N-O 3.33Å; K517-N801 PolarHBondContact O-N 2.81Å; K517-N801 PolarHBondContact O-ND2 3.47Å; K517-N801 VanDerWaalsContact O-O 3.13Å; K517-V803 HydrophobicContact CB-CG2 4.26Å; K517-V803 HydrophobicContact CD-CG2 3.85Å; K517-V803 HydrophobicContact CG-CG2 3.7Å
518	G	90.9	Very high	91.8	Very high	5 Å²	5	40.5 Å²	40.5	5%	0.052	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-79.4	172	176.3	0	0	0	0	0	113.6	Q505 P506	Q505-G518 PolarHBondContact NE2-O 3.23Å; P506-G518 PolarHBondContact O-N 3Å
519	P	93.1	Very high	92.2	Very high	15 Å²	15	38.4 Å²	38.4	10%	0.097	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-54.2	143.3	149	25.4	-34.5	0	0	0	110.8	P506 H562 N564 L798 D799	P506-P519 WeakPolarHBondContact CD-O 3.13Å; P519-H562 WeakPolarHBondContact CB-O 3.3Å; P519-N564 WeakPolarHBondContact CG-ND2 3.24Å; P519-L798 HydrophobicContact CG-CD1 4.41Å; P519-D799 WeakPolarHBondContact CD-O 3.49Å
520	P	96.3	Very high	92.7	Very high	6 Å²	6	41.4 Å²	41.4	4%	0.039	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-55.6	152.2	173.2	-26.8	34.8	0	0	0	113.5	L503 E561 C563 N564	L503-P520 HydrophobicContact CD1-CB 3.74Å; L503-P520 HydrophobicContact CG-CB 4.41Å; P520-E561 HydrophobicContact CG-CB 4.31Å; P520-C563 WeakPolarHBondContact O-CA 3.16Å; P520-N564 PolarHBondContact O-N 3.45Å
521	L	98.1	Very high	93.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	107.4	-178.1	178.7	67	0	0	0	109.3	F379 I427 F475 L504 P506 V523 N564 V566 L760	F379-L521 HydrophobicContact CD2-CD2 4.48Å; F379-L521 HydrophobicContact CE2-CD2 3.65Å; F379-L521 HydrophobicContact CZ-CD1 4.29Å; F379-L521 HydrophobicContact CZ-CD2 3.73Å; I427-L521 HydrophobicContact CD1-CD2 3.88Å; F475-L521 HydrophobicContact CE1-CD2 3.82Å; F475-L521 HydrophobicContact CZ-CD2 4.5Å; L504-L521 PolarHBondContact N-O 3.4Å; L504-L521 PolarHBondContact O-N 3.06Å; P506-L521 HydrophobicContact CG-CB 4.48Å; L521-V523 HydrophobicContact CD2-CG2 4.01Å; L521-V523 HydrophobicContact CG-CG2 3.9Å; L521-V523 PolarHBondContact O-N 2.9Å; L521-N564 HydrophobicContact CD1-CB 3.72Å; L521-V566 HydrophobicContact CD1-CG2 4.12Å; L521-L760 HydrophobicContact CD1-CD1 4.15Å
522	C	98.8	Very high	93.9	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	114.8	170.1	-175.1	0	0	0	0	108.9	V501 L502 L503 I552 N564 V565 V566	V501-C522 WeakPolarHBondContact CG1-SG 3.47Å; L502-C522 CarbonylContact O-C 3.43Å; L502-C522 WeakPolarHBondContact O-CA 3.24Å; L503-C522 HydrophobicContact CD1-CB 4.42Å; C522-I552 HydrophobicContact CB-CG2 4.3Å; C522-N564 PolarHBondContact N-O 3.06Å; C522-V565 HydrophobicContact CB-CG2 4.36Å; C522-V565 CarbonylContact O-C 3.57Å; C522-V565 WeakPolarHBondContact O-CA 3.24Å; C522-V566 PolarHBondContact O-N 3.5Å
523	V	98.9	Very high	94.6	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	125.3	175.3	-171.5	0	0	0	0	108.2	I427 I468 V501 L502 L504 L521 V566	I427-V523 HydrophobicContact CD1-CG2 4.05Å; I427-V523 HydrophobicContact CG2-CG1 3.99Å; I468-V523 HydrophobicContact CD1-CG1 4.17Å; I468-V523 HydrophobicContact CG2-CG1 4.23Å; V501-V523 CarbonylContact C-O 3.54Å; V501-V523 WeakPolarHBondContact CA-O 3.38Å; L502-V523 PolarHBondContact N-O 2.99Å; L502-V523 PolarHBondContact O-N 3.35Å; L504-V523 HydrophobicContact CD1-CG2 3.87Å; L504-V523 HydrophobicContact CG-CG2 4.26Å; L521-V523 HydrophobicContact CD2-CG2 4.01Å; L521-V523 HydrophobicContact CG-CG2 3.9Å; L521-V523 PolarHBondContact O-N 2.9Å; V523-V566 CarbonylContact C-O 3.51Å; V523-V566 WeakPolarHBondContact CA-O 3.41Å
524	A	98.9	Very high	95.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	147.8	177.4	0	0	0	0	0	111.6	I500 V501 L545 I549 V566 L567 C568	I500-A524 CarbonylContact O-C 3.29Å; I500-A524 VanDerWaalsContact O-CA 3.25Å; I500-A524 WeakPolarHBondContact O-CA 3.49Å; V501-A524 HydrophobicContact CG1-CB 4.26Å; V501-A524 HydrophobicContact CG2-CB 4.07Å; A524-L545 HydrophobicContact CB-CD1 4.35Å; A524-I549 HydrophobicContact CB-CD1 3.55Å; A524-I549 HydrophobicContact CB-CG1 3.93Å; A524-V566 PolarHBondContact N-O 2.79Å; A524-L567 HydrophobicContact CB-CD1 3.74Å; A524-C568 PolarHBondContact O-N 3.4Å
525	T	98.9	Very high	95.6	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	156.3	168.3	-162.6	0	0	0	0	111.7	Q431 C466 I468 G499 I500 C568	Q431-T525 PolarHBondContact NE2-OG1 3.32Å; C466-T525 HydrophobicContact CB-CG2 3.85Å; I468-T525 HydrophobicContact CD1-CG2 3.83Å; I468-T525 HydrophobicContact CG1-CG2 3.44Å; I468-T525 VanDerWaalsContact CG1-CG2 3.44Å; G499-T525 CarbonylContact C-O 3.57Å; G499-T525 WeakPolarHBondContact CA-O 3.33Å; I500-T525 HydrophobicContact CB-CG2 4.23Å; I500-T525 PolarHBondContact N-O 2.82Å; I500-T525 PolarHBondContact O-N 3.39Å; T525-C568 WeakPolarHBondContact CA-O 3.4Å
526	T	98.9	Very high	96.1	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	159.5	180	-175.6	0	0	0	0	110.4	Q431 V498 L528 L545 G569 D570 F571	Q431-T526 WeakPolarHBondContact CG-O 3.19Å; V498-T526 PolarHBondContact O-OG1 2.82Å; T526-L528 HydrophobicContact CG2-CD2 4.17Å; T526-L528 HydrophobicContact CG2-CG 4.12Å; T526-L528 WeakPolarHBondContact OG1-CD2 3.25Å; T526-L545 HydrophobicContact CG2-CD2 3.58Å; T526-G569 VanDerWaalsContact O-CA 3.25Å; T526-G569 WeakPolarHBondContact O-CA 3.41Å; T526-D570 PolarHBondContact O-N 2.95Å; T526-D570 VanDerWaalsContact O-N 3.15Å; T526-F571 HydrophobicContact CG2-CE1 4.08Å; T526-F571 HydrophobicContact CG2-CE2 4.37Å; T526-F571 HydrophobicContact CG2-CZ 3.96Å
527	H	98.8	Very high	96.6	Very high	14 Å²	14	25 Å²	25	7%	0.065	11%	0.114	C	C	.	.	B	Isolated β-bridge	trans	-122.8	105.6	154.3	-175.9	167.6	0	0	0	106.3	Q431 E432 N497 D570 N572	Q431-H527 HydrophobicContact CB-CB 4.27Å; Q431-H527 HydrophobicContact CG-CB 4.22Å; E432-H527 IonicContact OE1-CE1 3.72Å; E432-H527 PolarHBondContact OE1-CE1 2.9Å; E432-H527 VanDerWaalsContact OE1-CE1 3.31Å; E432-H527 IonicContact OE1-ND1 3.72Å; N497-H527 PolarHBondContact ND2-O 2.74Å; H527-D570 WeakPolarHBondContact CA-O 3.37Å; H527-D570 IonicContact NE2-OD2 3.61Å; H527-N572 PolarHBondContact NE2-ND2 3.41Å
528	L	98.7	Very high	97	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	9%	0.094	C	C	.	.			trans	-70.7	165.5	179.8	-65.1	-173	0	0	0	112.1	F485 N497 T526 F530 Q541 L542 D570 F571 L579	F485-L528 HydrophobicContact CE2-CD2 4.36Å; N497-L528 VanDerWaalsContact ND2-C 3.29Å; N497-L528 PolarHBondContact ND2-O 3.27Å; T526-L528 HydrophobicContact CG2-CD2 4.17Å; T526-L528 HydrophobicContact CG2-CG 4.12Å; T526-L528 WeakPolarHBondContact OG1-CD2 3.25Å; L528-F530 PolarHBondContact O-N 3.42Å; L528-F530 VanDerWaalsContact O-N 3.15Å; L528-Q541 HydrophobicContact CD2-CB 3.69Å; L528-L542 HydrophobicContact CD1-CB 4.39Å; L528-D570 PolarHBondContact N-O 3.35Å; L528-F571 HydrophobicContact CD1-CB 4.12Å; L528-F571 HydrophobicContact CD1-CD1 3.69Å; L528-F571 HydrophobicContact CD1-CG 4.25Å; L528-F571 HydrophobicContact CG-CD1 4.39Å; L528-L579 HydrophobicContact CD1-CD1 4.11Å; L528-L579 HydrophobicContact CD1-CD2 4.39Å
529	L	98.5	Very high	97.4	Very high	12 Å²	12	20.2 Å²	20.2	6%	0.063	9%	0.092	C	C	.	.			trans	-57	120.1	179.3	175.4	64.2	0	0	0	111.9	R495 N497 N531 R534 V537 K538	R495-L529 HydrophobicContact CB-CD1 4.32Å; R495-L529 HydrophobicContact CG-CD1 3.84Å; R495-L529 HydrophobicContact CG-CD2 4.03Å; N497-L529 PolarHBondContact ND2-N 2.95Å; N497-L529 WeakPolarHBondContact OD1-CA 2.99Å; L529-N531 HydrophobicContact CD1-CB 4.14Å; L529-N531 HydrophobicContact CD2-CB 4.14Å; L529-N531 HydrophobicContact CG-CB 3.96Å; L529-N531 PolarHBondContact O-N 3.47Å; L529-R534 HydrophobicContact CD2-CB 3.52Å; L529-R534 HydrophobicContact CD2-CG 4.29Å; L529-V537 HydrophobicContact CD2-CB 3.8Å; L529-V537 HydrophobicContact CD2-CG1 4Å; L529-V537 HydrophobicContact CD2-CG2 4.11Å; L529-K538 HydrophobicContact CB-CG 4.34Å; L529-K538 VanDerWaalsContact O-CE 3.24Å; L529-K538 WeakPolarHBondContact O-CE 3.44Å; L529-K538 PolarHBondContact O-NZ 2.85Å
530	F	96.7	Very high	97.6	Very high	121 Å²	121	19.5 Å²	19.5	53%	0.531	9%	0.087	S	C	.	.			trans	-51.6	-52.1	174.4	175.4	-96.2	0	0	0	113.2	L528 T532 K538 N572 Q601	L528-F530 PolarHBondContact O-N 3.42Å; L528-F530 VanDerWaalsContact O-N 3.15Å; F530-T532 PolarHBondContact O-N 2.88Å; F530-T532 VanDerWaalsContact O-N 3.14Å; F530-K538 PolarHBondContact O-NZ 3Å; F530-N572 WeakPolarHBondContact CA-OD1 3.38Å; F530-N572 WeakPolarHBondContact CD2-OD1 3.27Å; F530-Q601 PolarHBondContact O-NE2 3.38Å; F530-Q601 PolarHBondContact O-OE1 2.98Å
531	N	96	Very high	97.7	Very high	66 Å²	66	19.3 Å²	19.3	35%	0.353	9%	0.086	S	C	.	.			trans	-43	114	-167.4	-173.6	-82.4	0	0	0	114.2	L529 R533 R534 K538	L529-N531 HydrophobicContact CD1-CB 4.14Å; L529-N531 HydrophobicContact CD2-CB 4.14Å; L529-N531 HydrophobicContact CG-CB 3.96Å; L529-N531 PolarHBondContact O-N 3.47Å; N531-R533 PolarHBondContact O-N 3.36Å; N531-R533 PolarHBondContact OD1-N 3.18Å; N531-R533 VanDerWaalsContact OD1-N 3.11Å; N531-R534 HydrophobicContact CB-CB 4.38Å; N531-R534 PolarHBondContact O-N 2.88Å; N531-R534 WeakPolarHBondContact OD1-CG 3.5Å; N531-R534 PolarHBondContact OD1-N 3.1Å; N531-K538 WeakPolarHBondContact O-CE 3.11Å
532	T	93.7	Very high	97.8	Very high	23 Å²	23	19.3 Å²	19.3	14%	0.141	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-23.5	-174.4	61.5	0	0	0	0	114.2	F530 W596 Q601 E602	F530-T532 PolarHBondContact O-N 2.88Å; F530-T532 VanDerWaalsContact O-N 3.14Å; T532-W596 VanDerWaalsContact O-CA 3.29Å; T532-W596 WeakPolarHBondContact O-CA 3.14Å; T532-Q601 HydrophobicContact CG2-CB 3.81Å; T532-E602 WeakPolarHBondContact CB-OE2 3.38Å; T532-E602 HydrophobicContact CG2-CB 3.96Å; T532-E602 PolarHBondContact OG1-OE2 3.42Å
533	R	94.3	Very high	97.8	Very high	125 Å²	125	19.3 Å²	19.3	47%	0.472	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-2.6	-169.4	-45.3	-170.6	179.4	172.4	-5.1	113.7	N531 A595 E602 L604	N531-R533 PolarHBondContact O-N 3.36Å; N531-R533 PolarHBondContact OD1-N 3.18Å; N531-R533 VanDerWaalsContact OD1-N 3.11Å; R533-A595 WeakPolarHBondContact O-CB 3.37Å; R533-E602 IonicContact CZ-OE1 3.84Å; R533-E602 IonicContact CZ-OE2 3.07Å; R533-E602 IonicContact NE-OE1 2.99Å; R533-E602 IonicContact NE-OE2 4Å; R533-E602 PolarHBondContact NE-OE2 3.11Å; R533-E602 IonicContact NH2-OE1 2.7Å; R533-E602 PolarHBondContact NH2-OE1 2.9Å; R533-E602 IonicContact NH2-OE2 2.95Å; R533-E602 PolarHBondContact NH2-OE2 2.98Å; R533-L604 HydrophobicContact CG-CD1 3.83Å
534	R	96.4	Very high	97.7	Very high	38 Å²	38	19.8 Å²	19.8	14%	0.143	9%	0.088	C	C	.	.			trans	-111.3	41.8	-176.6	-73.7	-66.1	-63.5	-86	3.8	112.7	L492 D494 L529 N531 D536 V537 K538	L492-R534 PolarHBondContact O-NH2 3.4Å; L492-R534 VanDerWaalsContact O-NH2 3.08Å; D494-R534 IonicContact OD1-CZ 2.67Å; D494-R534 VanDerWaalsContact OD1-CZ 3.25Å; D494-R534 IonicContact OD1-NH1 3.48Å; D494-R534 PolarHBondContact OD1-NH1 2.84Å; D494-R534 IonicContact OD1-NH2 3.45Å; D494-R534 PolarHBondContact OD1-NH2 2.86Å; D494-R534 IonicContact OD2-CZ 3.14Å; D494-R534 IonicContact OD2-NH1 3.71Å; D494-R534 PolarHBondContact OD2-NH1 3.07Å; D494-R534 IonicContact OD2-NH2 2.73Å; L529-R534 HydrophobicContact CD2-CB 3.52Å; L529-R534 HydrophobicContact CD2-CG 4.29Å; N531-R534 HydrophobicContact CB-CB 4.38Å; N531-R534 PolarHBondContact O-N 2.88Å; N531-R534 WeakPolarHBondContact OD1-CG 3.5Å; N531-R534 PolarHBondContact OD1-N 3.1Å; R534-D536 WeakPolarHBondContact CA-OD1 3.03Å; R534-D536 IonicContact NE-OD1 3.32Å; R534-D536 IonicContact NE-OD2 3.37Å; R534-D536 PolarHBondContact O-N 3.43Å; R534-V537 HydrophobicContact CB-CB 4.41Å; R534-V537 HydrophobicContact CB-CG2 3.85Å; R534-V537 HydrophobicContact CG-CG2 4.4Å; R534-V537 WeakPolarHBondContact O-CA 3.42Å; R534-V537 WeakPolarHBondContact O-CB 3.45Å; R534-V537 PolarHBondContact O-N 2.69Å; R534-K538 PolarHBondContact O-N 2.9Å
535	G	97.4	Very high	97.7	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-61.5	-21.9	177.2	0	0	0	0	0	114.9	V537 K538 L539 A595	G535-V537 VanDerWaalsContact C-N 3.26Å; G535-V537 PolarHBondContact O-N 3.12Å; G535-K538 PolarHBondContact O-N 2.86Å; G535-L539 WeakPolarHBondContact O-CG 3.36Å; G535-L539 PolarHBondContact O-N 3.01Å; G535-A595 VanDerWaalsContact CA-O 3.24Å; G535-A595 WeakPolarHBondContact CA-O 3.46Å; G535-A595 PolarHBondContact N-O 2.99Å
536	D	96.9	Very high	97.7	Very high	4 Å²	4	19.8 Å²	19.8	2%	0.021	9%	0.088	C	C	.	.	H	α-helix	trans	-56.6	-40.1	166.5	58.8	-52.9	0	0	0	112.3	L492 R534 T540 R611 V613 L617	L492-D536 HydrophobicContact CD1-CB 3.97Å; L492-D536 WeakPolarHBondContact CD1-OD2 3.22Å; R534-D536 WeakPolarHBondContact CA-OD1 3.03Å; R534-D536 IonicContact NE-OD1 3.32Å; R534-D536 IonicContact NE-OD2 3.37Å; R534-D536 PolarHBondContact O-N 3.43Å; D536-T540 PolarHBondContact O-N 2.99Å; D536-T540 PolarHBondContact O-OG1 2.7Å; D536-R611 IonicContact OD1-CZ 2.81Å; D536-R611 IonicContact OD1-NH1 2.81Å; D536-R611 PolarHBondContact OD1-NH1 3.4Å; D536-R611 IonicContact OD2-CZ 3.32Å; D536-R611 IonicContact OD2-NH1 3.47Å; D536-R611 PolarHBondContact OD2-NH1 3.07Å; D536-R611 IonicContact OD2-NH2 3.7Å; D536-R611 PolarHBondContact OD2-NH2 2.89Å; D536-V613 HydrophobicContact CB-CG1 4.49Å; D536-V613 HydrophobicContact CB-CG2 4.18Å; D536-L617 HydrophobicContact CB-CD1 4.44Å
537	V	98.2	Very high	97.7	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-73.2	-45.9	175.8	-166	0	0	0	0	110.2	L492 L493 L529 R534 G535 L539 T540 Q541	L492-V537 HydrophobicContact CD1-CG2 4.21Å; L492-V537 WeakPolarHBondContact O-CG2 3.4Å; L493-V537 HydrophobicContact CD2-CG1 4.38Å; L529-V537 HydrophobicContact CD2-CB 3.8Å; L529-V537 HydrophobicContact CD2-CG1 4Å; L529-V537 HydrophobicContact CD2-CG2 4.11Å; R534-V537 HydrophobicContact CB-CB 4.41Å; R534-V537 HydrophobicContact CB-CG2 3.85Å; R534-V537 HydrophobicContact CG-CG2 4.4Å; R534-V537 WeakPolarHBondContact O-CA 3.42Å; R534-V537 WeakPolarHBondContact O-CB 3.45Å; R534-V537 PolarHBondContact O-N 2.69Å; G535-V537 VanDerWaalsContact C-N 3.26Å; G535-V537 PolarHBondContact O-N 3.12Å; V537-L539 VanDerWaalsContact C-N 3.31Å; V537-L539 PolarHBondContact O-N 3.28Å; V537-T540 PolarHBondContact O-N 3.42Å; V537-Q541 HydrophobicContact CG1-CG 4.07Å; V537-Q541 WeakPolarHBondContact O-CB 3.4Å; V537-Q541 WeakPolarHBondContact O-CG 3.36Å; V537-Q541 PolarHBondContact O-N 2.81Å
538	K	98.7	Very high	97.7	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-57.1	-43	180	-57.1	177.9	-170.2	-105.6	0	111.7	L529 F530 N531 R534 G535 L542 N572 L579 S599	L529-K538 HydrophobicContact CB-CG 4.34Å; L529-K538 VanDerWaalsContact O-CE 3.24Å; L529-K538 WeakPolarHBondContact O-CE 3.44Å; L529-K538 PolarHBondContact O-NZ 2.85Å; F530-K538 PolarHBondContact O-NZ 3Å; N531-K538 WeakPolarHBondContact O-CE 3.11Å; R534-K538 PolarHBondContact O-N 2.9Å; G535-K538 PolarHBondContact O-N 2.86Å; K538-L542 VanDerWaalsContact O-CB 3.25Å; K538-L542 WeakPolarHBondContact O-CB 3.18Å; K538-L542 PolarHBondContact O-N 3.31Å; K538-N572 PolarHBondContact NZ-O 2.83Å; K538-L579 HydrophobicContact CB-CD1 3.5Å; K538-L579 HydrophobicContact CD-CD1 4.28Å; K538-S599 WeakPolarHBondContact CE-OG 3.48Å
539	L	98.5	Very high	97.7	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-65	-37	174.1	-70.7	179	0	0	0	112.8	G535 V537 A543 L579 L582 L588 I598 L617 I700	G535-L539 WeakPolarHBondContact O-CG 3.36Å; G535-L539 PolarHBondContact O-N 3.01Å; V537-L539 VanDerWaalsContact C-N 3.31Å; V537-L539 PolarHBondContact O-N 3.28Å; L539-A543 VanDerWaalsContact O-CB 3.31Å; L539-A543 WeakPolarHBondContact O-CB 3.3Å; L539-A543 PolarHBondContact O-N 2.92Å; L539-L579 HydrophobicContact CD2-CB 4.3Å; L539-L579 HydrophobicContact CD2-CG 4.3Å; L539-L582 HydrophobicContact CD2-CD2 4.01Å; L539-L588 HydrophobicContact CD1-CD2 3.91Å; L539-L588 HydrophobicContact CD2-CD2 3.93Å; L539-I598 HydrophobicContact CD1-CD1 3.77Å; L539-I598 HydrophobicContact CD1-CG1 4.33Å; L539-I598 HydrophobicContact CD1-CG2 4.08Å; L539-I598 HydrophobicContact CD2-CG2 4.04Å; L539-I598 HydrophobicContact CG-CD1 4.43Å; L539-I598 HydrophobicContact CG-CG2 3.73Å; L539-L617 HydrophobicContact CB-CD2 3.87Å; L539-L617 HydrophobicContact CD1-CD2 4.04Å; L539-I700 HydrophobicContact CB-CD1 4.38Å; L539-I700 HydrophobicContact CD1-CD1 4.19Å; L539-I700 HydrophobicContact CD2-CD1 4.32Å
540	T	98.4	Very high	97.7	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.006	9%	0.088	C	C	.	.	H	α-helix	trans	-71.7	-42.6	179.4	-50.4	0	0	0	0	111.4	L492 L493 D536 V537 A543 M544 W618 V622	L492-T540 HydrophobicContact CD2-CG2 4.24Å; L492-T540 WeakPolarHBondContact CD2-OG1 3.25Å; L493-T540 HydrophobicContact CD1-CG2 4.03Å; L493-T540 HydrophobicContact CD2-CG2 3.73Å; L493-T540 HydrophobicContact CG-CG2 4.05Å; D536-T540 PolarHBondContact O-N 2.99Å; D536-T540 PolarHBondContact O-OG1 2.7Å; V537-T540 PolarHBondContact O-N 3.42Å; T540-A543 PolarHBondContact O-N 2.76Å; T540-M544 WeakPolarHBondContact O-CG 3.28Å; T540-M544 PolarHBondContact O-N 3.21Å; T540-W618 HydrophobicContact CG2-CB 3.95Å; T540-W618 HydrophobicContact CG2-CD2 4.2Å; T540-W618 HydrophobicContact CG2-CE3 3.8Å; T540-W618 HydrophobicContact CG2-CG 4.28Å; T540-V622 HydrophobicContact CG2-CG1 4.44Å
541	Q	98.8	Very high	97.8	Very high	1 Å²	1	19 Å²	19	1%	0.005	8%	0.082	C	C	.	.	H	α-helix	trans	-59.2	-46.7	172.2	-69.5	175.9	-18.5	0	0	111.1	F485 L493 N497 L528 V537 A543 M544 L545	F485-Q541 HydrophobicContact CB-CB 4.5Å; F485-Q541 HydrophobicContact CB-CG 3.81Å; F485-Q541 HydrophobicContact CD1-CB 4.49Å; F485-Q541 HydrophobicContact CD2-CB 3.88Å; F485-Q541 HydrophobicContact CD2-CG 3.81Å; F485-Q541 WeakPolarHBondContact CE1-O 3.44Å; F485-Q541 HydrophobicContact CE2-CB 4.2Å; F485-Q541 HydrophobicContact CG-CB 4.05Å; F485-Q541 HydrophobicContact CG-CG 3.88Å; L493-Q541 HydrophobicContact CD2-CG 4.42Å; N497-Q541 PolarHBondContact OD1-NE2 3.22Å; N497-Q541 VanDerWaalsContact OD1-NE2 3.12Å; L528-Q541 HydrophobicContact CD2-CB 3.69Å; V537-Q541 HydrophobicContact CG1-CG 4.07Å; V537-Q541 WeakPolarHBondContact O-CB 3.4Å; V537-Q541 WeakPolarHBondContact O-CG 3.36Å; V537-Q541 PolarHBondContact O-N 2.81Å; Q541-A543 PolarHBondContact O-N 2.95Å; Q541-M544 WeakPolarHBondContact O-CB 3.37Å; Q541-M544 PolarHBondContact O-N 2.96Å; Q541-L545 PolarHBondContact O-N 3.15Å
542	L	98.9	Very high	97.9	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-61.3	-42.4	174.6	177.3	60.5	0	0	0	112	L528 K538 M544 L545 L546 F571 L579 L582 I583	L528-L542 HydrophobicContact CD1-CB 4.39Å; K538-L542 VanDerWaalsContact O-CB 3.25Å; K538-L542 WeakPolarHBondContact O-CB 3.18Å; K538-L542 PolarHBondContact O-N 3.31Å; L542-M544 VanDerWaalsContact C-N 3.33Å; L542-M544 PolarHBondContact O-N 3.36Å; L542-L545 PolarHBondContact O-N 2.84Å; L542-L546 HydrophobicContact CD1-CD1 4.06Å; L542-L546 HydrophobicContact CD1-CG 4.03Å; L542-L546 HydrophobicContact CG-CD1 3.82Å; L542-L546 HydrophobicContact CG-CG 4.28Å; L542-L546 WeakPolarHBondContact O-CB 3.43Å; L542-L546 WeakPolarHBondContact O-CG 3.41Å; L542-L546 PolarHBondContact O-N 2.93Å; L542-F571 HydrophobicContact CD1-CD1 4.45Å; L542-F571 HydrophobicContact CD1-CE1 4.04Å; L542-L579 HydrophobicContact CD2-CD2 3.82Å; L542-L579 HydrophobicContact CD2-CG 3.81Å; L542-L582 HydrophobicContact CD2-CD2 4.03Å; L542-I583 HydrophobicContact CD1-CD1 4.03Å; L542-I583 HydrophobicContact CD1-CG1 4.12Å; L542-I583 HydrophobicContact CD2-CD1 3.98Å; L542-I583 HydrophobicContact CD2-CG1 3.74Å
543	A	98.6	Very high	98	Very high	1 Å²	1	16.6 Å²	16.6	1%	0.008	7%	0.07	C	C	.	.	H	α-helix	trans	-63.5	-36.4	176.4	0	0	0	0	0	112.7	L539 T540 Q541 A547 W618 C628	L539-A543 VanDerWaalsContact O-CB 3.31Å; L539-A543 WeakPolarHBondContact O-CB 3.3Å; L539-A543 PolarHBondContact O-N 2.92Å; T540-A543 PolarHBondContact O-N 2.76Å; Q541-A543 PolarHBondContact O-N 2.95Å; A543-A547 WeakPolarHBondContact O-CB 3.36Å; A543-A547 PolarHBondContact O-N 3.43Å; A543-W618 HydrophobicContact CB-CE3 4.36Å; A543-W618 HydrophobicContact CB-CH2 3.27Å; A543-W618 HydrophobicContact CB-CZ2 4.07Å; A543-W618 HydrophobicContact CB-CZ3 3.42Å; A543-W618 VanDerWaalsContact CB-CZ3 3.42Å; A543-C628 HydrophobicContact CB-CB 4.42Å
544	M	98.6	Very high	98.1	Very high	9 Å²	9	14.4 Å²	14.4	4%	0.044	6%	0.062	C	C	.	.	H	α-helix	trans	-62.8	-44.2	172.2	-69.4	174.1	76.8	0	0	112.3	E484 F485 L493 T540 Q541 L542 A547 E548 V622 I624	E484-M544 WeakPolarHBondContact O-CE 3.19Å; F485-M544 HydrophobicContact CB-SD 4.26Å; F485-M544 HydrophobicContact CD1-CB 3.73Å; F485-M544 HydrophobicContact CD1-CE 4.12Å; F485-M544 HydrophobicContact CD1-CG 4.44Å; F485-M544 HydrophobicContact CD1-SD 3.93Å; F485-M544 HydrophobicContact CE1-CB 3.83Å; L493-M544 HydrophobicContact CD1-SD 3.71Å; L493-M544 HydrophobicContact CD2-SD 4.22Å; T540-M544 WeakPolarHBondContact O-CG 3.28Å; T540-M544 PolarHBondContact O-N 3.21Å; Q541-M544 WeakPolarHBondContact O-CB 3.37Å; Q541-M544 PolarHBondContact O-N 2.96Å; L542-M544 VanDerWaalsContact C-N 3.33Å; L542-M544 PolarHBondContact O-N 3.36Å; M544-A547 PolarHBondContact O-N 3.02Å; M544-E548 PolarHBondContact O-N 3.35Å; M544-V622 HydrophobicContact CG-CG1 4.24Å; M544-V622 HydrophobicContact SD-CG1 4.42Å; M544-I624 HydrophobicContact CB-CD1 4.07Å; M544-I624 HydrophobicContact CG-CD1 3.6Å
545	L	98.9	Very high	98.1	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-66	-43.2	176.5	-173.7	62.8	0	0	0	112.3	L483 F485 V501 A524 T526 Q541 L542 A547 E548 I549 L567	L483-L545 HydrophobicContact CD1-CB 4.49Å; L483-L545 HydrophobicContact CD1-CD1 3.71Å; F485-L545 HydrophobicContact CE1-CB 4.35Å; F485-L545 HydrophobicContact CZ-CB 4.2Å; V501-L545 HydrophobicContact CG2-CD1 3.77Å; A524-L545 HydrophobicContact CB-CD1 4.35Å; T526-L545 HydrophobicContact CG2-CD2 3.58Å; Q541-L545 PolarHBondContact O-N 3.15Å; L542-L545 PolarHBondContact O-N 2.84Å; L545-A547 VanDerWaalsContact C-N 3.32Å; L545-A547 PolarHBondContact O-N 2.85Å; L545-E548 PolarHBondContact O-N 3.33Å; L545-I549 HydrophobicContact CD1-CD1 4.47Å; L545-I549 HydrophobicContact CG-CD1 4.09Å; L545-I549 WeakPolarHBondContact O-CD1 3.33Å; L545-I549 VanDerWaalsContact O-CG1 3.29Å; L545-I549 WeakPolarHBondContact O-CG1 3.32Å; L545-I549 PolarHBondContact O-N 3.13Å; L545-I549 VanDerWaalsContact O-N 3.16Å; L545-L567 HydrophobicContact CD2-CD1 3.63Å; L545-L567 HydrophobicContact CG-CD1 4.32Å
546	L	98.8	Very high	98	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-63.3	-36.5	176.9	-70.9	169	0	0	0	112.2	L542 I549 D550 C628 H702 L704	L542-L546 HydrophobicContact CD1-CD1 4.06Å; L542-L546 HydrophobicContact CD1-CG 4.03Å; L542-L546 HydrophobicContact CG-CD1 3.82Å; L542-L546 HydrophobicContact CG-CG 4.28Å; L542-L546 WeakPolarHBondContact O-CB 3.43Å; L542-L546 WeakPolarHBondContact O-CG 3.41Å; L542-L546 PolarHBondContact O-N 2.93Å; L546-I549 PolarHBondContact O-N 2.96Å; L546-D550 VanDerWaalsContact O-CB 3.23Å; L546-D550 WeakPolarHBondContact O-CB 3.39Å; L546-D550 PolarHBondContact O-N 2.83Å; L546-C628 HydrophobicContact CB-CB 3.96Å; L546-C628 HydrophobicContact CD1-CB 4.41Å; L546-H702 HydrophobicContact CD1-CB 4.39Å; L546-L704 HydrophobicContact CD2-CD1 3.73Å
547	A	98.7	Very high	97.8	Very high	0 Å²	0	23 Å²	23	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-67.1	-38.5	178.4	0	0	0	0	0	113.3	A543 M544 L545 Y551 I624 C628 Y630	A543-A547 WeakPolarHBondContact O-CB 3.36Å; A543-A547 PolarHBondContact O-N 3.43Å; M544-A547 PolarHBondContact O-N 3.02Å; L545-A547 VanDerWaalsContact C-N 3.32Å; L545-A547 PolarHBondContact O-N 2.85Å; A547-Y551 VanDerWaalsContact O-CB 3.27Å; A547-Y551 WeakPolarHBondContact O-CB 2.95Å; A547-Y551 PolarHBondContact O-N 2.78Å; A547-I624 HydrophobicContact CB-CD1 3.77Å; A547-I624 HydrophobicContact CB-CG1 4.12Å; A547-I624 HydrophobicContact CB-CG2 4.32Å; A547-C628 WeakPolarHBondContact CA-O 3.15Å; A547-C628 WeakPolarHBondContact CB-O 3.11Å; A547-C628 PolarHBondContact N-O 3.34Å; A547-Y630 HydrophobicContact CB-CD1 4.21Å; A547-Y630 HydrophobicContact CB-CD2 4.34Å; A547-Y630 HydrophobicContact CB-CE1 4.07Å; A547-Y630 HydrophobicContact CB-CE2 4.22Å; A547-Y630 HydrophobicContact CB-CG 4.32Å
548	E	98.8	Very high	97.5	Very high	17 Å²	17	29.1 Å²	29.1	8%	0.079	14%	0.14	C	C	.	.	H	α-helix	trans	-67.7	-46	174.4	-174.4	58.3	-145.2	0	0	111.4	S481 L483 V501 M544 L545 D550 Y551 I552 Y630	S481-E548 VanDerWaalsContact CB-OE1 3.24Å; S481-E548 WeakPolarHBondContact CB-OE1 3.04Å; S481-E548 PolarHBondContact OG-OE1 2.74Å; L483-E548 HydrophobicContact CD1-CB 3.85Å; L483-E548 HydrophobicContact CD1-CG 4.21Å; L483-E548 HydrophobicContact CD2-CB 4.11Å; L483-E548 HydrophobicContact CD2-CG 4.03Å; L483-E548 HydrophobicContact CG-CB 4.49Å; L483-E548 HydrophobicContact CG-CG 4.42Å; V501-E548 HydrophobicContact CB-CG 4.12Å; V501-E548 HydrophobicContact CG2-CB 4.23Å; V501-E548 HydrophobicContact CG2-CG 3.84Å; M544-E548 PolarHBondContact O-N 3.35Å; L545-E548 PolarHBondContact O-N 3.33Å; E548-D550 PolarHBondContact O-N 2.95Å; E548-Y551 WeakPolarHBondContact O-CB 3.41Å; E548-Y551 PolarHBondContact O-N 3.05Å; E548-I552 HydrophobicContact CG-CD1 4.15Å; E548-I552 WeakPolarHBondContact O-CG1 3.29Å; E548-I552 PolarHBondContact O-N 2.82Å; E548-I552 WeakPolarHBondContact OE1-CD1 3.46Å; E548-Y630 HydrophobicContact CB-CE2 4.41Å; E548-Y630 WeakPolarHBondContact OE2-CE2 3.48Å; E548-Y630 PolarHBondContact OE2-OH 3.28Å
549	I	98.8	Very high	97.2	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.3	-44.6	176.8	-62.5	163	0	0	0	110.6	V501 A524 L545 L546 I552 V553 V565 L567 L704	V501-I549 HydrophobicContact CG1-CG1 4Å; V501-I549 HydrophobicContact CG2-CG1 4.09Å; A524-I549 HydrophobicContact CB-CD1 3.55Å; A524-I549 HydrophobicContact CB-CG1 3.93Å; L545-I549 HydrophobicContact CD1-CD1 4.47Å; L545-I549 HydrophobicContact CG-CD1 4.09Å; L545-I549 WeakPolarHBondContact O-CD1 3.33Å; L545-I549 VanDerWaalsContact O-CG1 3.29Å; L545-I549 WeakPolarHBondContact O-CG1 3.32Å; L545-I549 PolarHBondContact O-N 3.13Å; L545-I549 VanDerWaalsContact O-N 3.16Å; L546-I549 PolarHBondContact O-N 2.96Å; I549-I552 PolarHBondContact O-N 2.77Å; I549-V553 HydrophobicContact CG2-CG2 4.27Å; I549-V553 WeakPolarHBondContact O-CB 3.5Å; I549-V553 WeakPolarHBondContact O-CG2 3.19Å; I549-V553 PolarHBondContact O-N 2.89Å; I549-V565 HydrophobicContact CG2-CG1 3.79Å; I549-V565 HydrophobicContact CG2-CG2 4.06Å; I549-L567 HydrophobicContact CD1-CD1 4.15Å; I549-L567 HydrophobicContact CD1-CD2 4.44Å; I549-L704 HydrophobicContact CB-CD1 3.94Å; I549-L704 HydrophobicContact CG2-CD1 3.46Å; I549-L704 VanDerWaalsContact CG2-CD1 3.46Å; I549-L704 HydrophobicContact CG2-CD2 4.02Å; I549-L704 HydrophobicContact CG2-CG 4.4Å
550	D	98.3	Very high	96.8	Very high	9 Å²	9	39 Å²	39	5%	0.048	20%	0.202	C	C	.	.	H	α-helix	trans	-66.3	-34.9	177.2	174	86.8	0	0	0	112.5	L546 E548 R554 Q629 L704	L546-D550 VanDerWaalsContact O-CB 3.23Å; L546-D550 WeakPolarHBondContact O-CB 3.39Å; L546-D550 PolarHBondContact O-N 2.83Å; E548-D550 PolarHBondContact O-N 2.95Å; D550-R554 VanDerWaalsContact O-CB 3.29Å; D550-R554 WeakPolarHBondContact O-CB 3.4Å; D550-R554 WeakPolarHBondContact O-CG 3.33Å; D550-R554 PolarHBondContact O-N 3.35Å; D550-R554 PolarHBondContact O-NE 3.05Å; D550-R554 IonicContact OD2-CZ 3.93Å; D550-R554 IonicContact OD2-NE 2.74Å; D550-R554 PolarHBondContact OD2-NE 2.94Å; D550-R554 IonicContact OD2-NH2 3.97Å; D550-R554 PolarHBondContact OD2-NH2 3.45Å; D550-Q629 PolarHBondContact OD1-NE2 3.41Å; D550-Q629 WeakPolarHBondContact OD2-CG 3.47Å; D550-Q629 PolarHBondContact OD2-NE2 3.45Å; D550-L704 HydrophobicContact CB-CD2 4.35Å
551	Y	98	Very high	96.4	Very high	104 Å²	104	42.4 Å²	42.4	41%	0.408	22%	0.218	S	C	.	.	H	α-helix	trans	-62	-50.6	171.2	171.3	-117.8	0	0	0	111.7	A547 E548 R554 N555 Y630	A547-Y551 VanDerWaalsContact O-CB 3.27Å; A547-Y551 WeakPolarHBondContact O-CB 2.95Å; A547-Y551 PolarHBondContact O-N 2.78Å; E548-Y551 WeakPolarHBondContact O-CB 3.41Å; E548-Y551 PolarHBondContact O-N 3.05Å; Y551-R554 PolarHBondContact O-N 2.93Å; Y551-N555 WeakPolarHBondContact CD2-ND2 3.27Å; Y551-N555 WeakPolarHBondContact CE1-ND2 3.46Å; Y551-N555 WeakPolarHBondContact CE2-ND2 3.31Å; Y551-N555 PolarHBondContact O-N 2.81Å; Y551-N555 PolarHBondContact O-ND2 2.82Å; Y551-Y630 HydrophobicContact CG-CD2 4.43Å
552	I	97.8	Very high	96	Very high	7 Å²	7	44.2 Å²	44.2	4%	0.036	23%	0.227	C	C	.	.	H	α-helix	trans	-60.5	-47.7	177.1	-71.9	168.2	0	0	0	111.2	V501 L503 C522 E548 I549 R554 N555 C556	V501-I552 HydrophobicContact CB-CD1 4.09Å; V501-I552 HydrophobicContact CG1-CD1 3.55Å; L503-I552 HydrophobicContact CB-CG2 4.18Å; L503-I552 HydrophobicContact CD1-CG2 3.86Å; L503-I552 HydrophobicContact CD2-CG2 4.21Å; L503-I552 HydrophobicContact CG-CG2 4.3Å; C522-I552 HydrophobicContact CB-CG2 4.3Å; E548-I552 HydrophobicContact CG-CD1 4.15Å; E548-I552 WeakPolarHBondContact O-CG1 3.29Å; E548-I552 PolarHBondContact O-N 2.82Å; E548-I552 WeakPolarHBondContact OE1-CD1 3.46Å; I549-I552 PolarHBondContact O-N 2.77Å; I552-R554 VanDerWaalsContact C-N 3.33Å; I552-R554 PolarHBondContact O-N 3.3Å; I552-N555 PolarHBondContact O-N 3.2Å; I552-N555 VanDerWaalsContact O-N 3.11Å; I552-C556 PolarHBondContact O-N 2.71Å
553	V	96.8	Very high	95.8	Very high	32 Å²	32	44.7 Å²	44.7	19%	0.194	23%	0.23	C	C	.	.	H	α-helix	trans	-61.5	-39.2	177.5	169.6	0	0	0	0	111.7	I549 K557 C563 V565 L704	I549-V553 HydrophobicContact CG2-CG2 4.27Å; I549-V553 WeakPolarHBondContact O-CB 3.5Å; I549-V553 WeakPolarHBondContact O-CG2 3.19Å; I549-V553 PolarHBondContact O-N 2.89Å; V553-K557 WeakPolarHBondContact O-CB 3.42Å; V553-K557 PolarHBondContact O-N 3.42Å; V553-C563 HydrophobicContact CB-CB 4.44Å; V553-C563 HydrophobicContact CG1-CB 4.45Å; V553-C563 HydrophobicContact CG2-CB 4.09Å; V553-V565 HydrophobicContact CG2-CG2 3.6Å; V553-L704 HydrophobicContact CG2-CD2 4.33Å
554	R	95.6	Very high	95.7	Very high	80 Å²	80	44.7 Å²	44.7	30%	0.302	23%	0.23	S	C	.	.	H	α-helix	trans	-65.1	-40.7	172.6	-83.7	-175.2	-76.4	119.2	-3.9	112.4	D550 Y551 I552 K557 V558	D550-R554 VanDerWaalsContact O-CB 3.29Å; D550-R554 WeakPolarHBondContact O-CB 3.4Å; D550-R554 WeakPolarHBondContact O-CG 3.33Å; D550-R554 PolarHBondContact O-N 3.35Å; D550-R554 PolarHBondContact O-NE 3.05Å; D550-R554 IonicContact OD2-CZ 3.93Å; D550-R554 IonicContact OD2-NE 2.74Å; D550-R554 PolarHBondContact OD2-NE 2.94Å; D550-R554 IonicContact OD2-NH2 3.97Å; D550-R554 PolarHBondContact OD2-NH2 3.45Å; Y551-R554 PolarHBondContact O-N 2.93Å; I552-R554 VanDerWaalsContact C-N 3.33Å; I552-R554 PolarHBondContact O-N 3.3Å; R554-K557 WeakPolarHBondContact O-CB 3.42Å; R554-K557 PolarHBondContact O-N 3.48Å; R554-V558 WeakPolarHBondContact O-CG2 3.22Å; R554-V558 PolarHBondContact O-N 3.03Å
555	N	95.9	Very high	95.7	Very high	60 Å²	60	44.5 Å²	44.5	32%	0.321	23%	0.229	S	C	.	.	H	α-helix	trans	-65	-42.4	-179.6	-67.4	-25.4	0	0	0	111.8	Y551 I552 V558 K559	Y551-N555 WeakPolarHBondContact CD2-ND2 3.27Å; Y551-N555 WeakPolarHBondContact CE1-ND2 3.46Å; Y551-N555 WeakPolarHBondContact CE2-ND2 3.31Å; Y551-N555 PolarHBondContact O-N 2.81Å; Y551-N555 PolarHBondContact O-ND2 2.82Å; I552-N555 PolarHBondContact O-N 3.2Å; I552-N555 VanDerWaalsContact O-N 3.11Å; N555-V558 PolarHBondContact O-N 2.89Å; N555-K559 WeakPolarHBondContact O-CG 3.49Å; N555-K559 PolarHBondContact O-N 3.12Å
556	C	95.2	Very high	95.7	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.014	23%	0.229	C	C	.	.	H	α-helix	trans	-58.2	-48.1	168.7	-72.2	0	0	0	0	111.6	I552 V558 K559 G560 E561 C563	I552-C556 PolarHBondContact O-N 2.71Å; C556-V558 VanDerWaalsContact C-N 3.27Å; C556-V558 PolarHBondContact O-N 2.81Å; C556-K559 CarbonylContact O-C 3.56Å; C556-K559 WeakPolarHBondContact O-CA 3.34Å; C556-K559 WeakPolarHBondContact O-CB 3.29Å; C556-K559 PolarHBondContact O-N 3.48Å; C556-G560 PolarHBondContact O-N 3.28Å; C556-E561 CarbonylContact C-O 3.55Å; C556-E561 VanDerWaalsContact C-O 3.28Å; C556-E561 HydrophobicContact CB-CB 4.12Å; C556-E561 WeakPolarHBondContact O-CB 3.28Å; C556-E561 PolarHBondContact O-N 3.16Å; C556-C563 HydrophobicContact CB-CB 3.76Å
557	K	92.9	Very high	95.7	Very high	160 Å²	160	44.5 Å²	44.5	70%	0.696	23%	0.229	S	C	*	.	H	α-helix	trans	-60	-34.5	179.2	-174.7	-174.5	174.2	-168.3	0	113	V553 R554 G560 E561	V553-K557 WeakPolarHBondContact O-CB 3.42Å; V553-K557 PolarHBondContact O-N 3.42Å; R554-K557 WeakPolarHBondContact O-CB 3.42Å; R554-K557 PolarHBondContact O-N 3.48Å; K557-G560 PolarHBondContact O-N 3.2Å; K557-G560 VanDerWaalsContact O-N 3.12Å; K557-E561 WeakPolarHBondContact CA-O 3.2Å; K557-E561 PolarHBondContact N-O 3.06Å
558	V	93.5	Very high	95.8	Very high	128 Å²	128	44.5 Å²	44.5	78%	0.776	23%	0.229	S	C	*	.	H	α-helix	trans	-69	-32.9	174.8	168.8	0	0	0	0	111.9	R554 N555 C556 G560	R554-V558 WeakPolarHBondContact O-CG2 3.22Å; R554-V558 PolarHBondContact O-N 3.03Å; N555-V558 PolarHBondContact O-N 2.89Å; C556-V558 VanDerWaalsContact C-N 3.27Å; C556-V558 PolarHBondContact O-N 2.81Å; V558-G560 PolarHBondContact O-N 3.34Å
559	K	92.5	Very high	95.8	Very high	138 Å²	138	43.7 Å²	43.7	60%	0.6	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-5.5	169.4	-62.7	169.9	179.3	178.5	0	113.6	N555 C556 E561	N555-K559 WeakPolarHBondContact O-CG 3.49Å; N555-K559 PolarHBondContact O-N 3.12Å; C556-K559 CarbonylContact O-C 3.56Å; C556-K559 WeakPolarHBondContact O-CA 3.34Å; C556-K559 WeakPolarHBondContact O-CB 3.29Å; C556-K559 PolarHBondContact O-N 3.48Å; K559-E561 HydrophobicContact CB-CG 4.07Å; K559-E561 VanDerWaalsContact CD-OE2 3.29Å; K559-E561 WeakPolarHBondContact CD-OE2 3.25Å
560	G	90.1	Very high	95.8	Very high	69 Å²	69	43.9 Å²	43.9	71%	0.711	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	86.2	4.5	-173.4	0	0	0	0	0	114.4	C556 K557 V558	C556-G560 PolarHBondContact O-N 3.28Å; K557-G560 PolarHBondContact O-N 3.2Å; K557-G560 VanDerWaalsContact O-N 3.12Å; V558-G560 PolarHBondContact O-N 3.34Å
561	E	89.4	Confident	95.8	Very high	73 Å²	73	43.4 Å²	43.4	34%	0.341	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-90.1	138.7	-175.7	-58.3	170.6	144	0	0	111.2	P520 C556 K557 K559	P520-E561 HydrophobicContact CG-CB 4.31Å; C556-E561 CarbonylContact C-O 3.55Å; C556-E561 VanDerWaalsContact C-O 3.28Å; C556-E561 HydrophobicContact CB-CB 4.12Å; C556-E561 WeakPolarHBondContact O-CB 3.28Å; C556-E561 PolarHBondContact O-N 3.16Å; K557-E561 WeakPolarHBondContact CA-O 3.2Å; K557-E561 PolarHBondContact N-O 3.06Å; K559-E561 HydrophobicContact CB-CG 4.07Å; K559-E561 VanDerWaalsContact CD-OE2 3.29Å; K559-E561 WeakPolarHBondContact CD-OE2 3.25Å
562	H	90.2	Very high	95.8	Very high	39 Å²	39	38.8 Å²	38.8	18%	0.181	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-83.7	118.8	167.1	178.3	-80.9	0	0	0	109.7	P519 N564 Q758 G759	P519-H562 WeakPolarHBondContact CB-O 3.3Å; H562-N564 PolarHBondContact CE1-OD1 3.34Å; H562-N564 VanDerWaalsContact CE1-OD1 3.29Å; H562-Q758 VanDerWaalsContact CD2-CG 3.47Å; H562-Q758 WeakPolarHBondContact CD2-CG 3.38Å; H562-Q758 WeakPolarHBondContact NE2-CB 3.34Å; H562-G759 PolarHBondContact CE1-N 3.23Å
563	C	95.1	Very high	95.8	Very high	10 Å²	10	38.4 Å²	38.4	7%	0.068	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-93	125.3	172.1	-167	0	0	0	0	110.7	P520 V553 C556	P520-C563 WeakPolarHBondContact O-CA 3.16Å; V553-C563 HydrophobicContact CB-CB 4.44Å; V553-C563 HydrophobicContact CG1-CB 4.45Å; V553-C563 HydrophobicContact CG2-CB 4.09Å; C556-C563 HydrophobicContact CB-CB 3.76Å
564	N	97	Very high	95.8	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.011	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	158.1	164.3	-65.2	-58.9	0	0	0	109.8	P519 P520 L521 C522 H562 G759 L760	P519-N564 WeakPolarHBondContact CG-ND2 3.24Å; P520-N564 PolarHBondContact O-N 3.45Å; L521-N564 HydrophobicContact CD1-CB 3.72Å; C522-N564 PolarHBondContact N-O 3.06Å; H562-N564 PolarHBondContact CE1-OD1 3.34Å; H562-N564 VanDerWaalsContact CE1-OD1 3.29Å; N564-G759 WeakPolarHBondContact OD1-CA 3.36Å; N564-G759 PolarHBondContact OD1-N 3.25Å; N564-L760 HydrophobicContact CB-CD2 3.85Å; N564-L760 HydrophobicContact CB-CG 4.08Å
565	V	98.4	Very high	95.9	Very high	5 Å²	5	36.7 Å²	36.7	3%	0.03	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	136.4	177	-176.6	0	0	0	0	110.5	C522 I549 V553 L706 Y738 S739	C522-V565 HydrophobicContact CB-CG2 4.36Å; C522-V565 CarbonylContact O-C 3.57Å; C522-V565 WeakPolarHBondContact O-CA 3.24Å; I549-V565 HydrophobicContact CG2-CG1 3.79Å; I549-V565 HydrophobicContact CG2-CG2 4.06Å; V553-V565 HydrophobicContact CG2-CG2 3.6Å; V565-L706 HydrophobicContact CB-CD2 4.16Å; V565-L706 HydrophobicContact CG1-CD2 3.92Å; V565-Y738 CarbonylContact O-C 3.51Å; V565-Y738 WeakPolarHBondContact O-CA 3.45Å; V565-S739 PolarHBondContact N-OG 3.21Å; V565-S739 PolarHBondContact O-N 3.01Å; V565-S739 PolarHBondContact O-OG 3.27Å
566	V	98.9	Very high	95.7	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	133.3	158.6	176.4	0	0	0	0	107.8	V381 L521 C522 V523 A524 I736 F737 L760	V381-V566 HydrophobicContact CG1-CG1 4.16Å; V381-V566 HydrophobicContact CG2-CG1 4.46Å; L521-V566 HydrophobicContact CD1-CG2 4.12Å; C522-V566 PolarHBondContact O-N 3.5Å; V523-V566 CarbonylContact C-O 3.51Å; V523-V566 WeakPolarHBondContact CA-O 3.41Å; A524-V566 PolarHBondContact N-O 2.79Å; V566-I736 HydrophobicContact CG1-CG2 4.09Å; V566-F737 CarbonylContact C-O 3.5Å; V566-F737 WeakPolarHBondContact CA-O 3.49Å; V566-L760 HydrophobicContact CG2-CD1 3.61Å
567	L	98.9	Very high	95.8	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	109.2	-179.2	165.9	61.4	0	0	0	108	A524 L545 I549 F571 L706 F737	A524-L567 HydrophobicContact CB-CD1 3.74Å; L545-L567 HydrophobicContact CD2-CD1 3.63Å; L545-L567 HydrophobicContact CG-CD1 4.32Å; I549-L567 HydrophobicContact CD1-CD1 4.15Å; I549-L567 HydrophobicContact CD1-CD2 4.44Å; L567-F571 HydrophobicContact CD1-CE1 4.5Å; L567-F571 HydrophobicContact CD1-CZ 3.86Å; L567-F571 HydrophobicContact CD2-CE1 4.37Å; L567-F571 HydrophobicContact CD2-CZ 4.18Å; L567-F571 HydrophobicContact CG-CE1 4.48Å; L567-F571 HydrophobicContact CG-CZ 3.82Å; L567-L706 HydrophobicContact CD2-CD1 3.91Å; L567-F737 HydrophobicContact CB-CB 4.17Å; L567-F737 HydrophobicContact CD2-CD2 4.47Å; L567-F737 HydrophobicContact CG-CD2 4.4Å; L567-F737 PolarHBondContact N-O 3.49Å; L567-F737 WeakPolarHBondContact O-CB 3.46Å; L567-F737 PolarHBondContact O-N 2.98Å
568	C	98.9	Very high	96	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	174.4	-177.2	-69.3	0	0	0	0	111.4	C429 A524 T525 Y735	C429-C568 HydrophobicContact CB-CB 3.48Å; C429-C568 VanDerWaalsContact CB-CB 3.48Å; A524-C568 PolarHBondContact O-N 3.4Å; T525-C568 WeakPolarHBondContact CA-O 3.4Å; C568-Y735 VanDerWaalsContact CA-O 3.3Å; C568-Y735 WeakPolarHBondContact CA-O 3.39Å
569	G	98.7	Very high	96.2	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	125.8	178.9	167.2	0	0	0	0	0	114.9	S383 T526 F571 D734 Y735	S383-G569 PolarHBondContact OG-N 2.57Å; T526-G569 VanDerWaalsContact O-CA 3.25Å; T526-G569 WeakPolarHBondContact O-CA 3.41Å; G569-F571 VanDerWaalsContact O-CD2 3.24Å; G569-F571 WeakPolarHBondContact O-CD2 3.41Å; G569-F571 WeakPolarHBondContact O-CE2 3.35Å; G569-D734 WeakPolarHBondContact O-CA 3.05Å; G569-Y735 PolarHBondContact N-O 3.29Å; G569-Y735 PolarHBondContact O-N 2.98Å; G569-Y735 VanDerWaalsContact O-N 3.08Å
570	D	98.9	Very high	96.5	Very high	3 Å²	3	21.8 Å²	21.8	2%	0.016	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	117.8	169.1	-176.6	-17.7	0	0	0	108.8	Q431 T526 H527 L528 N572 H789	Q431-D570 HydrophobicContact CG-CB 4.4Å; T526-D570 PolarHBondContact O-N 2.95Å; T526-D570 VanDerWaalsContact O-N 3.15Å; H527-D570 WeakPolarHBondContact CA-O 3.37Å; H527-D570 IonicContact NE2-OD2 3.61Å; L528-D570 PolarHBondContact N-O 3.35Å; D570-N572 WeakPolarHBondContact OD1-CA 3.28Å; D570-N572 PolarHBondContact OD1-N 3.31Å; D570-N572 PolarHBondContact OD1-ND2 3.44Å; D570-N572 PolarHBondContact OD2-ND2 3.26Å; D570-H789 IonicContact OD2-CE1 3.43Å; D570-H789 PolarHBondContact OD2-CE1 2.78Å
571	F	98.8	Very high	96.9	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.112	C	C	.	.			trans	-97.9	-7	-179.9	-69.9	-101.9	0	0	0	112.7	T526 L528 L542 L567 G569 A573 L579 I583 V733 Y735 F737	T526-F571 HydrophobicContact CG2-CE1 4.08Å; T526-F571 HydrophobicContact CG2-CE2 4.37Å; T526-F571 HydrophobicContact CG2-CZ 3.96Å; L528-F571 HydrophobicContact CD1-CB 4.12Å; L528-F571 HydrophobicContact CD1-CD1 3.69Å; L528-F571 HydrophobicContact CD1-CG 4.25Å; L528-F571 HydrophobicContact CG-CD1 4.39Å; L542-F571 HydrophobicContact CD1-CD1 4.45Å; L542-F571 HydrophobicContact CD1-CE1 4.04Å; L567-F571 HydrophobicContact CD1-CE1 4.5Å; L567-F571 HydrophobicContact CD1-CZ 3.86Å; L567-F571 HydrophobicContact CD2-CE1 4.37Å; L567-F571 HydrophobicContact CD2-CZ 4.18Å; L567-F571 HydrophobicContact CG-CE1 4.48Å; L567-F571 HydrophobicContact CG-CZ 3.82Å; G569-F571 VanDerWaalsContact O-CD2 3.24Å; G569-F571 WeakPolarHBondContact O-CD2 3.41Å; G569-F571 WeakPolarHBondContact O-CE2 3.35Å; F571-A573 PolarHBondContact O-N 2.8Å; F571-L579 HydrophobicContact CB-CD2 4.24Å; F571-L579 HydrophobicContact CD1-CD2 4.16Å; F571-I583 HydrophobicContact CD1-CD1 3.76Å; F571-I583 HydrophobicContact CE1-CD1 3.74Å; F571-V733 PolarHBondContact N-O 2.9Å; F571-Y735 HydrophobicContact CB-CD2 4.04Å; F571-Y735 HydrophobicContact CB-CE2 4.14Å; F571-Y735 AromaticContact CD2-CD2 3.64Å; F571-Y735 HydrophobicContact CD2-CD2 3.64Å; F571-Y735 HydrophobicContact CD2-CG 4.46Å; F571-Y735 HydrophobicContact CE2-CD2 4.43Å; F571-Y735 HydrophobicContact CG-CD2 4.02Å; F571-F737 HydrophobicContact CD2-CE2 4.35Å; F571-F737 HydrophobicContact CE1-CE2 4.39Å; F571-F737 HydrophobicContact CE2-CD2 4.26Å; F571-F737 HydrophobicContact CE2-CE2 4.09Å; F571-F737 HydrophobicContact CZ-CD2 4.14Å; F571-F737 HydrophobicContact CZ-CE2 4.13Å
572	N	98.6	Very high	97.3	Very high	6 Å²	6	18.6 Å²	18.6	3%	0.032	10%	0.096	C	C	.	.			trans	45.9	49.3	-177.3	-100.8	-91.1	0	0	0	111.1	H527 F530 K538 D570 S599 Q601	H527-N572 PolarHBondContact NE2-ND2 3.41Å; F530-N572 WeakPolarHBondContact CA-OD1 3.38Å; F530-N572 WeakPolarHBondContact CD2-OD1 3.27Å; K538-N572 PolarHBondContact NZ-O 2.83Å; D570-N572 WeakPolarHBondContact OD1-CA 3.28Å; D570-N572 PolarHBondContact OD1-N 3.31Å; D570-N572 PolarHBondContact OD1-ND2 3.44Å; D570-N572 PolarHBondContact OD2-ND2 3.26Å; N572-S599 WeakPolarHBondContact O-CB 3.29Å; N572-Q601 PolarHBondContact O-OE1 2.86Å; N572-Q601 PolarHBondContact OD1-NE2 3.21Å
573	A	97.8	Very high	97.7	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.088	C	C	.	.			trans	-155.3	135.1	-175.3	0	0	0	0	0	111	F571 L579 S599 Y735	F571-A573 PolarHBondContact O-N 2.8Å; A573-L579 HydrophobicContact CB-CB 4.15Å; A573-L579 HydrophobicContact CB-CD1 4.27Å; A573-L579 HydrophobicContact CB-CD2 3.99Å; A573-L579 HydrophobicContact CB-CG 4.36Å; A573-S599 WeakPolarHBondContact CA-O 3.46Å; A573-Y735 WeakPolarHBondContact O-CE2 3.45Å; A573-Y735 PolarHBondContact O-OH 3.22Å
574	L	97.5	Very high	97.8	Very high	48 Å²	48	18.3 Å²	18.3	25%	0.251	10%	0.097	S	C	.	.			trans	-75.5	157.5	-176.7	-56.6	-176.6	0	0	0	112.4	M577 S599 G600 A731 V733	L574-M577 HydrophobicContact CB-CG 3.78Å; L574-M577 WeakPolarHBondContact O-CB 3.5Å; L574-M577 WeakPolarHBondContact O-CG 3.27Å; L574-M577 PolarHBondContact O-N 2.73Å; L574-S599 PolarHBondContact N-O 3.23Å; L574-G600 VanDerWaalsContact CD1-O 3.25Å; L574-G600 WeakPolarHBondContact CD1-O 3.25Å; L574-A731 HydrophobicContact CD2-CB 3.7Å; L574-V733 HydrophobicContact CD2-CG1 4.38Å
575	P	96.1	Very high	97.8	Very high	28 Å²	28	22.1 Å²	22.1	18%	0.182	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	145.9	176.4	-26.2	35.2	0	0	0	112	M577 H712 T732 Y735	P575-M577 PolarHBondContact O-N 3.02Å; P575-H712 HydrophobicContact CB-CB 3.84Å; P575-H712 HydrophobicContact CG-CB 3.69Å; P575-T732 HydrophobicContact CG-CG2 3.66Å; P575-Y735 VanDerWaalsContact CD-OH 3.28Å; P575-Y735 WeakPolarHBondContact CD-OH 3.42Å; P575-Y735 HydrophobicContact CG-CE1 4.36Å
576	N	92.4	Very high	97.7	Very high	88 Å²	88	26.5 Å²	26.5	47%	0.471	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.5	1.2	178.5	-47.9	-61.8	0	0	0	116.2	Q581	N576-Q581 WeakPolarHBondContact O-CG 3.35Å; N576-Q581 PolarHBondContact O-NE2 3.46Å
577	M	96.4	Very high	97.6	Very high	51 Å²	51	32.2 Å²	32.2	25%	0.251	16%	0.163	S	C	.	.	S	Bend	trans	-73.9	160.6	171.7	-60.7	-52.2	-69.5	0	0	111.5	L574 P575 L579 Y580 Q581 M597	L574-M577 HydrophobicContact CB-CG 3.78Å; L574-M577 WeakPolarHBondContact O-CB 3.5Å; L574-M577 WeakPolarHBondContact O-CG 3.27Å; L574-M577 PolarHBondContact O-N 2.73Å; P575-M577 PolarHBondContact O-N 3.02Å; M577-L579 VanDerWaalsContact C-N 3.26Å; M577-L579 PolarHBondContact O-N 3.15Å; M577-Y580 CarbonylContact O-C 3.59Å; M577-Y580 WeakPolarHBondContact O-CA 3.47Å; M577-Y580 WeakPolarHBondContact O-CB 3.4Å; M577-Y580 PolarHBondContact O-N 3.48Å; M577-Q581 WeakPolarHBondContact O-CG 3.18Å; M577-Q581 PolarHBondContact O-N 3.35Å; M577-M597 HydrophobicContact CE-CG 4.32Å; M577-M597 WeakPolarHBondContact CE-O 3.19Å
578	P	98.1	Very high	97.5	Very high	13 Å²	13	32.7 Å²	32.7	8%	0.084	17%	0.165	C	C	.	.	H	α-helix	trans	-48.5	-37.5	-173.5	-31.6	37	0	0	0	116	Q581 L582 L588 L593 M597	P578-Q581 PolarHBondContact O-N 3.04Å; P578-L582 PolarHBondContact O-N 3.43Å; P578-L588 HydrophobicContact CB-CD1 3.76Å; P578-L588 HydrophobicContact CB-CD2 3.91Å; P578-L593 HydrophobicContact CB-CD1 4.31Å; P578-L593 HydrophobicContact CG-CD1 4.27Å; P578-M597 WeakPolarHBondContact CD-O 3.15Å
579	L	98.5	Very high	97.3	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-65.9	-47.5	175.1	-170.3	154.4	0	0	0	112	L528 K538 L539 L542 F571 A573 M577 Q581 L582 I583 I598	L528-L579 HydrophobicContact CD1-CD1 4.11Å; L528-L579 HydrophobicContact CD1-CD2 4.39Å; K538-L579 HydrophobicContact CB-CD1 3.5Å; K538-L579 HydrophobicContact CD-CD1 4.28Å; L539-L579 HydrophobicContact CD2-CB 4.3Å; L539-L579 HydrophobicContact CD2-CG 4.3Å; L542-L579 HydrophobicContact CD2-CD2 3.82Å; L542-L579 HydrophobicContact CD2-CG 3.81Å; F571-L579 HydrophobicContact CB-CD2 4.24Å; F571-L579 HydrophobicContact CD1-CD2 4.16Å; A573-L579 HydrophobicContact CB-CB 4.15Å; A573-L579 HydrophobicContact CB-CD1 4.27Å; A573-L579 HydrophobicContact CB-CD2 3.99Å; A573-L579 HydrophobicContact CB-CG 4.36Å; M577-L579 VanDerWaalsContact C-N 3.26Å; M577-L579 PolarHBondContact O-N 3.15Å; L579-Q581 VanDerWaalsContact C-N 3.32Å; L579-Q581 PolarHBondContact O-N 3.31Å; L579-L582 WeakPolarHBondContact O-CB 3.47Å; L579-L582 PolarHBondContact O-N 2.96Å; L579-I583 HydrophobicContact CD2-CD1 4.07Å; L579-I583 PolarHBondContact O-N 3.39Å; L579-I598 HydrophobicContact CB-CG2 4.11Å; L579-I598 WeakPolarHBondContact CB-O 3.21Å; L579-I598 PolarHBondContact N-O 3.24Å
580	Y	98.4	Very high	97.1	Very high	21 Å²	21	38.4 Å²	38.4	8%	0.082	19%	0.188	C	C	.	.	H	α-helix	trans	-63.1	-38.5	173.9	178.2	-82	0	0	0	111.7	M577 I583 T584 S708 H712 Y735 F737	M577-Y580 CarbonylContact O-C 3.59Å; M577-Y580 WeakPolarHBondContact O-CA 3.47Å; M577-Y580 WeakPolarHBondContact O-CB 3.4Å; M577-Y580 PolarHBondContact O-N 3.48Å; Y580-I583 PolarHBondContact O-N 3.48Å; Y580-T584 HydrophobicContact CD1-CG2 4.28Å; Y580-T584 HydrophobicContact CE1-CG2 3.74Å; Y580-T584 HydrophobicContact CE2-CG2 4.32Å; Y580-T584 PolarHBondContact O-N 3.38Å; Y580-T584 PolarHBondContact O-OG1 3.18Å; Y580-S708 WeakPolarHBondContact OH-CB 3.15Å; Y580-H712 AromaticContact CE2-CE1 3.92Å; Y580-H712 AromaticContact CE2-NE2 3.46Å; Y580-H712 WeakPolarHBondContact CE2-NE2 3.23Å; Y580-H712 AromaticContact CZ-NE2 3.39Å; Y580-H712 PolarHBondContact OH-NE2 2.83Å; Y580-Y735 HydrophobicContact CD2-CD1 4.19Å; Y580-Y735 AromaticContact CD2-CE1 3.64Å; Y580-Y735 HydrophobicContact CD2-CE1 3.64Å; Y580-Y735 HydrophobicContact CD2-CE2 4.38Å; Y580-Y735 AromaticContact CD2-CZ 3.77Å; Y580-Y735 AromaticContact CE2-CD1 3.93Å; Y580-Y735 HydrophobicContact CE2-CD1 3.93Å; Y580-Y735 AromaticContact CE2-CE1 3.61Å; Y580-Y735 HydrophobicContact CE2-CE1 3.61Å; Y580-F737 HydrophobicContact CD2-CE1 4.06Å; Y580-F737 AromaticContact CD2-CZ 3.74Å; Y580-F737 HydrophobicContact CD2-CZ 3.74Å; Y580-F737 AromaticContact CE2-CE1 3.64Å; Y580-F737 HydrophobicContact CE2-CE1 3.64Å; Y580-F737 AromaticContact CE2-CZ 3.74Å; Y580-F737 HydrophobicContact CE2-CZ 3.74Å
581	Q	97.6	Very high	96.8	Very high	76 Å²	76	41 Å²	41	36%	0.355	20%	0.2	S	C	.	.	H	α-helix	trans	-60.3	-47.2	174.5	-69	-176.5	15.5	0	0	110.7	N576 M577 P578 L579 I583 T584 T585	N576-Q581 WeakPolarHBondContact O-CG 3.35Å; N576-Q581 PolarHBondContact O-NE2 3.46Å; M577-Q581 WeakPolarHBondContact O-CG 3.18Å; M577-Q581 PolarHBondContact O-N 3.35Å; P578-Q581 PolarHBondContact O-N 3.04Å; L579-Q581 VanDerWaalsContact C-N 3.32Å; L579-Q581 PolarHBondContact O-N 3.31Å; Q581-I583 VanDerWaalsContact C-N 3.27Å; Q581-I583 PolarHBondContact O-N 3.03Å; Q581-T584 PolarHBondContact O-N 3.3Å; Q581-T584 PolarHBondContact O-OG1 3.11Å; Q581-T585 HydrophobicContact CB-CG2 4.3Å; Q581-T585 WeakPolarHBondContact O-CB 3.42Å; Q581-T585 WeakPolarHBondContact O-CG2 3.34Å; Q581-T585 PolarHBondContact O-N 3.04Å; Q581-T585 PolarHBondContact O-OG1 3.41Å
582	L	98.4	Very high	96.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-51.1	-48.2	177.3	176.8	58.6	0	0	0	111.5	L539 L542 P578 L579 T584 R586 L588 I700 H702	L539-L582 HydrophobicContact CD2-CD2 4.01Å; L542-L582 HydrophobicContact CD2-CD2 4.03Å; P578-L582 PolarHBondContact O-N 3.43Å; L579-L582 WeakPolarHBondContact O-CB 3.47Å; L579-L582 PolarHBondContact O-N 2.96Å; L582-T584 VanDerWaalsContact C-N 3.33Å; L582-T584 PolarHBondContact O-N 3.29Å; L582-R586 CarbonylContact O-C 3.47Å; L582-R586 WeakPolarHBondContact O-CA 3.43Å; L582-R586 PolarHBondContact O-N 2.96Å; L582-L588 HydrophobicContact CB-CB 4.04Å; L582-L588 HydrophobicContact CD1-CB 4.08Å; L582-I700 HydrophobicContact CD1-CG1 4.12Å; L582-I700 HydrophobicContact CD2-CD1 3.58Å; L582-I700 HydrophobicContact CD2-CG1 4.12Å; L582-H702 PolarHBondContact O-NE2 3.16Å
583	I	98.4	Very high	96.1	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-62.4	-38	-178.8	-58.8	173.3	0	0	0	112.2	L542 F571 L579 Y580 Q581 H702 L706 F737	L542-I583 HydrophobicContact CD1-CD1 4.03Å; L542-I583 HydrophobicContact CD1-CG1 4.12Å; L542-I583 HydrophobicContact CD2-CD1 3.98Å; L542-I583 HydrophobicContact CD2-CG1 3.74Å; F571-I583 HydrophobicContact CD1-CD1 3.76Å; F571-I583 HydrophobicContact CE1-CD1 3.74Å; L579-I583 HydrophobicContact CD2-CD1 4.07Å; L579-I583 PolarHBondContact O-N 3.39Å; Y580-I583 PolarHBondContact O-N 3.48Å; Q581-I583 VanDerWaalsContact C-N 3.27Å; Q581-I583 PolarHBondContact O-N 3.03Å; I583-H702 WeakPolarHBondContact CA-NE2 3.36Å; I583-H702 PolarHBondContact O-CE1 3.34Å; I583-H702 PolarHBondContact O-NE2 3.34Å; I583-L706 HydrophobicContact CG2-CB 4.17Å; I583-L706 HydrophobicContact CG2-CD1 3.89Å; I583-F737 HydrophobicContact CB-CE1 4.38Å; I583-F737 HydrophobicContact CB-CZ 4.3Å; I583-F737 HydrophobicContact CD1-CD2 4.3Å; I583-F737 HydrophobicContact CD1-CE2 3.6Å; I583-F737 HydrophobicContact CD1-CZ 3.87Å; I583-F737 HydrophobicContact CG2-CD1 3.69Å; I583-F737 HydrophobicContact CG2-CD2 3.94Å; I583-F737 HydrophobicContact CG2-CE1 3.77Å; I583-F737 HydrophobicContact CG2-CE2 3.99Å; I583-F737 HydrophobicContact CG2-CG 3.79Å; I583-F737 HydrophobicContact CG2-CZ 3.92Å
584	T	96.9	Very high	96	Very high	42 Å²	42	43.9 Å²	43.9	26%	0.258	22%	0.22	S	C	.	.	H	α-helix	trans	-100.2	-37	-167.6	52.6	0	0	0	0	114.4	Y580 Q581 L582 F737	Y580-T584 HydrophobicContact CD1-CG2 4.28Å; Y580-T584 HydrophobicContact CE1-CG2 3.74Å; Y580-T584 HydrophobicContact CE2-CG2 4.32Å; Y580-T584 PolarHBondContact O-N 3.38Å; Y580-T584 PolarHBondContact O-OG1 3.18Å; Q581-T584 PolarHBondContact O-N 3.3Å; Q581-T584 PolarHBondContact O-OG1 3.11Å; L582-T584 VanDerWaalsContact C-N 3.33Å; L582-T584 PolarHBondContact O-N 3.29Å; T584-F737 HydrophobicContact CG2-CD1 4.3Å; T584-F737 HydrophobicContact CG2-CE1 3.78Å
585	T	96.4	Very high	95.9	Very high	81 Å²	81	41.7 Å²	41.7	50%	0.497	21%	0.208	S	C	.	.	H	α-helix	trans	-82.4	-17.9	170.6	74.1	0	0	0	0	112	Q581 Q587	Q581-T585 HydrophobicContact CB-CG2 4.3Å; Q581-T585 WeakPolarHBondContact O-CB 3.42Å; Q581-T585 WeakPolarHBondContact O-CG2 3.34Å; Q581-T585 PolarHBondContact O-N 3.04Å; Q581-T585 PolarHBondContact O-OG1 3.41Å; T585-Q587 PolarHBondContact O-N 2.86Å; T585-Q587 PolarHBondContact OG1-N 2.7Å; T585-Q587 VanDerWaalsContact OG1-N 3.11Å; T585-Q587 PolarHBondContact OG1-O 2.81Å
586	R	97.3	Very high	95.8	Very high	97 Å²	97	41.1 Å²	41.1	37%	0.366	20%	0.202	S	C	.	.	S	Bend	trans	66.8	9	-171.3	-38.1	179.4	-159.8	154.5	9.6	115.2	L582 S701 H702 L704 N705	L582-R586 CarbonylContact O-C 3.47Å; L582-R586 WeakPolarHBondContact O-CA 3.43Å; L582-R586 PolarHBondContact O-N 2.96Å; R586-S701 CarbonylContact O-C 3.58Å; R586-S701 WeakPolarHBondContact O-CA 3.07Å; R586-S701 WeakPolarHBondContact O-CB 3.49Å; R586-H702 WeakPolarHBondContact CB-O 3.28Å; R586-H702 PolarHBondContact O-N 2.79Å; R586-L704 WeakPolarHBondContact CD-O 3.43Å; R586-L704 WeakPolarHBondContact CG-O 3.3Å; R586-L704 PolarHBondContact NE-O 3.35Å; R586-N705 PolarHBondContact NH2-OD1 3.24Å
587	Q	96.8	Very high	96	Very high	121 Å²	121	40.2 Å²	40.2	57%	0.565	20%	0.196	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-154.6	129.6	-177.4	-174.6	167.7	99.3	0	0	112.5	T585 T699 I700	T585-Q587 PolarHBondContact O-N 2.86Å; T585-Q587 PolarHBondContact OG1-N 2.7Å; T585-Q587 VanDerWaalsContact OG1-N 3.11Å; T585-Q587 PolarHBondContact OG1-O 2.81Å; Q587-T699 HydrophobicContact CG-CG2 3.28Å; Q587-I700 WeakPolarHBondContact CA-O 3.44Å
588	L	97	Very high	96	Very high	9 Å²	9	37.8 Å²	37.8	5%	0.047	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	120	176	175.7	65	0	0	0	110.8	L539 P578 L582 L593 T699 I700	L539-L588 HydrophobicContact CD1-CD2 3.91Å; L539-L588 HydrophobicContact CD2-CD2 3.93Å; P578-L588 HydrophobicContact CB-CD1 3.76Å; P578-L588 HydrophobicContact CB-CD2 3.91Å; L582-L588 HydrophobicContact CB-CB 4.04Å; L582-L588 HydrophobicContact CD1-CB 4.08Å; L588-L593 HydrophobicContact CD1-CD1 4.36Å; L588-T699 CarbonylContact O-C 3.58Å; L588-T699 VanDerWaalsContact O-CA 3.24Å; L588-T699 WeakPolarHBondContact O-CA 3.39Å; L588-I700 HydrophobicContact CB-CG1 4.19Å; L588-I700 PolarHBondContact N-O 3.4Å; L588-I700 PolarHBondContact O-N 3.48Å
589	Y	95.3	Very high	95.9	Very high	120 Å²	120	37.2 Å²	37.2	47%	0.471	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	117.5	160	179.6	-84.1	0	0	0	108.4	H591 Q698	Y589-H591 HydrophobicContact CE1-CB 4.18Å; Y589-H591 WeakPolarHBondContact CE1-O 3.14Å; Y589-H591 HydrophobicContact CE2-CB 4.49Å; Y589-Q698 WeakPolarHBondContact CA-O 3.45Å; Y589-Q698 HydrophobicContact CD2-CB 3.95Å; Y589-Q698 WeakPolarHBondContact CD2-O 3.42Å; Y589-Q698 HydrophobicContact CE2-CB 3.42Å; Y589-Q698 VanDerWaalsContact CE2-CB 3.42Å; Y589-Q698 HydrophobicContact CE2-CG 4.36Å
590	Y	94.1	Very high	95.8	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.187	C	C	.	.			trans	-115.4	-12	-169.1	67.8	-89.4	0	0	0	113.9	G592 L593 V613 F614 A615 L617 R697 Q698 I700	Y590-G592 PolarHBondContact O-N 3.28Å; Y590-L593 WeakPolarHBondContact O-CB 3.4Å; Y590-L593 WeakPolarHBondContact O-CG 3.34Å; Y590-L593 PolarHBondContact O-N 2.98Å; Y590-L593 VanDerWaalsContact O-N 3.16Å; Y590-V613 HydrophobicContact CD2-CG1 3.91Å; Y590-V613 HydrophobicContact CE2-CG1 4.46Å; Y590-F614 WeakPolarHBondContact CE2-O 3.24Å; Y590-A615 HydrophobicContact CE2-CB 4.21Å; Y590-A615 WeakPolarHBondContact OH-CA 3.36Å; Y590-A615 VanDerWaalsContact OH-CB 3.28Å; Y590-A615 WeakPolarHBondContact OH-CB 3.45Å; Y590-L617 HydrophobicContact CD2-CB 4.39Å; Y590-L617 HydrophobicContact CD2-CD1 4.42Å; Y590-L617 HydrophobicContact CE2-CB 3.69Å; Y590-L617 HydrophobicContact CE2-CD1 4.42Å; Y590-L617 HydrophobicContact CE2-CG 4.47Å; Y590-L617 PolarHBondContact OH-N 2.95Å; Y590-R697 WeakPolarHBondContact CE1-O 3.38Å; Y590-R697 PolarHBondContact OH-O 2.95Å; Y590-Q698 VanDerWaalsContact CD1-O 3.24Å; Y590-Q698 WeakPolarHBondContact CD1-O 3.34Å; Y590-Q698 PolarHBondContact N-O 3.41Å; Y590-I700 HydrophobicContact CD1-CB 4.49Å; Y590-I700 HydrophobicContact CD1-CG1 4.11Å; Y590-I700 HydrophobicContact CD1-CG2 4.09Å; Y590-I700 HydrophobicContact CE1-CG2 3.74Å
591	H	91.9	Very high	95.5	Very high	58 Å²	58	38.8 Å²	38.8	27%	0.269	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	118.9	-169.5	-172.2	99.2	0	0	0	112.6	Y589 F614 A615 Q698	Y589-H591 HydrophobicContact CE1-CB 4.18Å; Y589-H591 WeakPolarHBondContact CE1-O 3.14Å; Y589-H591 HydrophobicContact CE2-CB 4.49Å; H591-F614 AromaticContact CE1-CD1 3.87Å; H591-F614 AromaticContact NE2-CD1 3.89Å; H591-A615 PolarHBondContact ND1-N 3.25Å; H591-Q698 HydrophobicContact CB-CB 3.58Å; H591-Q698 HydrophobicContact CB-CG 3.72Å; H591-Q698 PolarHBondContact CD2-NE2 3.14Å
592	G	90.6	Very high	95.2	Very high	17 Å²	17	37.6 Å²	37.6	18%	0.175	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.1	-4.4	-176.6	0	0	0	0	0	114.6	Y590 R612 V613	Y590-G592 PolarHBondContact O-N 3.28Å; G592-R612 WeakPolarHBondContact O-CD 3.4Å; G592-R612 PolarHBondContact O-NH1 3.14Å; G592-V613 PolarHBondContact N-O 3.5Å
593	L	93.2	Very high	94.7	Very high	39 Å²	39	42 Å²	42	20%	0.204	21%	0.21	C	C	.	.			trans	-64.6	145.8	178.8	-67.9	-172.7	0	0	0	111.6	P578 L588 Y590 R612 V613	P578-L593 HydrophobicContact CB-CD1 4.31Å; P578-L593 HydrophobicContact CG-CD1 4.27Å; L588-L593 HydrophobicContact CD1-CD1 4.36Å; Y590-L593 WeakPolarHBondContact O-CB 3.4Å; Y590-L593 WeakPolarHBondContact O-CG 3.34Å; Y590-L593 PolarHBondContact O-N 2.98Å; Y590-L593 VanDerWaalsContact O-N 3.16Å; L593-R612 CarbonylContact O-C 3.46Å; L593-R612 VanDerWaalsContact O-CA 3.28Å; L593-R612 WeakPolarHBondContact O-CA 3.4Å; L593-V613 PolarHBondContact O-N 2.91Å
594	P	95.4	Very high	94.3	Very high	11 Å²	11	42.3 Å²	42.3	7%	0.071	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-63.2	135.9	167.7	-15	28.3	0	0	0	111.1	W596 M597	P594-W596 HydrophobicContact CB-CD2 4.21Å; P594-W596 HydrophobicContact CB-CG 4.21Å; P594-W596 HydrophobicContact CB-CZ2 4.15Å; P594-W596 VanDerWaalsContact CB-NE1 3.32Å; P594-W596 HydrophobicContact CG-CZ2 4.25Å; P594-W596 PolarHBondContact O-N 2.72Å; P594-M597 HydrophobicContact CB-CB 3.9Å; P594-M597 HydrophobicContact CG-CB 3.99Å; P594-M597 HydrophobicContact CG-CE 4.33Å; P594-M597 HydrophobicContact CG-SD 4.14Å; P594-M597 PolarHBondContact O-N 2.82Å
595	A	95.4	Very high	93.8	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.008	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-22.7	-178.3	0	0	0	0	0	113.7	R533 G535 R611 V613	R533-A595 WeakPolarHBondContact O-CB 3.37Å; G535-A595 VanDerWaalsContact CA-O 3.24Å; G535-A595 WeakPolarHBondContact CA-O 3.46Å; G535-A595 PolarHBondContact N-O 2.99Å; A595-R611 HydrophobicContact CB-CB 4.33Å; A595-R611 HydrophobicContact CB-CG 4.48Å; A595-R611 WeakPolarHBondContact CB-O 3.37Å; A595-R611 PolarHBondContact N-O 3.08Å; A595-V613 HydrophobicContact CB-CG2 3.83Å
596	W	94.1	Very high	93.3	Very high	17 Å²	17	47.4 Å²	47.4	6%	0.064	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-35.9	175.1	61.5	-99.6	0	0	0	113	T532 P594 I598 S599 G600 E602 D603 L604 S605 H610	T532-W596 VanDerWaalsContact O-CA 3.29Å; T532-W596 WeakPolarHBondContact O-CA 3.14Å; P594-W596 HydrophobicContact CB-CD2 4.21Å; P594-W596 HydrophobicContact CB-CG 4.21Å; P594-W596 HydrophobicContact CB-CZ2 4.15Å; P594-W596 VanDerWaalsContact CB-NE1 3.32Å; P594-W596 HydrophobicContact CG-CZ2 4.25Å; P594-W596 PolarHBondContact O-N 2.72Å; W596-I598 PolarHBondContact O-N 3Å; W596-I598 VanDerWaalsContact O-N 3.07Å; W596-S599 PolarHBondContact O-N 3.36Å; W596-G600 PolarHBondContact O-N 2.83Å; W596-G600 VanDerWaalsContact O-N 3.08Å; W596-E602 VanDerWaalsContact CE3-O 3.22Å; W596-D603 WeakPolarHBondContact CH2-OD1 3.37Å; W596-D603 VanDerWaalsContact CZ3-OD1 3.29Å; W596-D603 WeakPolarHBondContact CZ3-OD1 3.42Å; W596-L604 HydrophobicContact CB-CB 4.49Å; W596-L604 HydrophobicContact CB-CD1 3.94Å; W596-L604 HydrophobicContact CB-CG 4.49Å; W596-L604 HydrophobicContact CD2-CB 3.79Å; W596-L604 HydrophobicContact CE3-CB 4.45Å; W596-L604 HydrophobicContact CG-CB 3.77Å; W596-L604 HydrophobicContact CG-CD1 4.05Å; W596-L604 HydrophobicContact CG-CG 4.28Å; W596-S605 VanDerWaalsContact CZ2-N 3.32Å; W596-H610 AromaticContact NE1-CG 3.84Å
597	M	95.3	Very high	92.7	Very high	69 Å²	69	45.6 Å²	45.6	34%	0.34	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-17.6	-178.7	178.3	174.9	-80.8	0	0	112.1	M577 P578 P594	M577-M597 HydrophobicContact CE-CG 4.32Å; M577-M597 WeakPolarHBondContact CE-O 3.19Å; P578-M597 WeakPolarHBondContact CD-O 3.15Å; P594-M597 HydrophobicContact CB-CB 3.9Å; P594-M597 HydrophobicContact CG-CB 3.99Å; P594-M597 HydrophobicContact CG-CE 4.33Å; P594-M597 HydrophobicContact CG-SD 4.14Å; P594-M597 PolarHBondContact O-N 2.82Å
598	I	97.1	Very high	91.6	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-41.6	-179	-72.8	169.4	0	0	0	112.8	L539 L579 W596 V613	L539-I598 HydrophobicContact CD1-CD1 3.77Å; L539-I598 HydrophobicContact CD1-CG1 4.33Å; L539-I598 HydrophobicContact CD1-CG2 4.08Å; L539-I598 HydrophobicContact CD2-CG2 4.04Å; L539-I598 HydrophobicContact CG-CD1 4.43Å; L539-I598 HydrophobicContact CG-CG2 3.73Å; L579-I598 HydrophobicContact CB-CG2 4.11Å; L579-I598 WeakPolarHBondContact CB-O 3.21Å; L579-I598 PolarHBondContact N-O 3.24Å; W596-I598 PolarHBondContact O-N 3Å; W596-I598 VanDerWaalsContact O-N 3.07Å; I598-V613 HydrophobicContact CD1-CG2 3.71Å
599	S	96.9	Very high	90.8	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-29.8	173.8	53.5	0	0	0	0	113	K538 N572 A573 L574 W596 Q601	K538-S599 WeakPolarHBondContact CE-OG 3.48Å; N572-S599 WeakPolarHBondContact O-CB 3.29Å; A573-S599 WeakPolarHBondContact CA-O 3.46Å; L574-S599 PolarHBondContact N-O 3.23Å; W596-S599 PolarHBondContact O-N 3.36Å; S599-Q601 PolarHBondContact O-N 3.22Å; S599-Q601 PolarHBondContact OG-OE1 3.08Å
600	G	95.1	Very high	90.1	Very high	14 Å²	14	49.8 Å²	49.8	14%	0.144	26%	0.258	C	S	.	.			trans	73.4	4.1	176.3	0	0	0	0	0	116.1	L574 W596 E602	L574-G600 VanDerWaalsContact CD1-O 3.25Å; L574-G600 WeakPolarHBondContact CD1-O 3.25Å; W596-G600 PolarHBondContact O-N 2.83Å; W596-G600 VanDerWaalsContact O-N 3.08Å; G600-E602 PolarHBondContact O-N 2.84Å
601	Q	92.6	Very high	89.9	Confident	42 Å²	42	56.2 Å²	56.2	20%	0.196	28%	0.282	C	S	.	.	S	Bend	trans	-58.1	-27.9	179.3	-63.6	156.8	-77.6	0	0	113.7	F530 T532 N572 S599	F530-Q601 PolarHBondContact O-NE2 3.38Å; F530-Q601 PolarHBondContact O-OE1 2.98Å; T532-Q601 HydrophobicContact CG2-CB 3.81Å; N572-Q601 PolarHBondContact O-OE1 2.86Å; N572-Q601 PolarHBondContact OD1-NE2 3.21Å; S599-Q601 PolarHBondContact O-N 3.22Å; S599-Q601 PolarHBondContact OG-OE1 3.08Å
602	E	91	Very high	89.9	Confident	50 Å²	50	59 Å²	59	23%	0.234	29%	0.291	C	S	.	.	S	Bend	trans	-137	120.8	-177.6	-176	-171.6	-166.9	0	0	107.9	T532 R533 W596 G600 L604	T532-E602 WeakPolarHBondContact CB-OE2 3.38Å; T532-E602 HydrophobicContact CG2-CB 3.96Å; T532-E602 PolarHBondContact OG1-OE2 3.42Å; R533-E602 IonicContact CZ-OE1 3.84Å; R533-E602 IonicContact CZ-OE2 3.07Å; R533-E602 IonicContact NE-OE1 2.99Å; R533-E602 IonicContact NE-OE2 4Å; R533-E602 PolarHBondContact NE-OE2 3.11Å; R533-E602 IonicContact NH2-OE1 2.7Å; R533-E602 PolarHBondContact NH2-OE1 2.9Å; R533-E602 IonicContact NH2-OE2 2.95Å; R533-E602 PolarHBondContact NH2-OE2 2.98Å; W596-E602 VanDerWaalsContact CE3-O 3.22Å; G600-E602 PolarHBondContact O-N 2.84Å; E602-L604 HydrophobicContact CG-CD2 3.95Å; E602-L604 HydrophobicContact CG-CG 3.95Å; E602-L604 PolarHBondContact O-N 3.22Å; E602-L604 WeakPolarHBondContact OE1-CD2 3.22Å
603	D	89.1	Confident	90	Very high	94 Å²	94	58.6 Å²	58.6	50%	0.503	29%	0.285	S	S	.	.			trans	-77.3	113.2	171.4	-178.4	23.2	0	0	0	110.2	W596 S605 Y606	W596-D603 WeakPolarHBondContact CH2-OD1 3.37Å; W596-D603 VanDerWaalsContact CZ3-OD1 3.29Å; W596-D603 WeakPolarHBondContact CZ3-OD1 3.42Å; D603-S605 VanDerWaalsContact CG-OG 3.24Å; D603-S605 WeakPolarHBondContact OD1-CB 3.41Å; D603-S605 PolarHBondContact OD1-N 3.14Å; D603-S605 PolarHBondContact OD1-OG 2.77Å; D603-S605 PolarHBondContact OD2-OG 3.04Å; D603-Y606 WeakPolarHBondContact O-CE1 3.42Å
604	L	89.1	Confident	89.9	Confident	6 Å²	6	62.1 Å²	62.1	3%	0.031	30%	0.299	C	S	.	.			trans	-111.6	24	174.5	-64	176.5	0	0	0	112.2	R533 W596 E602 Y606 N607	R533-L604 HydrophobicContact CG-CD1 3.83Å; W596-L604 HydrophobicContact CB-CB 4.49Å; W596-L604 HydrophobicContact CB-CD1 3.94Å; W596-L604 HydrophobicContact CB-CG 4.49Å; W596-L604 HydrophobicContact CD2-CB 3.79Å; W596-L604 HydrophobicContact CE3-CB 4.45Å; W596-L604 HydrophobicContact CG-CB 3.77Å; W596-L604 HydrophobicContact CG-CD1 4.05Å; W596-L604 HydrophobicContact CG-CG 4.28Å; E602-L604 HydrophobicContact CG-CD2 3.95Å; E602-L604 HydrophobicContact CG-CG 3.95Å; E602-L604 PolarHBondContact O-N 3.22Å; E602-L604 WeakPolarHBondContact OE1-CD2 3.22Å; L604-Y606 HydrophobicContact CD2-CE1 3.9Å; L604-Y606 VanDerWaalsContact CD2-OH 3.27Å; L604-Y606 WeakPolarHBondContact CD2-OH 3.24Å; L604-Y606 PolarHBondContact O-N 3.23Å; L604-N607 WeakPolarHBondContact O-CB 3.46Å; L604-N607 PolarHBondContact O-N 2.72Å
605	S	87.2	Confident	89.5	Confident	74 Å²	74	62.7 Å²	62.7	52%	0.517	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-30.5	174.7	64.5	0	0	0	0	113.3	W596 D603 N607	W596-S605 VanDerWaalsContact CZ2-N 3.32Å; D603-S605 VanDerWaalsContact CG-OG 3.24Å; D603-S605 WeakPolarHBondContact OD1-CB 3.41Å; D603-S605 PolarHBondContact OD1-N 3.14Å; D603-S605 PolarHBondContact OD1-OG 2.77Å; D603-S605 PolarHBondContact OD2-OG 3.04Å; S605-N607 PolarHBondContact O-N 3.16Å
606	Y	85.4	Confident	89.2	Confident	156 Å²	156	65.4 Å²	65.4	61%	0.612	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-15	176	67.1	-97.7	0	0	0	114	D603 L604	D603-Y606 WeakPolarHBondContact O-CE1 3.42Å; L604-Y606 HydrophobicContact CD2-CE1 3.9Å; L604-Y606 VanDerWaalsContact CD2-OH 3.27Å; L604-Y606 WeakPolarHBondContact CD2-OH 3.24Å; L604-Y606 PolarHBondContact O-N 3.23Å
607	N	83.7	Confident	89.1	Confident	60 Å²	60	65.2 Å²	65.2	32%	0.321	32%	0.322	S	S	.	.			trans	-89	113.4	-178	-170.5	-17.9	0	0	0	111.5	L604 S605 H609 H610	L604-N607 WeakPolarHBondContact O-CB 3.46Å; L604-N607 PolarHBondContact O-N 2.72Å; S605-N607 PolarHBondContact O-N 3.16Å; N607-H609 PolarHBondContact O-N 3.02Å; N607-H609 PolarHBondContact OD1-N 2.85Å; N607-H610 PolarHBondContact O-CE1 3.19Å; N607-H610 PolarHBondContact O-ND1 2.68Å
608	V	74.1	Confident	89	Confident	118 Å²	118	62.6 Å²	62.6	72%	0.715	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-28.3	179.5	-174.3	0	0	0	0	112.7
609	H	79.7	Confident	88.8	Confident	164 Å²	164	65.2 Å²	65.2	76%	0.759	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.3	52.1	-172.5	-61.2	101.9	0	0	0	112.7	N607	N607-H609 PolarHBondContact O-N 3.02Å; N607-H609 PolarHBondContact OD1-N 2.85Å
610	H	82	Confident	88.4	Confident	55 Å²	55	70.6 Å²	70.6	26%	0.255	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-70.6	138.7	171.5	56.8	-96.3	0	0	0	112.2	W596 N607 R612	W596-H610 AromaticContact NE1-CG 3.84Å; N607-H610 PolarHBondContact O-CE1 3.19Å; N607-H610 PolarHBondContact O-ND1 2.68Å; H610-R612 PolarHBondContact NE2-NH2 3.36Å; H610-R612 PolarHBondContact O-N 2.82Å
611	R	88.7	Confident	88.1	Confident	135 Å²	135	74.6 Å²	74.6	51%	0.509	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-61.4	128	169.8	-173.2	171.9	176	-129.2	-3.8	109.2	D536 A595	D536-R611 IonicContact OD1-CZ 2.81Å; D536-R611 IonicContact OD1-NH1 2.81Å; D536-R611 PolarHBondContact OD1-NH1 3.4Å; D536-R611 IonicContact OD2-CZ 3.32Å; D536-R611 IonicContact OD2-NH1 3.47Å; D536-R611 PolarHBondContact OD2-NH1 3.07Å; D536-R611 IonicContact OD2-NH2 3.7Å; D536-R611 PolarHBondContact OD2-NH2 2.89Å; A595-R611 HydrophobicContact CB-CB 4.33Å; A595-R611 HydrophobicContact CB-CG 4.48Å; A595-R611 WeakPolarHBondContact CB-O 3.37Å; A595-R611 PolarHBondContact N-O 3.08Å
612	R	92.2	Very high	88.1	Confident	118 Å²	118	73.6 Å²	73.6	45%	0.445	38%	0.381	S	S	.	.	B	Isolated β-bridge	trans	-102.9	152	174	-69.3	-179.4	-174.5	-93.2	2.9	110.7	G592 L593 H610 F614	G592-R612 WeakPolarHBondContact O-CD 3.4Å; G592-R612 PolarHBondContact O-NH1 3.14Å; L593-R612 CarbonylContact O-C 3.46Å; L593-R612 VanDerWaalsContact O-CA 3.28Å; L593-R612 WeakPolarHBondContact O-CA 3.4Å; H610-R612 PolarHBondContact NE2-NH2 3.36Å; H610-R612 PolarHBondContact O-N 2.82Å; R612-F614 HydrophobicContact CB-CD2 4.39Å; R612-F614 HydrophobicContact CB-CE1 4.49Å; R612-F614 HydrophobicContact CB-CE2 3.59Å; R612-F614 HydrophobicContact CB-CZ 3.65Å
613	V	92.6	Very high	88.2	Confident	8 Å²	8	72.2 Å²	72.2	5%	0.048	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-100.1	133.8	179.3	-171.8	0	0	0	0	109.1	D536 Y590 G592 L593 A595 I598 L617	D536-V613 HydrophobicContact CB-CG1 4.49Å; D536-V613 HydrophobicContact CB-CG2 4.18Å; Y590-V613 HydrophobicContact CD2-CG1 3.91Å; Y590-V613 HydrophobicContact CE2-CG1 4.46Å; G592-V613 PolarHBondContact N-O 3.5Å; L593-V613 PolarHBondContact O-N 2.91Å; A595-V613 HydrophobicContact CB-CG2 3.83Å; I598-V613 HydrophobicContact CD1-CG2 3.71Å; V613-L617 HydrophobicContact CG1-CD1 3.27Å
614	F	91.4	Very high	88.5	Confident	113 Å²	113	68.1 Å²	68.1	50%	0.496	36%	0.359	S	S	.	.			trans	-132.4	166.4	-175	-64.8	-73.5	0	0	0	110.9	Y590 H591 R612 P616	Y590-F614 WeakPolarHBondContact CE2-O 3.24Å; H591-F614 AromaticContact CE1-CD1 3.87Å; H591-F614 AromaticContact NE2-CD1 3.89Å; R612-F614 HydrophobicContact CB-CD2 4.39Å; R612-F614 HydrophobicContact CB-CE1 4.49Å; R612-F614 HydrophobicContact CB-CE2 3.59Å; R612-F614 HydrophobicContact CB-CZ 3.65Å; F614-P616 CarbonylContact O-C 3.54Å; F614-P616 VanDerWaalsContact O-C 3.29Å
615	A	87.6	Confident	88.7	Confident	23 Å²	23	70 Å²	70	19%	0.19	37%	0.369	C	S	.	.	S	Bend	trans	-93.1	136.2	-177.6	0	0	0	0	0	110.7	Y590 H591 F696 Q698	Y590-A615 HydrophobicContact CE2-CB 4.21Å; Y590-A615 WeakPolarHBondContact OH-CA 3.36Å; Y590-A615 VanDerWaalsContact OH-CB 3.28Å; Y590-A615 WeakPolarHBondContact OH-CB 3.45Å; H591-A615 PolarHBondContact ND1-N 3.25Å; A615-F696 HydrophobicContact CB-CB 3.87Å; A615-Q698 HydrophobicContact CB-CG 4.47Å
616	P	89.3	Confident	89.1	Confident	57 Å²	57	68.2 Å²	68.2	37%	0.37	35%	0.353	S	S	.	.	S	Bend	cis	-73.9	145.3	-1.7	32.5	-34.2	0	0	0	112.2	F614 F696	F614-P616 CarbonylContact O-C 3.54Å; F614-P616 VanDerWaalsContact O-C 3.29Å; P616-F696 HydrophobicContact CB-CB 4.47Å; P616-F696 HydrophobicContact CB-CD1 3.65Å; P616-F696 HydrophobicContact CB-CE1 4.07Å; P616-F696 HydrophobicContact CB-CG 4.18Å; P616-F696 HydrophobicContact CG-CD1 3.76Å; P616-F696 HydrophobicContact CG-CE1 3.72Å; P616-F696 HydrophobicContact CG-CG 4.23Å; P616-F696 HydrophobicContact CG-CZ 4.18Å
617	L	91.4	Very high	89.6	Confident	14 Å²	14	61.8 Å²	61.8	7%	0.073	33%	0.33	C	S	.	.	S	Bend	trans	-63.4	-41.8	179.1	-179.9	53.1	0	0	0	112.6	L492 D536 L539 Y590 V613 I700	L492-L617 VanDerWaalsContact CD2-O 3.24Å; L492-L617 WeakPolarHBondContact CD2-O 3.31Å; D536-L617 HydrophobicContact CB-CD1 4.44Å; L539-L617 HydrophobicContact CB-CD2 3.87Å; L539-L617 HydrophobicContact CD1-CD2 4.04Å; Y590-L617 HydrophobicContact CD2-CB 4.39Å; Y590-L617 HydrophobicContact CD2-CD1 4.42Å; Y590-L617 HydrophobicContact CE2-CB 3.69Å; Y590-L617 HydrophobicContact CE2-CD1 4.42Å; Y590-L617 HydrophobicContact CE2-CG 4.47Å; Y590-L617 PolarHBondContact OH-N 2.95Å; V613-L617 HydrophobicContact CG1-CD1 3.27Å; L617-I700 HydrophobicContact CD2-CD1 3.79Å; L617-I700 HydrophobicContact CD2-CG2 4.31Å
618	W	93.8	Very high	90.2	Very high	14 Å²	14	59 Å²	59	5%	0.053	32%	0.315	C	S	.	.	S	Bend	trans	-132.2	153.5	179	52.1	72.8	0	0	0	111	L492 T540 A543 V622 I624 D625 I700	L492-W618 HydrophobicContact CD2-CB 3.76Å; T540-W618 HydrophobicContact CG2-CB 3.95Å; T540-W618 HydrophobicContact CG2-CD2 4.2Å; T540-W618 HydrophobicContact CG2-CE3 3.8Å; T540-W618 HydrophobicContact CG2-CG 4.28Å; A543-W618 HydrophobicContact CB-CE3 4.36Å; A543-W618 HydrophobicContact CB-CH2 3.27Å; A543-W618 HydrophobicContact CB-CZ2 4.07Å; A543-W618 HydrophobicContact CB-CZ3 3.42Å; A543-W618 VanDerWaalsContact CB-CZ3 3.42Å; W618-V622 HydrophobicContact CB-CG2 4.05Å; W618-V622 HydrophobicContact CG-CB 4.45Å; W618-V622 HydrophobicContact CG-CG2 4.47Å; W618-I624 HydrophobicContact CZ2-CG2 4.06Å; W618-I624 PolarHBondContact NE1-O 3.21Å; W618-D625 WeakPolarHBondContact CZ2-O 3.29Å; W618-I700 HydrophobicContact CH2-CG2 3.82Å; W618-I700 HydrophobicContact CZ2-CG2 4.4Å; W618-I700 HydrophobicContact CZ3-CG2 4.37Å
619	P	91.3	Very high	91.3	Very high	54 Å²	54	55.2 Å²	55.2	35%	0.351	29%	0.289	S	S	.	.			trans	-69.6	154.7	174.4	30	-34.9	0	0	0	111.3	C490 T621 V622	C490-P619 WeakPolarHBondContact SG-CG 3.49Å; P619-T621 WeakPolarHBondContact CG-OG1 3.17Å; P619-T621 PolarHBondContact O-N 2.92Å; P619-V622 HydrophobicContact CG-CG2 4.3Å; P619-V622 PolarHBondContact O-N 3.5Å
620	S	88.3	Confident	92.1	Very high	113 Å²	113	51.2 Å²	51.2	79%	0.79	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-63.3	-12.6	179.1	56.7	0	0	0	0	114.2	V622 G623	S620-V622 PolarHBondContact O-N 2.82Å; S620-G623 PolarHBondContact O-N 2.78Å; S620-G623 VanDerWaalsContact O-N 3.14Å
621	T	89.1	Confident	92.5	Very high	99 Å²	99	51.7 Å²	51.7	61%	0.607	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-66.3	-16.7	172	46.5	0	0	0	0	113.6	P619 G623	P619-T621 WeakPolarHBondContact CG-OG1 3.17Å; P619-T621 PolarHBondContact O-N 2.92Å; T621-G623 PolarHBondContact O-N 2.96Å
622	V	92.6	Very high	91.9	Very high	20 Å²	20	51 Å²	51	12%	0.121	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-70.3	-18.9	171.2	179.5	0	0	0	0	112	L493 T540 M544 W618 P619 S620 I624	L493-V622 HydrophobicContact CD1-CG1 4.32Å; L493-V622 HydrophobicContact CD1-CG2 3.82Å; T540-V622 HydrophobicContact CG2-CG1 4.44Å; M544-V622 HydrophobicContact CG-CG1 4.24Å; M544-V622 HydrophobicContact SD-CG1 4.42Å; W618-V622 HydrophobicContact CB-CG2 4.05Å; W618-V622 HydrophobicContact CG-CB 4.45Å; W618-V622 HydrophobicContact CG-CG2 4.47Å; P619-V622 HydrophobicContact CG-CG2 4.3Å; P619-V622 PolarHBondContact O-N 3.5Å; S620-V622 PolarHBondContact O-N 2.82Å; V622-I624 VanDerWaalsContact C-N 3.31Å; V622-I624 HydrophobicContact CG1-CB 4.35Å; V622-I624 HydrophobicContact CG1-CD1 4.18Å; V622-I624 HydrophobicContact CG1-CG1 4.34Å; V622-I624 PolarHBondContact O-N 3.28Å
623	G	93.9	Very high	89.9	Confident	22 Å²	22	51.1 Å²	51.1	23%	0.227	30%	0.3	C	S	.	.			trans	71.1	22	176.3	0	0	0	0	0	114.7	S620 T621 Y630 T631	S620-G623 PolarHBondContact O-N 2.78Å; S620-G623 VanDerWaalsContact O-N 3.14Å; T621-G623 PolarHBondContact O-N 2.96Å; G623-Y630 CarbonylContact O-C 3.59Å; G623-Y630 WeakPolarHBondContact O-CA 3.44Å; G623-T631 PolarHBondContact O-N 2.78Å; G623-T631 PolarHBondContact O-OG1 3Å; G623-T631 VanDerWaalsContact O-OG1 3.11Å
624	I	95.1	Very high	87.3	Confident	8 Å²	8	57.7 Å²	57.7	4%	0.041	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-129.5	140.2	-177.3	-63.5	176.1	0	0	0	110	M544 A547 W618 V622 Q629 Y630	M544-I624 HydrophobicContact CB-CD1 4.07Å; M544-I624 HydrophobicContact CG-CD1 3.6Å; A547-I624 HydrophobicContact CB-CD1 3.77Å; A547-I624 HydrophobicContact CB-CG1 4.12Å; A547-I624 HydrophobicContact CB-CG2 4.32Å; W618-I624 HydrophobicContact CZ2-CG2 4.06Å; W618-I624 PolarHBondContact NE1-O 3.21Å; V622-I624 VanDerWaalsContact C-N 3.31Å; V622-I624 HydrophobicContact CG1-CB 4.35Å; V622-I624 HydrophobicContact CG1-CD1 4.18Å; V622-I624 HydrophobicContact CG1-CG1 4.34Å; V622-I624 PolarHBondContact O-N 3.28Å; I624-Q629 WeakPolarHBondContact CA-O 3.24Å; I624-Y630 HydrophobicContact CD1-CD1 4.21Å; I624-Y630 HydrophobicContact CD1-CE1 3.9Å; I624-Y630 HydrophobicContact CG1-CD1 3.69Å; I624-Y630 HydrophobicContact CG1-CE1 3.89Å
625	D	94.1	Very high	84.5	Confident	45 Å²	45	57.7 Å²	57.7	24%	0.241	34%	0.336	C	S	.	.			trans	-94.6	172	180	82.4	-9.8	0	0	0	114	W618 N627 C628 Q629 T631	W618-D625 WeakPolarHBondContact CZ2-O 3.29Å; D625-N627 PolarHBondContact O-N 2.68Å; D625-N627 WeakPolarHBondContact OD1-CA 3.48Å; D625-N627 WeakPolarHBondContact OD1-CB 3.45Å; D625-N627 PolarHBondContact OD1-N 3.14Å; D625-N627 PolarHBondContact OD2-ND2 3.41Å; D625-C628 PolarHBondContact O-N 2.8Å; D625-C628 PolarHBondContact OD1-N 3.22Å; D625-Q629 PolarHBondContact N-O 2.8Å; D625-Q629 PolarHBondContact OD1-N 3.45Å; D625-T631 HydrophobicContact CB-CG2 4.05Å
626	D	94.3	Very high	82	Confident	36 Å²	36	62 Å²	62	19%	0.193	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-3.3	177.7	-59.3	-52.8	0	0	0	114.2	R697 I700 S701	D626-R697 HydrophobicContact CB-CB 4.12Å; D626-R697 HydrophobicContact CB-CG 4.38Å; D626-R697 WeakPolarHBondContact OD2-CB 3.39Å; D626-R697 WeakPolarHBondContact OD2-CD 3.45Å; D626-R697 WeakPolarHBondContact OD2-CG 3.38Å; D626-I700 CarbonylContact O-C 3.58Å; D626-I700 WeakPolarHBondContact O-CA 3.45Å; D626-S701 PolarHBondContact O-N 3.37Å; D626-S701 PolarHBondContact O-OG 3.37Å
627	N	95.9	Very high	79.5	Confident	22 Å²	22	66.7 Å²	66.7	12%	0.118	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	11.9	173.3	-42.7	-75.8	0	0	0	111.7	D625 Q629 R697 S701 Y703	D625-N627 PolarHBondContact O-N 2.68Å; D625-N627 WeakPolarHBondContact OD1-CA 3.48Å; D625-N627 WeakPolarHBondContact OD1-CB 3.45Å; D625-N627 PolarHBondContact OD1-N 3.14Å; D625-N627 PolarHBondContact OD2-ND2 3.41Å; N627-Q629 VanDerWaalsContact C-N 3.29Å; N627-Q629 HydrophobicContact CB-CG 4.28Å; N627-Q629 PolarHBondContact O-N 3.36Å; N627-R697 PolarHBondContact OD1-NH1 3.12Å; N627-S701 CarbonylContact C-O 3.51Å; N627-S701 VanDerWaalsContact CA-O 3.29Å; N627-S701 WeakPolarHBondContact CA-O 3.24Å; N627-Y703 HydrophobicContact CB-CE2 3.81Å
628	C	97.1	Very high	76.8	Confident	1 Å²	1	70.7 Å²	70.7	1%	0.007	41%	0.405	C	S	.	.	S	Bend	trans	51.6	46.4	-174.2	-57.3	0	0	0	0	111.9	A543 L546 A547 D625 S701 H702	A543-C628 HydrophobicContact CB-CB 4.42Å; L546-C628 HydrophobicContact CB-CB 3.96Å; L546-C628 HydrophobicContact CD1-CB 4.41Å; A547-C628 WeakPolarHBondContact CA-O 3.15Å; A547-C628 WeakPolarHBondContact CB-O 3.11Å; A547-C628 PolarHBondContact N-O 3.34Å; D625-C628 PolarHBondContact O-N 2.8Å; D625-C628 PolarHBondContact OD1-N 3.22Å; C628-S701 WeakPolarHBondContact CB-O 3.43Å; C628-S701 PolarHBondContact N-O 3.09Å; C628-S701 PolarHBondContact SG-O 3.39Å; C628-H702 HydrophobicContact CB-CB 4.2Å
629	Q	96.6	Very high	74.2	Confident	39 Å²	39	78.9 Å²	78.9	18%	0.182	44%	0.444	C	S	.	.			trans	-120.5	147	172.5	-52.1	-166.4	-68.3	0	0	110.3	D550 I624 D625 N627 T631 Y703	D550-Q629 PolarHBondContact OD1-NE2 3.41Å; D550-Q629 WeakPolarHBondContact OD2-CG 3.47Å; D550-Q629 PolarHBondContact OD2-NE2 3.45Å; I624-Q629 WeakPolarHBondContact CA-O 3.24Å; D625-Q629 PolarHBondContact N-O 2.8Å; D625-Q629 PolarHBondContact OD1-N 3.45Å; N627-Q629 VanDerWaalsContact C-N 3.29Å; N627-Q629 HydrophobicContact CB-CG 4.28Å; N627-Q629 PolarHBondContact O-N 3.36Å; Q629-T631 PolarHBondContact O-N 3.14Å; Q629-Y703 VanDerWaalsContact CD-CE2 3.48Å; Q629-Y703 HydrophobicContact CG-CD2 4.21Å; Q629-Y703 HydrophobicContact CG-CE2 4.13Å
630	Y	96.4	Very high	71.5	Confident	79 Å²	79	83.4 Å²	83.4	31%	0.31	46%	0.464	S	S	.	.	B	Isolated β-bridge	trans	-59.2	126.2	169.3	-68.9	-55	0	0	0	111.1	A547 E548 Y551 G623 I624 T632	A547-Y630 HydrophobicContact CB-CD1 4.21Å; A547-Y630 HydrophobicContact CB-CD2 4.34Å; A547-Y630 HydrophobicContact CB-CE1 4.07Å; A547-Y630 HydrophobicContact CB-CE2 4.22Å; A547-Y630 HydrophobicContact CB-CG 4.32Å; E548-Y630 HydrophobicContact CB-CE2 4.41Å; E548-Y630 WeakPolarHBondContact OE2-CE2 3.48Å; E548-Y630 PolarHBondContact OE2-OH 3.28Å; Y551-Y630 HydrophobicContact CG-CD2 4.43Å; G623-Y630 CarbonylContact O-C 3.59Å; G623-Y630 WeakPolarHBondContact O-CA 3.44Å; I624-Y630 HydrophobicContact CD1-CD1 4.21Å; I624-Y630 HydrophobicContact CD1-CE1 3.9Å; I624-Y630 HydrophobicContact CG1-CD1 3.69Å; I624-Y630 HydrophobicContact CG1-CE1 3.89Å; Y630-T632 PolarHBondContact O-N 3.25Å
631	T	90.9	Very high	69	Low	66 Å²	66	84.8 Å²	84.8	41%	0.405	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-65.8	126.2	175.7	54.3	0	0	0	0	109.7	G623 D625 Q629 V633	G623-T631 PolarHBondContact O-N 2.78Å; G623-T631 PolarHBondContact O-OG1 3Å; G623-T631 VanDerWaalsContact O-OG1 3.11Å; D625-T631 HydrophobicContact CB-CG2 4.05Å; Q629-T631 PolarHBondContact O-N 3.14Å; T631-V633 PolarHBondContact O-N 3.45Å
632	T	75.9	Confident	66.3	Low	119 Å²	119	84.3 Å²	84.3	73%	0.73	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-62.1	125.2	168.1	40.9	0	0	0	0	109.4	Y630 N634	Y630-T632 PolarHBondContact O-N 3.25Å; T632-N634 PolarHBondContact O-N 2.86Å
633	V	50.4	Low	63.7	Low	122 Å²	122	89.8 Å²	89.8	74%	0.739	50%	0.502	S	S	*	.			trans	-76.3	73.4	-177.4	-170.3	0	0	0	0	110.1	T631 E635	T631-V633 PolarHBondContact O-N 3.45Å; V633-E635 HydrophobicContact CG1-CG 3.87Å; V633-E635 PolarHBondContact O-N 3.32Å; V633-E635 VanDerWaalsContact O-N 3.11Å
634	N	37.6	Very low	61.1	Low	145 Å²	145	97.6 Å²	97.6	78%	0.775	53%	0.533	S	S	*	.			trans	-69	96.8	157.2	-79.1	-19.4	0	0	0	107.2	T632 P636	T632-N634 PolarHBondContact O-N 2.86Å; N634-P636 WeakPolarHBondContact O-CD 3.44Å
635	E	33.5	Very low	58.1	Low	113 Å²	113	101.9 Å²	101.9	53%	0.528	56%	0.564	S	S	.	*			trans	-71.4	115.1	170.2	-67.3	-164.4	131.8	0	0	110.6	V633 K637	V633-E635 HydrophobicContact CG1-CG 3.87Å; V633-E635 PolarHBondContact O-N 3.32Å; V633-E635 VanDerWaalsContact O-N 3.11Å; E635-K637 HydrophobicContact CB-CB 4.35Å; E635-K637 HydrophobicContact CB-CG 4.21Å; E635-K637 PolarHBondContact O-N 2.88Å; E635-K637 WeakPolarHBondContact OE1-CE 3.28Å; E635-K637 IonicContact OE1-NZ 2.72Å; E635-K637 PolarHBondContact OE1-NZ 2.76Å; E635-K637 WeakPolarHBondContact OE2-CD 3.4Å; E635-K637 VanDerWaalsContact OE2-CE 3.29Å; E635-K637 WeakPolarHBondContact OE2-CE 3.48Å; E635-K637 IonicContact OE2-NZ 3.01Å; E635-K637 PolarHBondContact OE2-NZ 2.87Å
636	P	35.3	Very low	55.7	Low	114 Å²	114	106.1 Å²	106.1	74%	0.74	59%	0.594	S	S	*	*			trans	-76.2	67.5	153.8	35.6	-35.3	0	0	0	108.4	N634 S638	N634-P636 WeakPolarHBondContact O-CD 3.44Å; P636-S638 PolarHBondContact O-N 3.44Å
637	K	36.4	Very low	53	Low	156 Å²	156	112.6 Å²	112.6	68%	0.678	62%	0.623	S	S	*	*			trans	-72.1	51.2	165.3	-92.6	-166.5	-172	126.4	0	110.8	E635 Q639	E635-K637 HydrophobicContact CB-CB 4.35Å; E635-K637 HydrophobicContact CB-CG 4.21Å; E635-K637 PolarHBondContact O-N 2.88Å; E635-K637 WeakPolarHBondContact OE1-CE 3.28Å; E635-K637 IonicContact OE1-NZ 2.72Å; E635-K637 PolarHBondContact OE1-NZ 2.76Å; E635-K637 WeakPolarHBondContact OE2-CD 3.4Å; E635-K637 VanDerWaalsContact OE2-CE 3.29Å; E635-K637 WeakPolarHBondContact OE2-CE 3.48Å; E635-K637 IonicContact OE2-NZ 3.01Å; E635-K637 PolarHBondContact OE2-NZ 2.87Å; K637-Q639 PolarHBondContact O-N 2.93Å
638	S	34.3	Very low	50.8	Low	97 Å²	97	123.7 Å²	123.7	68%	0.678	66%	0.663	S	S	*	*			trans	-60.9	120.4	159.2	-56.8	0	0	0	0	107.4	P636 I640	P636-S638 PolarHBondContact O-N 3.44Å; S638-I640 PolarHBondContact O-N 3.46Å; S638-I640 VanDerWaalsContact O-N 3.15Å
639	Q	40.2	Very low	48	Very low	186 Å²	186	129.7 Å²	129.7	87%	0.869	70%	0.695	S	S	*	*			trans	-59.3	116.6	-171.5	-65.8	162.5	-20.5	0	0	111.7	K637	K637-Q639 PolarHBondContact O-N 2.93Å
640	I	34.2	Very low	45.5	Very low	149 Å²	149	134.8 Å²	134.8	76%	0.764	72%	0.723	S	S	*	*			trans	-122.2	88.6	157.4	-58.4	-178.7	0	0	0	107.4	S638 S642	S638-I640 PolarHBondContact O-N 3.46Å; S638-I640 VanDerWaalsContact O-N 3.15Å; I640-S642 PolarHBondContact O-N 2.77Å
641	T	34.2	Very low	42.8	Very low	142 Å²	142	139.3 Å²	139.3	87%	0.871	75%	0.747	S	S	*	*			trans	-76	93.7	167.4	47.2	0	0	0	0	109.1
642	S	34	Very low	40.9	Very low	89 Å²	89	142.5 Å²	142.5	62%	0.622	75%	0.752	S	S	*	*			trans	-126.8	90.6	171.5	60.7	0	0	0	0	110.9	I640 Q644	I640-S642 PolarHBondContact O-N 2.77Å; S642-Q644 PolarHBondContact O-N 3.01Å
643	T	37.5	Very low	39.7	Very low	135 Å²	135	142.4 Å²	142.4	83%	0.828	75%	0.747	S	S	*	*			trans	-64.4	110.2	165.8	42.6	0	0	0	0	110.2
644	Q	38.2	Very low	39.6	Very low	186 Å²	186	143 Å²	143	87%	0.869	74%	0.742	S	S	*	*			trans	-159.2	164.4	161.6	-121.8	138.3	103.9	0	0	113.2	S642	S642-Q644 PolarHBondContact O-N 3.01Å
645	S	33.2	Very low	40.1	Very low	98 Å²	98	137.2 Å²	137.2	69%	0.685	72%	0.716	S	S	*	*			trans	-81.3	161.4	-166.2	41.6	0	0	0	0	114.7	E647	S645-E647 PolarHBondContact O-N 3.25Å
646	P	42.8	Very low	41.1	Very low	135 Å²	135	135.3 Å²	135.3	88%	0.877	71%	0.706	S	S	*	*			trans	-81.4	84.9	-174.4	33.6	-36.7	0	0	0	113.1
647	E	38.3	Very low	42.1	Very low	171 Å²	171	133.5 Å²	133.5	80%	0.799	69%	0.69	S	S	*	*			trans	-111.4	135.9	159.8	-70.5	-160.2	149.3	0	0	111.4	S645 N649	S645-E647 PolarHBondContact O-N 3.25Å; E647-N649 PolarHBondContact O-N 3.09Å
648	R	49.6	Very low	42.7	Very low	256 Å²	256	129.1 Å²	129.1	97%	0.966	67%	0.669	S	S	*	*			trans	-72.7	91.5	-173.4	-76.9	177	166.8	162.4	-6.4	112
649	N	37.7	Very low	43.4	Very low	127 Å²	127	129.8 Å²	129.8	68%	0.679	66%	0.657	S	S	*	*			trans	-123.4	107.1	157.9	-83.2	-65.8	0	0	0	109.8	E647 Q651	E647-N649 PolarHBondContact O-N 3.09Å; N649-Q651 HydrophobicContact CB-CG 4.34Å; N649-Q651 PolarHBondContact O-N 2.93Å
650	L	44.8	Very low	43.9	Very low	146 Å²	146	126.2 Å²	126.2	76%	0.764	64%	0.643	S	S	*	*			trans	-73.3	71.1	172.7	-72.9	169.2	0	0	0	110	Y652	L650-Y652 VanDerWaalsContact C-N 3.35Å; L650-Y652 PolarHBondContact O-N 2.97Å
651	Q	39.8	Very low	44.6	Very low	174 Å²	174	127.5 Å²	127.5	81%	0.813	64%	0.638	S	S	*	*			trans	-71.8	90.8	174.9	-71.7	-166.7	-3.7	0	0	110.4	N649 N653	N649-Q651 HydrophobicContact CB-CG 4.34Å; N649-Q651 PolarHBondContact O-N 2.93Å; Q651-N653 PolarHBondContact O-N 3.43Å; Q651-N653 VanDerWaalsContact O-N 3.07Å
652	Y	51.2	Low	45.3	Very low	133 Å²	133	126.2 Å²	126.2	52%	0.522	62%	0.621	S	S	.	*			trans	-56.4	112.5	167.9	-60.6	-66.6	0	0	0	110.1	L650 H654 F656 L657	L650-Y652 VanDerWaalsContact C-N 3.35Å; L650-Y652 PolarHBondContact O-N 2.97Å; Y652-H654 PolarHBondContact O-N 3.17Å; Y652-F656 AromaticContact CD1-CD1 3.64Å; Y652-F656 HydrophobicContact CD1-CD1 3.64Å; Y652-F656 AromaticContact CD1-CE1 3.35Å; Y652-F656 HydrophobicContact CD1-CE1 3.35Å; Y652-F656 HydrophobicContact CD1-CZ 4.22Å; Y652-F656 AromaticContact CE1-CE1 3.84Å; Y652-F656 HydrophobicContact CE1-CE1 3.84Å; Y652-F656 HydrophobicContact CE1-CZ 4.4Å; Y652-F656 HydrophobicContact CG-CD1 4.1Å; Y652-F656 HydrophobicContact CG-CE1 4.1Å; Y652-L657 HydrophobicContact CD2-CD2 4.32Å; Y652-L657 HydrophobicContact CG-CD2 4.13Å
653	N	50.4	Low	45.9	Very low	116 Å²	116	126 Å²	126	62%	0.62	62%	0.619	S	S	*	*			trans	-52.4	141.2	175.6	-178.5	-43	0	0	0	110.2	Q651 G655 F656 L657	Q651-N653 PolarHBondContact O-N 3.43Å; Q651-N653 VanDerWaalsContact O-N 3.07Å; N653-G655 PolarHBondContact O-N 2.99Å; N653-G655 VanDerWaalsContact O-N 3.12Å; N653-G655 PolarHBondContact OD1-N 3.15Å; N653-F656 WeakPolarHBondContact O-CA 3.46Å; N653-F656 WeakPolarHBondContact O-CB 3.31Å; N653-F656 PolarHBondContact O-N 3.38Å; N653-L657 PolarHBondContact O-N 2.85Å
654	H	47.5	Very low	46.4	Very low	136 Å²	136	126.7 Å²	126.7	63%	0.63	61%	0.612	S	S	*	*	H	α-helix	trans	-48.4	-40	176.1	-178.3	-122.8	0	0	0	112.9	Y652 F656 L657 R658	Y652-H654 PolarHBondContact O-N 3.17Å; H654-F656 VanDerWaalsContact C-N 3.29Å; H654-F656 PolarHBondContact O-N 3.37Å; H654-L657 PolarHBondContact O-N 3.11Å; H654-R658 WeakPolarHBondContact O-CG 3.37Å; H654-R658 PolarHBondContact O-N 3.16Å
655	G	48.3	Very low	46.9	Very low	23 Å²	23	121.5 Å²	121.5	24%	0.237	60%	0.601	C	S	.	*	H	α-helix	trans	-73.4	-10.1	175.5	0	0	0	0	0	115.5	N653 R659	N653-G655 PolarHBondContact O-N 2.99Å; N653-G655 VanDerWaalsContact O-N 3.12Å; N653-G655 PolarHBondContact OD1-N 3.15Å; G655-R659 PolarHBondContact O-NE 3.16Å; G655-R659 PolarHBondContact O-NH2 3.4Å
656	F	54.5	Low	47.6	Very low	72 Å²	72	120.2 Å²	120.2	32%	0.316	60%	0.596	S	S	.	*	H	α-helix	trans	-89.1	-44.3	164.5	175.6	-88.8	0	0	0	110.4	Y652 N653 H654 R658 R659 L660	Y652-F656 AromaticContact CD1-CD1 3.64Å; Y652-F656 HydrophobicContact CD1-CD1 3.64Å; Y652-F656 AromaticContact CD1-CE1 3.35Å; Y652-F656 HydrophobicContact CD1-CE1 3.35Å; Y652-F656 HydrophobicContact CD1-CZ 4.22Å; Y652-F656 AromaticContact CE1-CE1 3.84Å; Y652-F656 HydrophobicContact CE1-CE1 3.84Å; Y652-F656 HydrophobicContact CE1-CZ 4.4Å; Y652-F656 HydrophobicContact CG-CD1 4.1Å; Y652-F656 HydrophobicContact CG-CE1 4.1Å; N653-F656 WeakPolarHBondContact O-CA 3.46Å; N653-F656 WeakPolarHBondContact O-CB 3.31Å; N653-F656 PolarHBondContact O-N 3.38Å; H654-F656 VanDerWaalsContact C-N 3.29Å; H654-F656 PolarHBondContact O-N 3.37Å; F656-R658 VanDerWaalsContact C-N 3.29Å; F656-R658 PolarHBondContact O-N 2.88Å; F656-R659 WeakPolarHBondContact O-CA 2.97Å; F656-R659 WeakPolarHBondContact O-CB 3.49Å; F656-R659 PolarHBondContact O-N 2.9Å; F656-L660 HydrophobicContact CD1-CD1 4.18Å; F656-L660 HydrophobicContact CE1-CD1 3.6Å; F656-L660 HydrophobicContact CE1-CG 4.11Å; F656-L660 HydrophobicContact CZ-CD1 4.27Å; F656-L660 PolarHBondContact O-N 3.13Å
657	L	57.9	Low	48.1	Very low	77 Å²	77	117.6 Å²	117.6	40%	0.403	58%	0.58	S	S	.	*	H	α-helix	trans	-60.4	-35.6	176.7	-67.1	176.7	0	0	0	112.9	Y652 N653 H654 R659 L660	Y652-L657 HydrophobicContact CD2-CD2 4.32Å; Y652-L657 HydrophobicContact CG-CD2 4.13Å; N653-L657 PolarHBondContact O-N 2.85Å; H654-L657 PolarHBondContact O-N 3.11Å; L657-R659 VanDerWaalsContact C-N 3.27Å; L657-R659 PolarHBondContact O-N 2.71Å; L657-L660 HydrophobicContact CD2-CD1 4.49Å; L657-L660 PolarHBondContact O-N 2.9Å
658	R	48.4	Very low	48.9	Very low	64 Å²	64	115.4 Å²	115.4	24%	0.242	57%	0.573	C	S	.	*	G	3₁₀ helix	trans	-64.6	-26.6	171.2	-70.7	-172.6	95.4	179.4	16.8	113.5	H654 F656 D688 H690 Y692	H654-R658 WeakPolarHBondContact O-CG 3.37Å; H654-R658 PolarHBondContact O-N 3.16Å; F656-R658 VanDerWaalsContact C-N 3.29Å; F656-R658 PolarHBondContact O-N 2.88Å; R658-D688 IonicContact CZ-OD2 3.36Å; R658-D688 IonicContact NH2-OD2 3.93Å; R658-D688 PolarHBondContact NH2-OD2 2.7Å; R658-H690 PolarHBondContact NH1-CD2 3.36Å; R658-H690 PolarHBondContact NH1-NE2 3.4Å; R658-H690 PolarHBondContact NH2-CD2 3.37Å; R658-H690 VanDerWaalsContact NH2-CD2 3.29Å; R658-Y692 PolarHBondContact NH1-OH 2.94Å
659	R	48.6	Very low	49.5	Very low	111 Å²	111	107.9 Å²	107.9	42%	0.419	54%	0.544	S	S	.	.	G	3₁₀ helix	trans	-79.5	-14.4	175.5	-77.8	178.8	-80.5	163.9	-4.2	113.7	G655 F656 L657 F696	G655-R659 PolarHBondContact O-NE 3.16Å; G655-R659 PolarHBondContact O-NH2 3.4Å; F656-R659 WeakPolarHBondContact O-CA 2.97Å; F656-R659 WeakPolarHBondContact O-CB 3.49Å; F656-R659 PolarHBondContact O-N 2.9Å; L657-R659 VanDerWaalsContact C-N 3.27Å; L657-R659 PolarHBondContact O-N 2.71Å; R659-F696 HydrophobicContact CB-CE2 4.48Å; R659-F696 HydrophobicContact CB-CZ 4.49Å
660	L	51.1	Low	50.8	Low	110 Å²	110	105.2 Å²	105.2	58%	0.576	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-89.4	-5.5	173.4	-67.6	-179.1	0	0	0	113.6	F656 L657	F656-L660 HydrophobicContact CD1-CD1 4.18Å; F656-L660 HydrophobicContact CE1-CD1 3.6Å; F656-L660 HydrophobicContact CE1-CG 4.11Å; F656-L660 HydrophobicContact CZ-CD1 4.27Å; F656-L660 PolarHBondContact O-N 3.13Å; L657-L660 HydrophobicContact CD2-CD1 4.49Å; L657-L660 PolarHBondContact O-N 2.9Å
661	R	49	Very low	51.7	Low	177 Å²	177	107.4 Å²	107.4	67%	0.668	54%	0.541	S	S	*	.			trans	-86.3	151.9	176.2	-67.6	-169.6	177.3	-167.6	-0.9	111.4
662	F	48.4	Very low	53.3	Low	115 Å²	115	106 Å²	106	50%	0.504	54%	0.539	S	S	.	.			trans	74.5	74.3	166.5	-37.8	-60.4	0	0	0	117	C667	F662-C667 VanDerWaalsContact CD1-SG 3.59Å
663	C	47.7	Very low	54.3	Low	85 Å²	85	103.8 Å²	103.8	57%	0.574	54%	0.535	S	S	*	.				-76.9	151.7	126.4	68.5	0	0	0	0	108.3	A665 A666	C663-A665 PolarHBondContact O-N 3.2Å; C663-A666 WeakPolarHBondContact O-CB 3.17Å; C663-A666 PolarHBondContact O-N 2.89Å
664	E	47.6	Very low	55.5	Low	149 Å²	149	106 Å²	106	70%	0.696	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-63.8	-29.7	-174.5	-69.1	176.3	156.6	0	0	112.8	A666 C667	E664-A666 VanDerWaalsContact C-N 3.26Å; E664-A666 PolarHBondContact O-N 2.95Å; E664-C667 VanDerWaalsContact O-CB 3.3Å; E664-C667 WeakPolarHBondContact O-CB 3.4Å; E664-C667 PolarHBondContact O-N 2.64Å
665	A	47.2	Very low	56.6	Low	76 Å²	76	105.1 Å²	105.1	63%	0.628	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-61.5	-31.1	172.2	0	0	0	0	0	113.2	C663 C667 I668	C663-A665 PolarHBondContact O-N 3.2Å; A665-C667 VanDerWaalsContact C-N 3.28Å; A665-C667 PolarHBondContact O-N 3.14Å; A665-I668 PolarHBondContact O-N 2.76Å
666	A	48.9	Very low	57.9	Low	71 Å²	71	108.3 Å²	108.3	59%	0.587	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-80.5	-5.8	175.5	0	0	0	0	0	113.5	C663 E664	C663-A666 WeakPolarHBondContact O-CB 3.17Å; C663-A666 PolarHBondContact O-N 2.89Å; E664-A666 VanDerWaalsContact C-N 3.26Å; E664-A666 PolarHBondContact O-N 2.95Å
667	C	52.9	Low	58.2	Low	80 Å²	80	109.7 Å²	109.7	54%	0.541	57%	0.568	S	S	.	*	G	3₁₀ helix	trans	-85	-14.9	169.9	-56.6	0	0	0	0	112.5	F662 E664 A665	F662-C667 VanDerWaalsContact CD1-SG 3.59Å; E664-C667 VanDerWaalsContact O-CB 3.3Å; E664-C667 WeakPolarHBondContact O-CB 3.4Å; E664-C667 PolarHBondContact O-N 2.64Å; A665-C667 VanDerWaalsContact C-N 3.28Å; A665-C667 PolarHBondContact O-N 3.14Å
668	I	56.3	Low	58.2	Low	126 Å²	126	108.6 Å²	108.6	65%	0.646	58%	0.576	S	S	*	*	S	Bend	trans	-91.3	118.7	-177.7	-58.6	174.1	0	0	0	108.5	A665 P670	A665-I668 PolarHBondContact O-N 2.76Å; I668-P670 WeakPolarHBondContact O-CD 3.39Å
669	R	61.2	Low	58.8	Low	97 Å²	97	110.2 Å²	110.2	37%	0.366	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-64.8	127.2	173.7	-164.9	-155	-173	79.9	7.8	109.2	L673 E674 T680	R669-L673 HydrophobicContact CG-CB 4.43Å; R669-L673 HydrophobicContact CG-CD2 4.22Å; R669-L673 PolarHBondContact NE-O 2.58Å; R669-L673 VanDerWaalsContact NE-O 3.08Å; R669-L673 PolarHBondContact NH2-O 2.77Å; R669-E674 PolarHBondContact NH2-O 2.72Å; R669-T680 PolarHBondContact NH1-O 3.01Å; R669-T680 PolarHBondContact NH2-OG1 2.83Å; R669-T680 VanDerWaalsContact NH2-OG1 3.17Å
670	P	64.5	Low	59.3	Low	72 Å²	72	106.7 Å²	106.7	47%	0.468	58%	0.583	S	S	.	*	P	Polyproline II helix	trans	-57.6	138.7	164.8	-21	32.9	0	0	0	109.8	I668 D672 L673	I668-P670 WeakPolarHBondContact O-CD 3.39Å; P670-D672 PolarHBondContact O-N 2.61Å; P670-L673 HydrophobicContact CB-CB 4.26Å; P670-L673 PolarHBondContact O-N 2.92Å
671	Q	63.9	Low	59.9	Low	192 Å²	192	104.5 Å²	104.5	90%	0.897	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-26	-177.2	-64.4	-176.3	0.8	0	0	111.9
672	D	74.5	Confident	60.5	Low	145 Å²	145	101.5 Å²	101.5	78%	0.775	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-3.2	-175.1	-22.2	-75.4	0	0	0	113.1	P670 E674	P670-D672 PolarHBondContact O-N 2.61Å; D672-E674 PolarHBondContact O-N 2.8Å
673	L	72.3	Confident	60.8	Low	86 Å²	86	102.1 Å²	102.1	45%	0.45	58%	0.583	S	S	.	*			trans	-79.9	106.6	-176.6	-176.4	68.8	0	0	0	111.1	R669 P670	R669-L673 HydrophobicContact CG-CB 4.43Å; R669-L673 HydrophobicContact CG-CD2 4.22Å; R669-L673 PolarHBondContact NE-O 2.58Å; R669-L673 VanDerWaalsContact NE-O 3.08Å; R669-L673 PolarHBondContact NH2-O 2.77Å; P670-L673 HydrophobicContact CB-CB 4.26Å; P670-L673 PolarHBondContact O-N 2.92Å
674	E	74.2	Confident	61.2	Low	162 Å²	162	102.6 Å²	102.6	76%	0.757	59%	0.585	S	S	*	*			trans	-49	141.2	177.2	-67.3	-167.2	145.6	0	0	113.2	R669 D672 I676 T680	R669-E674 PolarHBondContact NH2-O 2.72Å; D672-E674 PolarHBondContact O-N 2.8Å; E674-I676 PolarHBondContact O-N 3.47Å; E674-T680 PolarHBondContact O-OG1 3.17Å
675	L	70.4	Confident	61.7	Low	117 Å²	117	100.5 Å²	100.5	61%	0.613	58%	0.578	S	S	*	*			trans	-87.7	88.2	-178.4	-169	73.9	0	0	0	111.1	P677 D681	L675-P677 WeakPolarHBondContact O-CD 3.42Å; L675-D681 HydrophobicContact CD1-CB 3.89Å
676	I	75.8	Confident	62	Low	91 Å²	91	101.9 Å²	101.9	47%	0.467	58%	0.581	S	S	.	*			trans	-81.6	116.3	165.9	-53.5	175.1	0	0	0	108.6	E674 V679 T680	E674-I676 PolarHBondContact O-N 3.47Å; I676-V679 HydrophobicContact CB-CB 4.19Å; I676-V679 HydrophobicContact CG2-CB 3.89Å; I676-V679 HydrophobicContact CG2-CG2 3.86Å; I676-V679 PolarHBondContact O-N 3.48Å; I676-T680 HydrophobicContact CB-CG2 4.13Å; I676-T680 HydrophobicContact CG1-CG2 4.47Å; I676-T680 PolarHBondContact N-OG1 2.97Å; I676-T680 PolarHBondContact O-N 2.78Å; I676-T680 PolarHBondContact O-OG1 3.34Å
677	P	62	Low	62.1	Low	100 Å²	100	106.9 Å²	106.9	65%	0.649	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	148.8	179.2	-19.8	34.2	0	0	0	113.3	L675 V679 D681	L675-P677 WeakPolarHBondContact O-CD 3.42Å; P677-V679 PolarHBondContact O-N 3.19Å; P677-D681 VanDerWaalsContact CA-OD2 3.27Å; P677-D681 WeakPolarHBondContact CA-OD2 3.17Å
678	G	58.3	Low	62	Low	55 Å²	55	106.8 Å²	106.8	57%	0.567	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.3	-5.7	-170.4	0	0	0	0	0	115.3	D681 N682	G678-D681 VanDerWaalsContact C-OD1 3.31Å; G678-D681 VanDerWaalsContact CA-OD1 3.27Å; G678-D681 WeakPolarHBondContact CA-OD1 3.38Å; G678-D681 PolarHBondContact N-OD1 3.27Å; G678-D681 PolarHBondContact N-OD2 2.94Å; G678-N682 VanDerWaalsContact C-ND2 3.35Å; G678-N682 PolarHBondContact O-ND2 2.96Å
679	V	60.8	Low	61.6	Low	98 Å²	98	109.1 Å²	109.1	59%	0.594	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.3	-57.9	-171.9	-177	0	0	0	0	111.5	I676 P677 D681 N682	I676-V679 HydrophobicContact CB-CB 4.19Å; I676-V679 HydrophobicContact CG2-CB 3.89Å; I676-V679 HydrophobicContact CG2-CG2 3.86Å; I676-V679 PolarHBondContact O-N 3.48Å; P677-V679 PolarHBondContact O-N 3.19Å; V679-D681 PolarHBondContact N-OD1 3.27Å; V679-N682 PolarHBondContact O-ND2 3.2Å
680	T	59.2	Low	60.8	Low	37 Å²	37	108.8 Å²	108.8	23%	0.227	59%	0.594	C	S	.	*	T	Hydrogen-bonded Turn	trans	-105.4	-6.5	-174.3	68.7	0	0	0	0	113.8	R669 E674 I676	R669-T680 PolarHBondContact NH1-O 3.01Å; R669-T680 PolarHBondContact NH2-OG1 2.83Å; R669-T680 VanDerWaalsContact NH2-OG1 3.17Å; E674-T680 PolarHBondContact O-OG1 3.17Å; I676-T680 HydrophobicContact CB-CG2 4.13Å; I676-T680 HydrophobicContact CG1-CG2 4.47Å; I676-T680 PolarHBondContact N-OG1 2.97Å; I676-T680 PolarHBondContact O-N 2.78Å; I676-T680 PolarHBondContact O-OG1 3.34Å
681	D	63	Low	59.7	Low	64 Å²	64	110.6 Å²	110.6	34%	0.342	61%	0.606	S	S	.	*			trans	-93.7	-6.1	-179.3	60.3	-23	0	0	0	113.2	L675 P677 G678 V679 T683	L675-D681 HydrophobicContact CD1-CB 3.89Å; P677-D681 VanDerWaalsContact CA-OD2 3.27Å; P677-D681 WeakPolarHBondContact CA-OD2 3.17Å; G678-D681 VanDerWaalsContact C-OD1 3.31Å; G678-D681 VanDerWaalsContact CA-OD1 3.27Å; G678-D681 WeakPolarHBondContact CA-OD1 3.38Å; G678-D681 PolarHBondContact N-OD1 3.27Å; G678-D681 PolarHBondContact N-OD2 2.94Å; V679-D681 PolarHBondContact N-OD1 3.27Å; D681-T683 VanDerWaalsContact C-N 3.26Å; D681-T683 PolarHBondContact O-N 2.31Å
682	N	61	Low	58.7	Low	114 Å²	114	106.6 Å²	106.6	61%	0.61	58%	0.583	S	S	*	*			trans	-64.2	77.1	176.2	-69.2	-70.5	0	0	0	112.2	G678 V679	G678-N682 VanDerWaalsContact C-ND2 3.35Å; G678-N682 PolarHBondContact O-ND2 2.96Å; V679-N682 PolarHBondContact O-ND2 3.2Å
683	T	56.3	Low	57.2	Low	127 Å²	127	105.9 Å²	105.9	78%	0.779	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-60.1	125.9	164.2	40.3	0	0	0	0	109.5	D681 D685	D681-T683 VanDerWaalsContact C-N 3.26Å; D681-T683 PolarHBondContact O-N 2.31Å; T683-D685 PolarHBondContact O-N 2.68Å
684	P	56.1	Low	56	Low	96 Å²	96	105.9 Å²	105.9	62%	0.623	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-63.8	134.2	172.7	27.8	-33.3	0	0	0	109.5
685	D	56.6	Low	55.1	Low	105 Å²	105	107.7 Å²	107.7	56%	0.561	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-62.7	124.6	-179.2	-172.9	-33.4	0	0	0	110.2	T683 E687 D688	T683-D685 PolarHBondContact O-N 2.68Å; D685-E687 PolarHBondContact O-N 2.73Å; D685-E687 PolarHBondContact OD1-N 3.28Å; D685-D688 HydrophobicContact CB-CB 3.96Å; D685-D688 PolarHBondContact O-N 3.45Å
686	P	53.6	Low	54.7	Low	104 Å²	104	105.5 Å²	105.5	68%	0.675	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-12.4	-179.2	29.5	-36.6	0	0	0	114.1	K689	P686-K689 WeakPolarHBondContact O-CE 3.46Å
687	E	52.5	Low	54.7	Low	176 Å²	176	107.2 Å²	107.2	82%	0.822	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-12.1	170.3	-59.3	-153.3	158.5	0	0	113.4	D685 K689	D685-E687 PolarHBondContact O-N 2.73Å; D685-E687 PolarHBondContact OD1-N 3.28Å; E687-K689 PolarHBondContact O-N 2.79Å
688	D	49.9	Very low	56	Low	79 Å²	79	106.4 Å²	106.4	42%	0.422	56%	0.562	S	S	.	*			trans	-74.5	43.7	172	-166.1	42.6	0	0	0	112.6	R658 D685 H690	R658-D688 IonicContact CZ-OD2 3.36Å; R658-D688 IonicContact NH2-OD2 3.93Å; R658-D688 PolarHBondContact NH2-OD2 2.7Å; D685-D688 HydrophobicContact CB-CB 3.96Å; D685-D688 PolarHBondContact O-N 3.45Å; D688-H690 VanDerWaalsContact CG-CD2 3.47Å; D688-H690 PolarHBondContact O-N 2.83Å; D688-H690 IonicContact OD1-CD2 3.39Å; D688-H690 PolarHBondContact OD1-CD2 2.73Å; D688-H690 IonicContact OD1-CG 2.96Å; D688-H690 IonicContact OD1-NE2 3.83Å; D688-H690 PolarHBondContact OD1-NE2 3.05Å; D688-H690 IonicContact OD2-CD2 3.18Å; D688-H690 PolarHBondContact OD2-CD2 3.4Å; D688-H690 IonicContact OD2-NE2 2.67Å
689	K	47.8	Very low	57.7	Low	175 Å²	175	105.4 Å²	105.4	76%	0.761	55%	0.545	S	S	*	.			trans	-72.8	58.6	171.1	-68.2	173.7	-178.4	156.9	0	110.5	P686 E687 P691	P686-K689 WeakPolarHBondContact O-CE 3.46Å; E687-K689 PolarHBondContact O-N 2.79Å; K689-P691 WeakPolarHBondContact O-CD 3.28Å
690	H	45.3	Very low	59.4	Low	90 Å²	90	100.8 Å²	100.8	42%	0.417	52%	0.516	S	S	.	.			trans	-49.6	127.5	162	-80.7	-78.3	0	0	0	109.1	R658 D688 Y692	R658-H690 PolarHBondContact NH1-CD2 3.36Å; R658-H690 PolarHBondContact NH1-NE2 3.4Å; R658-H690 PolarHBondContact NH2-CD2 3.37Å; R658-H690 VanDerWaalsContact NH2-CD2 3.29Å; D688-H690 VanDerWaalsContact CG-CD2 3.47Å; D688-H690 PolarHBondContact O-N 2.83Å; D688-H690 IonicContact OD1-CD2 3.39Å; D688-H690 PolarHBondContact OD1-CD2 2.73Å; D688-H690 IonicContact OD1-CG 2.96Å; D688-H690 IonicContact OD1-NE2 3.83Å; D688-H690 PolarHBondContact OD1-NE2 3.05Å; D688-H690 IonicContact OD2-CD2 3.18Å; D688-H690 PolarHBondContact OD2-CD2 3.4Å; D688-H690 IonicContact OD2-NE2 2.67Å; H690-Y692 HydrophobicContact CB-CD2 3.48Å; H690-Y692 VanDerWaalsContact CB-CD2 3.48Å; H690-Y692 HydrophobicContact CB-CE2 3.41Å; H690-Y692 VanDerWaalsContact CB-CE2 3.41Å; H690-Y692 HydrophobicContact CB-CG 4.45Å; H690-Y692 AromaticContact CG-CE2 3.79Å; H690-Y692 PolarHBondContact O-N 3.03Å
691	P	41.1	Very low	61.2	Low	109 Å²	109	99.7 Å²	99.7	71%	0.708	51%	0.511	S	S	*	.			trans	-75.1	70.1	175.7	31.4	-35.1	0	0	0	110.2	K689 T693	K689-P691 WeakPolarHBondContact O-CD 3.28Å; P691-T693 HydrophobicContact CB-CG2 4.43Å; P691-T693 PolarHBondContact O-N 3.11Å
692	Y	42.4	Very low	62.9	Low	108 Å²	108	97.1 Å²	97.1	42%	0.424	50%	0.496	S	S	.	.			trans	-72.2	75.5	167.2	-76.2	-66.6	0	0	0	109	R658 H690 T694	R658-Y692 PolarHBondContact NH1-OH 2.94Å; H690-Y692 HydrophobicContact CB-CD2 3.48Å; H690-Y692 VanDerWaalsContact CB-CD2 3.48Å; H690-Y692 HydrophobicContact CB-CE2 3.41Å; H690-Y692 VanDerWaalsContact CB-CE2 3.41Å; H690-Y692 HydrophobicContact CB-CG 4.45Å; H690-Y692 AromaticContact CG-CE2 3.79Å; H690-Y692 PolarHBondContact O-N 3.03Å; Y692-T694 PolarHBondContact O-N 3.23Å
693	T	42.7	Very low	64.5	Low	131 Å²	131	97.9 Å²	97.9	80%	0.804	49%	0.492	S	S	*	.			trans	-66.1	-0.5	-178	46.5	0	0	0	0	114.4	P691	P691-T693 HydrophobicContact CB-CG2 4.43Å; P691-T693 PolarHBondContact O-N 3.11Å
694	T	46.9	Very low	66.4	Low	85 Å²	85	92.3 Å²	92.3	52%	0.521	46%	0.457	S	S	.	.			trans	-108.4	58.7	177.7	46.3	0	0	0	0	112.3	Y692 F696	Y692-T694 PolarHBondContact O-N 3.23Å; T694-F696 PolarHBondContact O-N 3.13Å
695	R	56.7	Low	68.2	Low	200 Å²	200	89.9 Å²	89.9	76%	0.755	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-59.8	122.8	148.7	-79.1	-176.2	171.6	-175.8	-4.7	106.9	R697	R695-R697 PolarHBondContact O-N 3.45Å
696	F	61.6	Low	70.2	Confident	72 Å²	72	85 Å²	85	32%	0.316	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-55	132.1	174	-58.7	-73.8	0	0	0	109.5	A615 P616 R659 T694 Q698	A615-F696 HydrophobicContact CB-CB 3.87Å; P616-F696 HydrophobicContact CB-CB 4.47Å; P616-F696 HydrophobicContact CB-CD1 3.65Å; P616-F696 HydrophobicContact CB-CE1 4.07Å; P616-F696 HydrophobicContact CB-CG 4.18Å; P616-F696 HydrophobicContact CG-CD1 3.76Å; P616-F696 HydrophobicContact CG-CE1 3.72Å; P616-F696 HydrophobicContact CG-CG 4.23Å; P616-F696 HydrophobicContact CG-CZ 4.18Å; R659-F696 HydrophobicContact CB-CE2 4.48Å; R659-F696 HydrophobicContact CB-CZ 4.49Å; T694-F696 PolarHBondContact O-N 3.13Å; F696-Q698 PolarHBondContact O-N 3.44Å
697	R	74.4	Confident	72.2	Confident	127 Å²	127	87.4 Å²	87.4	48%	0.479	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-71.2	127.8	-179.1	-64.1	180	172.3	-178.9	0.8	109	Y590 D626 N627 R695 T699	Y590-R697 WeakPolarHBondContact CE1-O 3.38Å; Y590-R697 PolarHBondContact OH-O 2.95Å; D626-R697 HydrophobicContact CB-CB 4.12Å; D626-R697 HydrophobicContact CB-CG 4.38Å; D626-R697 WeakPolarHBondContact OD2-CB 3.39Å; D626-R697 WeakPolarHBondContact OD2-CD 3.45Å; D626-R697 WeakPolarHBondContact OD2-CG 3.38Å; N627-R697 PolarHBondContact OD1-NH1 3.12Å; R695-R697 PolarHBondContact O-N 3.45Å; R697-T699 WeakPolarHBondContact CB-O 3.24Å; R697-T699 PolarHBondContact O-N 3.19Å; R697-T699 VanDerWaalsContact O-N 3.12Å
698	Q	89.8	Confident	74.4	Confident	83 Å²	83	79.9 Å²	79.9	39%	0.388	38%	0.375	S	S	.	.	S	Bend	trans	-73.3	6	172.8	-65.1	177.5	-45.3	0	0	112.9	Y589 Y590 H591 A615 F696	Y589-Q698 WeakPolarHBondContact CA-O 3.45Å; Y589-Q698 HydrophobicContact CD2-CB 3.95Å; Y589-Q698 WeakPolarHBondContact CD2-O 3.42Å; Y589-Q698 HydrophobicContact CE2-CB 3.42Å; Y589-Q698 VanDerWaalsContact CE2-CB 3.42Å; Y589-Q698 HydrophobicContact CE2-CG 4.36Å; Y590-Q698 VanDerWaalsContact CD1-O 3.24Å; Y590-Q698 WeakPolarHBondContact CD1-O 3.34Å; Y590-Q698 PolarHBondContact N-O 3.41Å; H591-Q698 HydrophobicContact CB-CB 3.58Å; H591-Q698 HydrophobicContact CB-CG 3.72Å; H591-Q698 PolarHBondContact CD2-NE2 3.14Å; A615-Q698 HydrophobicContact CB-CG 4.47Å; F696-Q698 PolarHBondContact O-N 3.44Å
699	T	93.5	Very high	76.6	Confident	34 Å²	34	76.3 Å²	76.3	21%	0.209	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	127.5	-169.3	-52.3	0	0	0	0	109.2	Q587 L588 R697	Q587-T699 HydrophobicContact CG-CG2 3.28Å; L588-T699 CarbonylContact O-C 3.58Å; L588-T699 VanDerWaalsContact O-CA 3.24Å; L588-T699 WeakPolarHBondContact O-CA 3.39Å; R697-T699 WeakPolarHBondContact CB-O 3.24Å; R697-T699 PolarHBondContact O-N 3.19Å; R697-T699 VanDerWaalsContact O-N 3.12Å
700	I	96.5	Very high	79	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	155.5	166.7	55.1	178.1	0	0	0	110.1	L539 L582 Q587 L588 Y590 L617 W618 D626	L539-I700 HydrophobicContact CB-CD1 4.38Å; L539-I700 HydrophobicContact CD1-CD1 4.19Å; L539-I700 HydrophobicContact CD2-CD1 4.32Å; L582-I700 HydrophobicContact CD1-CG1 4.12Å; L582-I700 HydrophobicContact CD2-CD1 3.58Å; L582-I700 HydrophobicContact CD2-CG1 4.12Å; Q587-I700 WeakPolarHBondContact CA-O 3.44Å; L588-I700 HydrophobicContact CB-CG1 4.19Å; L588-I700 PolarHBondContact N-O 3.4Å; L588-I700 PolarHBondContact O-N 3.48Å; Y590-I700 HydrophobicContact CD1-CB 4.49Å; Y590-I700 HydrophobicContact CD1-CG1 4.11Å; Y590-I700 HydrophobicContact CD1-CG2 4.09Å; Y590-I700 HydrophobicContact CE1-CG2 3.74Å; L617-I700 HydrophobicContact CD2-CD1 3.79Å; L617-I700 HydrophobicContact CD2-CG2 4.31Å; W618-I700 HydrophobicContact CH2-CG2 3.82Å; W618-I700 HydrophobicContact CZ2-CG2 4.4Å; W618-I700 HydrophobicContact CZ3-CG2 4.37Å; D626-I700 CarbonylContact O-C 3.58Å; D626-I700 WeakPolarHBondContact O-CA 3.45Å
701	S	97.5	Very high	81.2	Confident	15 Å²	15	65.9 Å²	65.9	11%	0.105	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	173.8	-176.9	52.1	0	0	0	0	112.6	R586 D626 N627 C628	R586-S701 CarbonylContact O-C 3.58Å; R586-S701 WeakPolarHBondContact O-CA 3.07Å; R586-S701 WeakPolarHBondContact O-CB 3.49Å; D626-S701 PolarHBondContact O-N 3.37Å; D626-S701 PolarHBondContact O-OG 3.37Å; N627-S701 CarbonylContact C-O 3.51Å; N627-S701 VanDerWaalsContact CA-O 3.29Å; N627-S701 WeakPolarHBondContact CA-O 3.24Å; C628-S701 WeakPolarHBondContact CB-O 3.43Å; C628-S701 PolarHBondContact N-O 3.09Å; C628-S701 PolarHBondContact SG-O 3.39Å
702	H	97.9	Very high	83.8	Confident	9 Å²	9	61.1 Å²	61.1	4%	0.042	29%	0.289	C	S	.	.			trans	-149.8	167.4	170.7	63.5	75.3	0	0	0	113	L546 L582 I583 R586 C628 L704	L546-H702 HydrophobicContact CD1-CB 4.39Å; L582-H702 PolarHBondContact O-NE2 3.16Å; I583-H702 WeakPolarHBondContact CA-NE2 3.36Å; I583-H702 PolarHBondContact O-CE1 3.34Å; I583-H702 PolarHBondContact O-NE2 3.34Å; R586-H702 WeakPolarHBondContact CB-O 3.28Å; R586-H702 PolarHBondContact O-N 2.79Å; C628-H702 HydrophobicContact CB-CB 4.2Å; H702-L704 PolarHBondContact CE1-O 3.33Å; H702-L704 PolarHBondContact ND1-N 3.36Å; H702-L704 PolarHBondContact ND1-O 3.21Å; H702-L704 VanDerWaalsContact ND1-O 3.13Å
703	Y	95.8	Very high	86.1	Confident	131 Å²	131	60.9 Å²	60.9	51%	0.514	29%	0.29	S	S	.	.	S	Bend	trans	-94.6	-16.4	-178.3	-63.6	-69.9	0	0	0	114.9	N627 Q629 N705	N627-Y703 HydrophobicContact CB-CE2 3.81Å; Q629-Y703 VanDerWaalsContact CD-CE2 3.48Å; Q629-Y703 HydrophobicContact CG-CD2 4.21Å; Q629-Y703 HydrophobicContact CG-CE2 4.13Å; Y703-N705 PolarHBondContact O-N 3.18Å
704	L	95.3	Very high	88.2	Confident	10 Å²	10	56.3 Å²	56.3	5%	0.052	26%	0.26	C	S	.	.			trans	-62.4	133	179.4	-50.4	-178.2	0	0	0	111.6	L546 I549 D550 V553 R586 H702 L706	L546-L704 HydrophobicContact CD2-CD1 3.73Å; I549-L704 HydrophobicContact CB-CD1 3.94Å; I549-L704 HydrophobicContact CG2-CD1 3.46Å; I549-L704 VanDerWaalsContact CG2-CD1 3.46Å; I549-L704 HydrophobicContact CG2-CD2 4.02Å; I549-L704 HydrophobicContact CG2-CG 4.4Å; D550-L704 HydrophobicContact CB-CD2 4.35Å; V553-L704 HydrophobicContact CG2-CD2 4.33Å; R586-L704 WeakPolarHBondContact CD-O 3.43Å; R586-L704 WeakPolarHBondContact CG-O 3.3Å; R586-L704 PolarHBondContact NE-O 3.35Å; H702-L704 PolarHBondContact CE1-O 3.33Å; H702-L704 PolarHBondContact ND1-N 3.36Å; H702-L704 PolarHBondContact ND1-O 3.21Å; H702-L704 VanDerWaalsContact ND1-O 3.13Å; L704-L706 HydrophobicContact CB-CD1 4.16Å; L704-L706 HydrophobicContact CB-CG 4Å; L704-L706 HydrophobicContact CD1-CD1 4.22Å
705	N	94.9	Very high	89.9	Confident	45 Å²	45	56.1 Å²	56.1	24%	0.241	26%	0.261	C	S	.	.			trans	-94.6	93.8	173.8	176.3	53.3	0	0	0	109.3	R586 Y703 S739 P740	R586-N705 PolarHBondContact NH2-OD1 3.24Å; Y703-N705 PolarHBondContact O-N 3.18Å; N705-S739 VanDerWaalsContact O-CA 3.31Å; N705-S739 WeakPolarHBondContact O-CA 3.48Å; N705-P740 WeakPolarHBondContact ND2-CD 3.43Å; N705-P740 WeakPolarHBondContact ND2-CG 3.48Å; N705-P740 WeakPolarHBondContact O-CD 3.28Å
706	L	97.4	Very high	91.1	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.01	27%	0.269	C	S	.	.			trans	-111.6	148.5	-175.7	-62.8	176.1	0	0	0	112.3	V565 L567 I583 L704 F737 Y738	V565-L706 HydrophobicContact CB-CD2 4.16Å; V565-L706 HydrophobicContact CG1-CD2 3.92Å; L567-L706 HydrophobicContact CD2-CD1 3.91Å; I583-L706 HydrophobicContact CG2-CB 4.17Å; I583-L706 HydrophobicContact CG2-CD1 3.89Å; L704-L706 HydrophobicContact CB-CD1 4.16Å; L704-L706 HydrophobicContact CB-CG 4Å; L704-L706 HydrophobicContact CD1-CD1 4.22Å; L706-F737 HydrophobicContact CB-CB 4.39Å; L706-Y738 WeakPolarHBondContact CA-O 3.12Å
707	R	96.6	Very high	92.2	Very high	155 Å²	155	50.5 Å²	50.5	59%	0.585	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.4	147.9	169.2	-70.5	-171.3	177.3	-177.8	-5.7	109.9	F737 Y738 P740	R707-F737 CarbonylContact O-C 3.45Å; R707-F737 VanDerWaalsContact O-CA 3.27Å; R707-F737 WeakPolarHBondContact O-CA 3.49Å; R707-Y738 HydrophobicContact CB-CE1 4.31Å; R707-Y738 PolarHBondContact N-O 3.27Å; R707-Y738 WeakPolarHBondContact O-CD1 3.37Å; R707-Y738 PolarHBondContact O-N 2.9Å; R707-P740 HydrophobicContact CG-CG 4.08Å
708	S	97.9	Very high	92.7	Very high	18 Å²	18	51.2 Å²	51.2	13%	0.126	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	144.6	168.5	177.8	0	0	0	0	110.8	Y580 Y710 H712	Y580-S708 WeakPolarHBondContact OH-CB 3.15Å; S708-Y710 WeakPolarHBondContact CB-O 3.39Å; S708-Y710 PolarHBondContact OG-N 2.99Å; S708-Y710 PolarHBondContact OG-O 3.08Å; S708-H712 PolarHBondContact OG-CE1 2.92Å; S708-H712 VanDerWaalsContact OG-CE1 3.25Å
709	A	97.8	Very high	92.6	Very high	3 Å²	3	51 Å²	51	3%	0.025	28%	0.281	C	S	.	.	S	Bend	trans	-77.2	-24.8	164.3	0	0	0	0	0	112.5	I736 Y738 L762 R765 A794 F796	A709-I736 HydrophobicContact CB-CB 4.3Å; A709-I736 HydrophobicContact CB-CG2 4.44Å; A709-I736 PolarHBondContact N-O 3.41Å; A709-Y738 HydrophobicContact CB-CD1 4.31Å; A709-Y738 HydrophobicContact CB-CE1 4.32Å; A709-L762 HydrophobicContact CB-CD1 4.2Å; A709-L762 HydrophobicContact CB-CD2 4.27Å; A709-R765 VanDerWaalsContact O-CD 3.31Å; A709-R765 WeakPolarHBondContact O-CD 3.4Å; A709-R765 PolarHBondContact O-NH1 3.22Å; A709-A794 HydrophobicContact CB-CB 3.99Å; A709-F796 HydrophobicContact CB-CZ 4.38Å
710	Y	97.2	Very high	92.5	Very high	9 Å²	9	51.8 Å²	51.8	4%	0.035	29%	0.291	C	S	.	.			trans	-95.1	150.3	179.4	-73.7	-85.8	0	0	0	112.7	S708 H712 R765 L766 L768 L792 L793	S708-Y710 WeakPolarHBondContact CB-O 3.39Å; S708-Y710 PolarHBondContact OG-N 2.99Å; S708-Y710 PolarHBondContact OG-O 3.08Å; Y710-H712 PolarHBondContact O-NE2 3Å; Y710-R765 HydrophobicContact CE1-CG 4.37Å; Y710-L766 VanDerWaalsContact CE1-O 3.23Å; Y710-L766 WeakPolarHBondContact CE1-O 3.27Å; Y710-L766 PolarHBondContact OH-O 3.18Å; Y710-L768 HydrophobicContact CD1-CD1 3.53Å; Y710-L768 HydrophobicContact CD1-CG 3.83Å; Y710-L768 HydrophobicContact CE1-CD1 3.92Å; Y710-L768 HydrophobicContact CE1-CG 3.7Å; Y710-L768 HydrophobicContact CG-CD1 4.04Å; Y710-L792 HydrophobicContact CD2-CD2 3.72Å; Y710-L792 HydrophobicContact CD2-CG 4.03Å; Y710-L792 HydrophobicContact CE2-CB 3.77Å; Y710-L792 HydrophobicContact CE2-CD2 3.78Å; Y710-L792 HydrophobicContact CE2-CG 3.62Å; Y710-L793 PolarHBondContact OH-N 2.98Å; Y710-L793 PolarHBondContact OH-O 3.24Å
711	G	92.4	Very high	92.4	Very high	38 Å²	38	52 Å²	52	39%	0.392	29%	0.292	S	S	.	.			trans	-91.1	-21.1	-176.7	0	0	0	0	0	113.2	F713 E721 R765	G711-F713 PolarHBondContact O-N 3.07Å; G711-E721 PolarHBondContact N-OE2 2.94Å; G711-R765 VanDerWaalsContact N-NH1 3.12Å
712	H	94.4	Very high	92.3	Very high	9 Å²	9	51.6 Å²	51.6	4%	0.042	29%	0.289	C	S	.	.	S	Bend	trans	70.9	4.4	-175.5	-38.6	-56.4	0	0	0	114.3	P575 Y580 S708 Y710 A720 E721 Y735	P575-H712 HydrophobicContact CB-CB 3.84Å; P575-H712 HydrophobicContact CG-CB 3.69Å; Y580-H712 AromaticContact CE2-CE1 3.92Å; Y580-H712 AromaticContact CE2-NE2 3.46Å; Y580-H712 WeakPolarHBondContact CE2-NE2 3.23Å; Y580-H712 AromaticContact CZ-NE2 3.39Å; Y580-H712 PolarHBondContact OH-NE2 2.83Å; S708-H712 PolarHBondContact OG-CE1 2.92Å; S708-H712 VanDerWaalsContact OG-CE1 3.25Å; Y710-H712 PolarHBondContact O-NE2 3Å; H712-A720 WeakPolarHBondContact O-CA 3.49Å; H712-E721 VanDerWaalsContact CA-OE2 3.3Å; H712-E721 WeakPolarHBondContact CA-OE2 3.46Å; H712-E721 PolarHBondContact N-OE2 2.96Å; H712-E721 PolarHBondContact O-N 3.32Å; H712-Y735 AromaticContact CE1-CD1 3.72Å; H712-Y735 AromaticContact CE1-CE1 3.48Å; H712-Y735 VanDerWaalsContact CE1-CE1 3.48Å; H712-Y735 WeakPolarHBondContact CE1-CE1 3.28Å; H712-Y735 AromaticContact ND1-CE1 3.93Å
713	F	91.9	Very high	92.3	Very high	103 Å²	103	51.2 Å²	51.2	45%	0.452	29%	0.288	S	S	.	.	B	Isolated β-bridge	trans	-143.2	137.9	178.1	-63.4	-86.2	0	0	0	109.5	G711 R719 E721	G711-F713 PolarHBondContact O-N 3.07Å; F713-R719 CarbonylContact C-O 3.55Å; F713-R719 VanDerWaalsContact CA-O 3.32Å; F713-R719 WeakPolarHBondContact CA-O 3.07Å; F713-E721 PolarHBondContact N-OE2 2.92Å
714	I	86.9	Confident	92.4	Very high	34 Å²	34	45.4 Å²	45.4	17%	0.174	27%	0.266	C	S	.	.			trans	-67.4	121.1	-178.5	-65.1	-69.5	0	0	0	109.2	G716 T717 R719 E721 P770	I714-G716 PolarHBondContact O-N 2.62Å; I714-T717 WeakPolarHBondContact CB-OG1 3.29Å; I714-T717 HydrophobicContact CG2-CG2 4.43Å; I714-T717 PolarHBondContact O-N 3.1Å; I714-T717 PolarHBondContact O-OG1 3.26Å; I714-R719 PolarHBondContact N-O 3.26Å; I714-E721 HydrophobicContact CD1-CG 3.82Å; I714-E721 HydrophobicContact CG1-CG 4.21Å; I714-P770 HydrophobicContact CD1-CG 4.49Å; I714-P770 HydrophobicContact CG1-CB 4.15Å; I714-P770 HydrophobicContact CG1-CG 4.21Å
715	P	82.4	Confident	92.4	Very high	82 Å²	82	45 Å²	45	53%	0.532	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	126.8	-171.7	-30.3	35.8	0	0	0	114.3
716	G	80.9	Confident	92.2	Very high	90 Å²	90	43.5 Å²	43.5	93%	0.928	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.7	6.2	-178.3	0	0	0	0	0	115	I714	I714-G716 PolarHBondContact O-N 2.62Å
717	T	85.1	Confident	91.7	Very high	63 Å²	63	45.8 Å²	45.8	39%	0.387	27%	0.271	S	S	.	.	S	Bend	trans	-135.5	165.6	176.1	78.2	0	0	0	0	111.4	I714 R719	I714-T717 WeakPolarHBondContact CB-OG1 3.29Å; I714-T717 HydrophobicContact CG2-CG2 4.43Å; I714-T717 PolarHBondContact O-N 3.1Å; I714-T717 PolarHBondContact O-OG1 3.26Å; T717-R719 VanDerWaalsContact C-N 3.33Å; T717-R719 PolarHBondContact OG1-N 3.49Å
718	D	85.2	Confident	91.2	Very high	142 Å²	142	45.4 Å²	45.4	76%	0.759	28%	0.276	S	S	*	.	S	Bend	trans	-89.4	6.9	169.7	-60.5	-45.7	0	0	0	112.8
719	R	87.2	Confident	90.5	Very high	79 Å²	79	47.7 Å²	47.7	30%	0.298	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-74.9	130.2	179.7	-66.2	174.4	73.7	-147.6	-3.6	109.7	F713 I714 T717 P770 E772 D773	F713-R719 CarbonylContact C-O 3.55Å; F713-R719 VanDerWaalsContact CA-O 3.32Å; F713-R719 WeakPolarHBondContact CA-O 3.07Å; I714-R719 PolarHBondContact N-O 3.26Å; T717-R719 VanDerWaalsContact C-N 3.33Å; T717-R719 PolarHBondContact OG1-N 3.49Å; R719-P770 HydrophobicContact CB-CB 4.42Å; R719-E772 VanDerWaalsContact CZ-CD 3.45Å; R719-E772 IonicContact CZ-OE1 2.71Å; R719-E772 IonicContact CZ-OE2 3.65Å; R719-E772 IonicContact NE-OE1 3.27Å; R719-E772 PolarHBondContact NE-OE1 3.13Å; R719-E772 IonicContact NE-OE2 3.16Å; R719-E772 PolarHBondContact NE-OE2 2.96Å; R719-E772 VanDerWaalsContact NE-OE2 3.16Å; R719-E772 VanDerWaalsContact NH2-CG 3.29Å; R719-E772 IonicContact NH2-OE1 3.67Å; R719-E772 PolarHBondContact NH2-OE1 2.67Å; R719-E772 IonicContact NH2-OE2 3.02Å; R719-E772 PolarHBondContact NH2-OE2 3.45Å; R719-D773 IonicContact CZ-OD1 3.64Å; R719-D773 IonicContact NH1-OD1 3.31Å; R719-D773 PolarHBondContact NH1-OD1 2.91Å; R719-D773 VanDerWaalsContact NH1-OD1 3.1Å; R719-D773 IonicContact NH2-OD1 2.73Å; R719-D773 PolarHBondContact NH2-OD1 3.25Å
720	A	91.7	Very high	90.1	Very high	51 Å²	51	48.3 Å²	48.3	42%	0.421	30%	0.296	S	S	.	.	B	Isolated β-bridge	trans	-69.3	144.6	177.4	0	0	0	0	0	111.7	H712 P770	H712-A720 WeakPolarHBondContact O-CA 3.49Å; A720-P770 WeakPolarHBondContact O-CA 3.25Å; A720-P770 WeakPolarHBondContact O-CB 3.3Å
721	E	93.5	Very high	90	Very high	3 Å²	3	48.3 Å²	48.3	1%	0.014	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-73.9	143.8	161.6	-65.9	179.5	113.4	0	0	108.7	G711 H712 F713 I714 T732 L768	G711-E721 PolarHBondContact N-OE2 2.94Å; H712-E721 VanDerWaalsContact CA-OE2 3.3Å; H712-E721 WeakPolarHBondContact CA-OE2 3.46Å; H712-E721 PolarHBondContact N-OE2 2.96Å; H712-E721 PolarHBondContact O-N 3.32Å; F713-E721 PolarHBondContact N-OE2 2.92Å; I714-E721 HydrophobicContact CD1-CG 3.82Å; I714-E721 HydrophobicContact CG1-CG 4.21Å; E721-T732 PolarHBondContact O-OG1 3.12Å; E721-L768 HydrophobicContact CB-CB 3.86Å; E721-L768 HydrophobicContact CB-CD1 3.82Å; E721-L768 HydrophobicContact CG-CB 4.02Å; E721-L768 HydrophobicContact CG-CD1 4.4Å
722	V	96.4	Very high	90.3	Very high	8 Å²	8	46.9 Å²	46.9	5%	0.048	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-119.8	148	167.4	-62.4	0	0	0	0	110.9	L769 E771 L774	V722-L769 VanDerWaalsContact CG2-O 3.29Å; V722-L769 WeakPolarHBondContact CG2-O 3.48Å; V722-L769 PolarHBondContact N-O 3.26Å; V722-E771 HydrophobicContact CG1-CB 4.38Å; V722-L774 HydrophobicContact CG2-CD1 3.57Å
723	T	98	Very high	90.5	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.006	28%	0.281	C	S	.	.	S	Bend	trans	-111.7	-17.9	176.4	70.1	0	0	0	0	112.4	A731 T732 V733 D734 L768 H789 L790 L792	T723-A731 PolarHBondContact N-O 3.3Å; T723-T732 HydrophobicContact CG2-CG2 3.86Å; T723-T732 WeakPolarHBondContact OG1-CA 3.37Å; T723-V733 PolarHBondContact OG1-N 3.34Å; T723-D734 WeakPolarHBondContact CB-OD2 3.16Å; T723-D734 HydrophobicContact CG2-CB 4.18Å; T723-D734 PolarHBondContact OG1-N 3.02Å; T723-D734 VanDerWaalsContact OG1-N 3.14Å; T723-D734 PolarHBondContact OG1-OD2 3.44Å; T723-L768 HydrophobicContact CG2-CD1 3.68Å; T723-L768 HydrophobicContact CG2-CD2 4.1Å; T723-H789 CarbonylContact O-C 3.48Å; T723-H789 WeakPolarHBondContact O-CA 3.3Å; T723-H789 WeakPolarHBondContact O-CB 3.32Å; T723-L790 PolarHBondContact O-N 2.97Å; T723-L792 HydrophobicContact CG2-CD1 3.74Å
724	T	97.6	Very high	90.8	Very high	9 Å²	9	41.9 Å²	41.9	6%	0.055	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	148.3	173.1	-171.2	0	0	0	0	111.2	G730 A731 V733 D788 H789	T724-G730 WeakPolarHBondContact O-CA 3.4Å; T724-A731 HydrophobicContact CG2-CB 4.05Å; T724-A731 PolarHBondContact N-O 3.03Å; T724-A731 PolarHBondContact O-N 3.35Å; T724-V733 HydrophobicContact CG2-CG2 3.8Å; T724-D788 CarbonylContact C-O 3.54Å; T724-D788 VanDerWaalsContact CA-O 3.31Å; T724-D788 WeakPolarHBondContact CA-O 3.36Å; T724-D788 PolarHBondContact OG1-O 2.84Å; T724-H789 PolarHBondContact OG1-CD2 2.79Å; T724-H789 PolarHBondContact OG1-NE2 2.9Å; T724-H789 VanDerWaalsContact OG1-NE2 3.14Å
725	L	95.8	Very high	91.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	114.6	171.2	178.5	64.2	0	0	0	111.5	G730 E771 L774 W775 L780 D788	L725-G730 VanDerWaalsContact CD1-CA 3.47Å; L725-E771 HydrophobicContact CD1-CG 4.04Å; L725-E771 HydrophobicContact CD2-CG 4.41Å; L725-L774 HydrophobicContact CB-CD1 3.92Å; L725-L774 HydrophobicContact CD2-CB 3.44Å; L725-L774 VanDerWaalsContact CD2-CB 3.44Å; L725-L774 HydrophobicContact CD2-CD1 3.97Å; L725-L774 HydrophobicContact CD2-CG 4.37Å; L725-W775 HydrophobicContact CD1-CZ2 3.76Å; L725-W775 HydrophobicContact CD2-CD2 4.05Å; L725-W775 HydrophobicContact CD2-CG 4.24Å; L725-W775 HydrophobicContact CD2-CZ2 4.23Å; L725-W775 HydrophobicContact CG-CZ2 4.11Å; L725-L780 HydrophobicContact CB-CD1 4.21Å; L725-L780 HydrophobicContact CB-CG 4.41Å; L725-L780 WeakPolarHBondContact O-CB 3.05Å; L725-D788 PolarHBondContact N-O 3.03Å
726	H	89.8	Confident	92.2	Very high	15 Å²	15	36.5 Å²	36.5	7%	0.069	23%	0.227	C	C	.	.			trans	-124.5	-174.5	168.5	64.3	92.6	0	0	0	110.4	L398 Y399 E728 V729	L398-H726 HydrophobicContact CB-CB 4.31Å; Y399-H726 HydrophobicContact CE1-CB 4.17Å; H726-E728 PolarHBondContact O-N 2.86Å; H726-V729 PolarHBondContact N-O 2.99Å; H726-V729 PolarHBondContact O-N 2.91Å
727	S	87.4	Confident	93	Very high	49 Å²	49	32.2 Å²	32.2	34%	0.343	18%	0.183	S	C	.	.	S	Bend	trans	-61.7	-14.4	-170.3	69.3	0	0	0	0	115.9	E397 L398 H401	E397-S727 PolarHBondContact O-OG 3.5Å; L398-S727 VanDerWaalsContact CA-OG 3.31Å; L398-S727 WeakPolarHBondContact CA-OG 3.48Å; L398-S727 VanDerWaalsContact O-CB 3.3Å; L398-S727 WeakPolarHBondContact O-CB 3.21Å; L398-S727 PolarHBondContact O-N 2.74Å; L398-S727 PolarHBondContact O-OG 2.95Å; H401-S727 PolarHBondContact CE1-N 3.02Å
728	E	84.8	Confident	93.7	Very high	148 Å²	148	30.3 Å²	30.3	69%	0.692	17%	0.169	S	C	*	.	S	Bend	trans	-107.2	-30.5	-177	-53.8	-167.3	135.1	0	0	114.3	L398 H726	L398-E728 HydrophobicContact CD2-CG 3.96Å; H726-E728 PolarHBondContact O-N 2.86Å
729	V	83.4	Confident	94.2	Very high	65 Å²	65	24.2 Å²	24.2	39%	0.394	14%	0.137	S	C	.	.			trans	-158.2	139.6	-174	66.2	0	0	0	0	113.4	H726 A731	H726-V729 PolarHBondContact N-O 2.99Å; H726-V729 PolarHBondContact O-N 2.91Å; V729-A731 HydrophobicContact CG2-CB 4.37Å
730	G	90.8	Very high	94.6	Very high	16 Å²	16	21.2 Å²	21.2	17%	0.165	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	130.6	159.6	0	0	0	0	0	110.9	T724 L725	T724-G730 WeakPolarHBondContact O-CA 3.4Å; L725-G730 VanDerWaalsContact CD1-CA 3.47Å
731	A	95.2	Very high	94.4	Very high	10 Å²	10	23.4 Å²	23.4	8%	0.083	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	155.4	-174.2	0	0	0	0	0	113.4	L574 T723 T724 V729 V733	L574-A731 HydrophobicContact CD2-CB 3.7Å; T723-A731 PolarHBondContact N-O 3.3Å; T724-A731 HydrophobicContact CG2-CB 4.05Å; T724-A731 PolarHBondContact N-O 3.03Å; T724-A731 PolarHBondContact O-N 3.35Å; V729-A731 HydrophobicContact CG2-CB 4.37Å; A731-V733 HydrophobicContact CB-CG1 4.16Å
732	T	97.9	Very high	93.5	Very high	7 Å²	7	31.2 Å²	31.2	4%	0.043	15%	0.154	C	C	.	.			trans	-93.2	119.4	157.5	-77.2	0	0	0	0	108.8	P575 E721 T723 Y735	P575-T732 HydrophobicContact CG-CG2 3.66Å; E721-T732 PolarHBondContact O-OG1 3.12Å; T723-T732 HydrophobicContact CG2-CG2 3.86Å; T723-T732 WeakPolarHBondContact OG1-CA 3.37Å; T732-Y735 HydrophobicContact CG2-CD1 4.47Å; T732-Y735 HydrophobicContact CG2-CE1 3.66Å; T732-Y735 PolarHBondContact O-OH 2.79Å
733	V	98.3	Very high	91.6	Very high	7 Å²	7	33.9 Å²	33.9	4%	0.042	18%	0.183	C	C	.	.			trans	-133.1	-19.5	175.8	-64.3	0	0	0	0	113.4	F571 L574 T723 T724 A731 Y735	F571-V733 PolarHBondContact N-O 2.9Å; L574-V733 HydrophobicContact CD2-CG1 4.38Å; T723-V733 PolarHBondContact OG1-N 3.34Å; T724-V733 HydrophobicContact CG2-CG2 3.8Å; A731-V733 HydrophobicContact CB-CG1 4.16Å; V733-Y735 WeakPolarHBondContact O-CD2 3.32Å; V733-Y735 VanDerWaalsContact O-CE2 3.24Å; V733-Y735 WeakPolarHBondContact O-CE2 3.39Å
734	D	98.8	Very high	89.1	Confident	1 Å²	1	42 Å²	42	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	143.7	176.1	-52.3	-97.3	0	0	0	110.7	G569 T723 H789 L792	G569-D734 WeakPolarHBondContact O-CA 3.05Å; T723-D734 WeakPolarHBondContact CB-OD2 3.16Å; T723-D734 HydrophobicContact CG2-CB 4.18Å; T723-D734 PolarHBondContact OG1-N 3.02Å; T723-D734 VanDerWaalsContact OG1-N 3.14Å; T723-D734 PolarHBondContact OG1-OD2 3.44Å; D734-H789 IonicContact OD1-CE1 2.69Å; D734-H789 IonicContact OD1-ND1 2.69Å; D734-H789 PolarHBondContact OD1-ND1 2.87Å; D734-H789 IonicContact OD2-CE1 3.93Å; D734-H789 IonicContact OD2-CG 2.69Å; D734-H789 IonicContact OD2-ND1 3.25Å; D734-H789 PolarHBondContact OD2-ND1 3.03Å; D734-L792 HydrophobicContact CB-CD1 3.7Å; D734-L792 HydrophobicContact CB-CD2 4.12Å; D734-L792 WeakPolarHBondContact O-CD2 3.32Å
735	Y	98.8	Very high	86.1	Confident	3 Å²	3	46.7 Å²	46.7	1%	0.012	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	148.3	179.1	-59	-78.6	0	0	0	112.6	C568 G569 F571 A573 P575 Y580 H712 T732 V733 F737	C568-Y735 VanDerWaalsContact CA-O 3.3Å; C568-Y735 WeakPolarHBondContact CA-O 3.39Å; G569-Y735 PolarHBondContact N-O 3.29Å; G569-Y735 PolarHBondContact O-N 2.98Å; G569-Y735 VanDerWaalsContact O-N 3.08Å; F571-Y735 HydrophobicContact CB-CD2 4.04Å; F571-Y735 HydrophobicContact CB-CE2 4.14Å; F571-Y735 AromaticContact CD2-CD2 3.64Å; F571-Y735 HydrophobicContact CD2-CD2 3.64Å; F571-Y735 HydrophobicContact CD2-CG 4.46Å; F571-Y735 HydrophobicContact CE2-CD2 4.43Å; F571-Y735 HydrophobicContact CG-CD2 4.02Å; A573-Y735 WeakPolarHBondContact O-CE2 3.45Å; A573-Y735 PolarHBondContact O-OH 3.22Å; P575-Y735 VanDerWaalsContact CD-OH 3.28Å; P575-Y735 WeakPolarHBondContact CD-OH 3.42Å; P575-Y735 HydrophobicContact CG-CE1 4.36Å; Y580-Y735 HydrophobicContact CD2-CD1 4.19Å; Y580-Y735 AromaticContact CD2-CE1 3.64Å; Y580-Y735 HydrophobicContact CD2-CE1 3.64Å; Y580-Y735 HydrophobicContact CD2-CE2 4.38Å; Y580-Y735 AromaticContact CD2-CZ 3.77Å; Y580-Y735 AromaticContact CE2-CD1 3.93Å; Y580-Y735 HydrophobicContact CE2-CD1 3.93Å; Y580-Y735 AromaticContact CE2-CE1 3.61Å; Y580-Y735 HydrophobicContact CE2-CE1 3.61Å; H712-Y735 AromaticContact CE1-CD1 3.72Å; H712-Y735 AromaticContact CE1-CE1 3.48Å; H712-Y735 VanDerWaalsContact CE1-CE1 3.48Å; H712-Y735 WeakPolarHBondContact CE1-CE1 3.28Å; H712-Y735 AromaticContact ND1-CE1 3.93Å; T732-Y735 HydrophobicContact CG2-CD1 4.47Å; T732-Y735 HydrophobicContact CG2-CE1 3.66Å; T732-Y735 PolarHBondContact O-OH 2.79Å; V733-Y735 WeakPolarHBondContact O-CD2 3.32Å; V733-Y735 VanDerWaalsContact O-CE2 3.24Å; V733-Y735 WeakPolarHBondContact O-CE2 3.39Å; Y735-F737 HydrophobicContact CD1-CE2 4.34Å; Y735-F737 AromaticContact CD1-CZ 3.93Å; Y735-F737 HydrophobicContact CD1-CZ 3.93Å; Y735-F737 AromaticContact CD2-CE2 3.82Å; Y735-F737 HydrophobicContact CD2-CE2 3.82Å; Y735-F737 AromaticContact CD2-CZ 3.98Å; Y735-F737 HydrophobicContact CD2-CZ 3.98Å; Y735-F737 HydrophobicContact CG-CD2 4.4Å; Y735-F737 HydrophobicContact CG-CE1 4.47Å; Y735-F737 AromaticContact CG-CE2 3.54Å; Y735-F737 HydrophobicContact CG-CE2 3.54Å; Y735-F737 AromaticContact CG-CZ 3.57Å; Y735-F737 HydrophobicContact CG-CZ 3.57Å
736	I	98.9	Very high	83.2	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	99.1	157.2	-59.2	-180	0	0	0	107	V381 V566 A709 L792 A794 F796	V381-I736 WeakPolarHBondContact O-CD1 3.45Å; V566-I736 HydrophobicContact CG1-CG2 4.09Å; A709-I736 HydrophobicContact CB-CB 4.3Å; A709-I736 HydrophobicContact CB-CG2 4.44Å; A709-I736 PolarHBondContact N-O 3.41Å; I736-L792 HydrophobicContact CD1-CB 3.78Å; I736-L792 HydrophobicContact CG1-CB 3.95Å; I736-L792 HydrophobicContact CG1-CD2 4.21Å; I736-A794 HydrophobicContact CD1-CB 4.18Å; I736-F796 HydrophobicContact CG2-CE2 4.11Å; I736-F796 HydrophobicContact CG2-CZ 3.93Å
737	F	98.9	Very high	80.4	Confident	0 Å²	0	53 Å²	53	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	142	168.8	-63.3	-74.9	0	0	0	110.1	V566 L567 F571 Y580 I583 T584 L706 R707 Y735	V566-F737 CarbonylContact C-O 3.5Å; V566-F737 WeakPolarHBondContact CA-O 3.49Å; L567-F737 HydrophobicContact CB-CB 4.17Å; L567-F737 HydrophobicContact CD2-CD2 4.47Å; L567-F737 HydrophobicContact CG-CD2 4.4Å; L567-F737 PolarHBondContact N-O 3.49Å; L567-F737 WeakPolarHBondContact O-CB 3.46Å; L567-F737 PolarHBondContact O-N 2.98Å; F571-F737 HydrophobicContact CD2-CE2 4.35Å; F571-F737 HydrophobicContact CE1-CE2 4.39Å; F571-F737 HydrophobicContact CE2-CD2 4.26Å; F571-F737 HydrophobicContact CE2-CE2 4.09Å; F571-F737 HydrophobicContact CZ-CD2 4.14Å; F571-F737 HydrophobicContact CZ-CE2 4.13Å; Y580-F737 HydrophobicContact CD2-CE1 4.06Å; Y580-F737 AromaticContact CD2-CZ 3.74Å; Y580-F737 HydrophobicContact CD2-CZ 3.74Å; Y580-F737 AromaticContact CE2-CE1 3.64Å; Y580-F737 HydrophobicContact CE2-CE1 3.64Å; Y580-F737 AromaticContact CE2-CZ 3.74Å; Y580-F737 HydrophobicContact CE2-CZ 3.74Å; I583-F737 HydrophobicContact CB-CE1 4.38Å; I583-F737 HydrophobicContact CB-CZ 4.3Å; I583-F737 HydrophobicContact CD1-CD2 4.3Å; I583-F737 HydrophobicContact CD1-CE2 3.6Å; I583-F737 HydrophobicContact CD1-CZ 3.87Å; I583-F737 HydrophobicContact CG2-CD1 3.69Å; I583-F737 HydrophobicContact CG2-CD2 3.94Å; I583-F737 HydrophobicContact CG2-CE1 3.77Å; I583-F737 HydrophobicContact CG2-CE2 3.99Å; I583-F737 HydrophobicContact CG2-CG 3.79Å; I583-F737 HydrophobicContact CG2-CZ 3.92Å; T584-F737 HydrophobicContact CG2-CD1 4.3Å; T584-F737 HydrophobicContact CG2-CE1 3.78Å; L706-F737 HydrophobicContact CB-CB 4.39Å; R707-F737 CarbonylContact O-C 3.45Å; R707-F737 VanDerWaalsContact O-CA 3.27Å; R707-F737 WeakPolarHBondContact O-CA 3.49Å; Y735-F737 HydrophobicContact CD1-CE2 4.34Å; Y735-F737 AromaticContact CD1-CZ 3.93Å; Y735-F737 HydrophobicContact CD1-CZ 3.93Å; Y735-F737 AromaticContact CD2-CE2 3.82Å; Y735-F737 HydrophobicContact CD2-CE2 3.82Å; Y735-F737 AromaticContact CD2-CZ 3.98Å; Y735-F737 HydrophobicContact CD2-CZ 3.98Å; Y735-F737 HydrophobicContact CG-CD2 4.4Å; Y735-F737 HydrophobicContact CG-CE1 4.47Å; Y735-F737 AromaticContact CG-CE2 3.54Å; Y735-F737 HydrophobicContact CG-CE2 3.54Å; Y735-F737 AromaticContact CG-CZ 3.57Å; Y735-F737 HydrophobicContact CG-CZ 3.57Å
738	Y	98.6	Very high	78.1	Confident	23 Å²	23	62 Å²	62	9%	0.09	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	158.8	179.3	73.3	-80	0	0	0	112.2	V565 L706 R707 A709 P740 L760 L762 F796	V565-Y738 CarbonylContact O-C 3.51Å; V565-Y738 WeakPolarHBondContact O-CA 3.45Å; L706-Y738 WeakPolarHBondContact CA-O 3.12Å; R707-Y738 HydrophobicContact CB-CE1 4.31Å; R707-Y738 PolarHBondContact N-O 3.27Å; R707-Y738 WeakPolarHBondContact O-CD1 3.37Å; R707-Y738 PolarHBondContact O-N 2.9Å; A709-Y738 HydrophobicContact CB-CD1 4.31Å; A709-Y738 HydrophobicContact CB-CE1 4.32Å; Y738-P740 HydrophobicContact CD2-CB 4.35Å; Y738-P740 HydrophobicContact CE2-CB 3.71Å; Y738-P740 VanDerWaalsContact O-CD 3.25Å; Y738-P740 WeakPolarHBondContact O-CD 3.44Å; Y738-L760 HydrophobicContact CD2-CB 4.19Å; Y738-L762 HydrophobicContact CE1-CB 4.44Å; Y738-L762 HydrophobicContact CE1-CD2 4.27Å; Y738-L762 HydrophobicContact CE2-CB 4.22Å; Y738-F796 AromaticContact CD1-CE1 3.65Å; Y738-F796 HydrophobicContact CD1-CE1 3.65Å; Y738-F796 HydrophobicContact CD1-CZ 4.07Å; Y738-F796 HydrophobicContact CD2-CD1 4.09Å; Y738-F796 AromaticContact CD2-CE1 3.66Å; Y738-F796 HydrophobicContact CD2-CE1 3.66Å; Y738-F796 HydrophobicContact CE1-CE1 4.13Å; Y738-F796 HydrophobicContact CE2-CE1 4.13Å; Y738-F796 HydrophobicContact CG-CD1 4.23Å; Y738-F796 AromaticContact CG-CE1 3.39Å; Y738-F796 HydrophobicContact CG-CE1 3.39Å; Y738-F796 AromaticContact CG-CZ 3.97Å; Y738-F796 HydrophobicContact CG-CZ 3.97Å
739	S	96.8	Very high	76	Confident	14 Å²	14	61.1 Å²	61.1	10%	0.098	34%	0.344	C	S	.	.			trans	-84.6	107.6	172.6	64.3	0	0	0	0	111.3	V565 N705 G759 L760	V565-S739 PolarHBondContact N-OG 3.21Å; V565-S739 PolarHBondContact O-N 3.01Å; V565-S739 PolarHBondContact O-OG 3.27Å; N705-S739 VanDerWaalsContact O-CA 3.31Å; N705-S739 WeakPolarHBondContact O-CA 3.48Å; S739-G759 CarbonylContact O-C 3.52Å; S739-G759 WeakPolarHBondContact O-CA 3.28Å; S739-L760 PolarHBondContact O-N 3.28Å
740	P	94.3	Very high	73.8	Confident	15 Å²	15	68.7 Å²	68.7	10%	0.097	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	-77.9	146.3	-172.7	32.5	-38.3	0	0	0	113.4	N705 R707 Y738 R742 L760	N705-P740 WeakPolarHBondContact ND2-CD 3.43Å; N705-P740 WeakPolarHBondContact ND2-CG 3.48Å; N705-P740 WeakPolarHBondContact O-CD 3.28Å; R707-P740 HydrophobicContact CG-CG 4.08Å; Y738-P740 HydrophobicContact CD2-CB 4.35Å; Y738-P740 HydrophobicContact CE2-CB 3.71Å; Y738-P740 VanDerWaalsContact O-CD 3.25Å; Y738-P740 WeakPolarHBondContact O-CD 3.44Å; P740-R742 PolarHBondContact O-N 3.17Å; P740-L760 CarbonylContact C-O 3.56Å; P740-L760 WeakPolarHBondContact CA-O 3.25Å
741	R	87.7	Confident	71.1	Confident	97 Å²	97	70.9 Å²	70.9	37%	0.366	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-53.9	120	173.6	-168.3	172.4	177.4	126.5	-0.3	110.1	G743 S757 Q758 G759 L760 D799	R741-G743 PolarHBondContact O-N 3.44Å; R741-S757 PolarHBondContact NE-OG 3.44Å; R741-S757 PolarHBondContact NH1-OG 2.99Å; R741-S757 PolarHBondContact NH2-OG 2.94Å; R741-Q758 CarbonylContact C-O 2.86Å; R741-Q758 WeakPolarHBondContact CA-O 3.46Å; R741-G759 WeakPolarHBondContact CB-O 3.1Å; R741-L760 PolarHBondContact N-O 2.93Å; R741-D799 IonicContact CZ-OD1 2.73Å; R741-D799 IonicContact NH1-OD1 2.71Å; R741-D799 PolarHBondContact NH1-OD1 3.08Å; R741-D799 IonicContact NH1-OD2 3.58Å; R741-D799 IonicContact NH2-OD1 3.64Å; R741-D799 PolarHBondContact NH2-OD1 3.24Å; R741-D799 VanDerWaalsContact NH2-OD1 3.15Å; R741-D799 IonicContact NH2-OD2 3.23Å
742	R	76.3	Confident	68.1	Low	167 Å²	167	75.1 Å²	75.1	63%	0.63	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-69.1	120.3	-179.6	-63.2	-175.3	-173.1	-153	2.8	110.5	P740 Q758	P740-R742 PolarHBondContact O-N 3.17Å; R742-Q758 PolarHBondContact N-O 2.99Å
743	G	55.2	Low	65.2	Low	64 Å²	64	77.7 Å²	77.7	66%	0.66	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-63.8	147.5	170.4	0	0	0	0	0	112	R741 S745	R741-G743 PolarHBondContact O-N 3.44Å; G743-S745 VanDerWaalsContact C-N 3.29Å; G743-S745 PolarHBondContact O-N 3.35Å
744	I	45.6	Very low	62.5	Low	171 Å²	171	83.3 Å²	83.3	88%	0.877	49%	0.493	S	S	*	.			trans	-80.4	76.8	-179.9	-51.8	176.3	0	0	0	109.3	G746	I744-G746 PolarHBondContact O-N 3.15Å
745	S	35.6	Very low	60.1	Low	109 Å²	109	92.5 Å²	92.5	76%	0.762	53%	0.527	S	S	*	.			trans	-60.6	125.6	167.5	-57	0	0	0	0	109.3	G743 A747	G743-S745 VanDerWaalsContact C-N 3.29Å; G743-S745 PolarHBondContact O-N 3.35Å; S745-A747 PolarHBondContact O-N 3.19Å
746	G	34.3	Very low	58	Low	72 Å²	72	95.8 Å²	95.8	74%	0.742	54%	0.543	S	S	*	.			trans	-69.3	45.7	-161	0	0	0	0	0	118.3	I744 Y748	I744-G746 PolarHBondContact O-N 3.15Å; G746-Y748 PolarHBondContact O-N 3.48Å
747	A	31	Very low	56.2	Low	76 Å²	76	97.2 Å²	97.2	63%	0.628	55%	0.553	S	S	*	*			trans	-75.9	110	167.9	0	0	0	0	0	110.2	S745 Q749	S745-A747 PolarHBondContact O-N 3.19Å; A747-Q749 PolarHBondContact O-N 2.95Å
748	Y	38.8	Very low	55.3	Low	238 Å²	238	100.6 Å²	100.6	93%	0.933	57%	0.568	S	S	*	*			trans	-58.3	94.7	175.2	-83.5	-99.3	0	0	0	111.8	G746	G746-Y748 PolarHBondContact O-N 3.48Å
749	Q	40.6	Very low	54.8	Low	129 Å²	129	99.7 Å²	99.7	60%	0.603	57%	0.566	S	S	*	*			trans	-98.7	105.2	173.4	-70.1	-167.2	-32.5	0	0	110.7	A747 G751 R755	A747-Q749 PolarHBondContact O-N 2.95Å; Q749-G751 PolarHBondContact O-N 3.21Å; Q749-R755 VanDerWaalsContact OE1-CZ 3.26Å
750	K	37	Very low	54.7	Low	224 Å²	224	99.1 Å²	99.1	97%	0.974	56%	0.562	S	S	*	*			trans	-67.8	94.5	168.7	-74.7	-179.3	174.9	178.1	0	109.7
751	G	35	Very low	54.8	Low	62 Å²	62	102 Å²	102	64%	0.639	57%	0.573	S	S	*	*			trans	-167.5	113	172.7	0	0	0	0	0	110.6	Q749 G753	Q749-G751 PolarHBondContact O-N 3.21Å; G751-G753 PolarHBondContact O-N 3.16Å
752	G	31.7	Very low	55.2	Low	99 Å²	99	98.6 Å²	98.6	100%	1.021	56%	0.562	S	S	*	*			trans	-77.2	35.6	-169.3	0	0	0	0	0	116.2
753	G	36.5	Very low	56.2	Low	60 Å²	60	91.1 Å²	91.1	62%	0.619	53%	0.534	S	S	*	.			trans	-95.6	134.2	174.9	0	0	0	0	0	111.5	G751 R755	G751-G753 PolarHBondContact O-N 3.16Å; G753-R755 PolarHBondContact O-N 2.96Å
754	Q	42.1	Very low	58.2	Low	126 Å²	126	88 Å²	88	59%	0.589	50%	0.503	S	S	*	.			trans	-62.6	103.7	167.8	-78.2	-177.2	-24.5	0	0	109.6	S371 Q756	S371-Q754 VanDerWaalsContact CB-NE2 3.29Å; S371-Q754 PolarHBondContact OG-NE2 2.85Å; Q754-Q756 PolarHBondContact O-N 2.9Å
755	R	47.9	Very low	60.7	Low	194 Å²	194	80.9 Å²	80.9	73%	0.732	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-69	116.6	166.9	-93.4	-173.1	173.6	136.2	5.9	109.4	Q749 G753	Q749-R755 VanDerWaalsContact OE1-CZ 3.26Å; G753-R755 PolarHBondContact O-N 2.96Å
756	Q	54.5	Low	63.6	Low	72 Å²	72	75.8 Å²	75.8	34%	0.336	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-50.6	144.6	154.2	-69.7	165.8	-24.6	0	0	108.9	Q754 N801	Q754-Q756 PolarHBondContact O-N 2.9Å; Q756-N801 PolarHBondContact NE2-OD1 2.8Å; Q756-N801 VanDerWaalsContact NE2-OD1 3.08Å
757	S	61.2	Low	66.5	Low	30 Å²	30	73 Å²	73	21%	0.21	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-69.1	137.7	165.8	75.3	0	0	0	0	109.6	R741 D799	R741-S757 PolarHBondContact NE-OG 3.44Å; R741-S757 PolarHBondContact NH1-OG 2.99Å; R741-S757 PolarHBondContact NH2-OG 2.94Å; S757-D799 WeakPolarHBondContact CB-OD2 3.45Å; S757-D799 PolarHBondContact N-OD2 3.34Å; S757-D799 PolarHBondContact OG-OD1 3.47Å; S757-D799 PolarHBondContact OG-OD2 2.92Å
758	Q	80.3	Confident	69.6	Low	71 Å²	71	69.4 Å²	69.4	33%	0.332	37%	0.368	S	S	.	.			trans	-111.3	116.7	-174.4	-72	-170	-20.5	0	0	109.2	H562 R741 R742	H562-Q758 VanDerWaalsContact CD2-CG 3.47Å; H562-Q758 WeakPolarHBondContact CD2-CG 3.38Å; H562-Q758 WeakPolarHBondContact NE2-CB 3.34Å; R741-Q758 CarbonylContact C-O 2.86Å; R741-Q758 WeakPolarHBondContact CA-O 3.46Å; R742-Q758 PolarHBondContact N-O 2.99Å
759	G	89.4	Confident	72.2	Confident	4 Å²	4	58.5 Å²	58.5	4%	0.041	33%	0.326	C	S	.	.	S	Bend	trans	99.6	160.2	-173.2	0	0	0	0	0	113.4	H562 N564 S739 R741	H562-G759 PolarHBondContact CE1-N 3.23Å; N564-G759 WeakPolarHBondContact OD1-CA 3.36Å; N564-G759 PolarHBondContact OD1-N 3.25Å; S739-G759 CarbonylContact O-C 3.52Å; S739-G759 WeakPolarHBondContact O-CA 3.28Å; R741-G759 WeakPolarHBondContact CB-O 3.1Å
760	L	94.8	Very high	74.8	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-84	141.6	-176.3	-53	176	0	0	0	111.4	F379 L521 N564 V566 Y738 S739 P740 R741 F796 L798	F379-L760 HydrophobicContact CE1-CD2 4.07Å; F379-L760 HydrophobicContact CZ-CD1 3.99Å; F379-L760 HydrophobicContact CZ-CD2 4.08Å; L521-L760 HydrophobicContact CD1-CD1 4.15Å; N564-L760 HydrophobicContact CB-CD2 3.85Å; N564-L760 HydrophobicContact CB-CG 4.08Å; V566-L760 HydrophobicContact CG2-CD1 3.61Å; Y738-L760 HydrophobicContact CD2-CB 4.19Å; S739-L760 PolarHBondContact O-N 3.28Å; P740-L760 CarbonylContact C-O 3.56Å; P740-L760 WeakPolarHBondContact CA-O 3.25Å; R741-L760 PolarHBondContact N-O 2.93Å; L760-F796 HydrophobicContact CB-CB 4.35Å; L760-F796 HydrophobicContact CB-CD1 4.15Å; L760-F796 HydrophobicContact CD1-CB 4.38Å; L760-F796 HydrophobicContact CD1-CD1 4.32Å; L760-F796 HydrophobicContact CD1-CG 4.25Å; L760-L798 HydrophobicContact CD2-CB 3.93Å; L760-L798 HydrophobicContact CD2-CD2 3.8Å; L760-L798 HydrophobicContact CD2-CG 4.42Å
761	K	95.4	Very high	77.5	Confident	76 Å²	76	45.5 Å²	45.5	33%	0.33	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	121.3	164.9	-179.6	-169.3	175.4	-159.9	0	108.1	L763 F796 Q797	K761-L763 HydrophobicContact CD-CD2 3.67Å; K761-L763 HydrophobicContact CG-CD2 4.14Å; K761-F796 CarbonylContact O-C 3.45Å; K761-F796 VanDerWaalsContact O-CA 3.27Å; K761-F796 WeakPolarHBondContact O-CA 3.44Å; K761-Q797 HydrophobicContact CB-CB 4.32Å; K761-Q797 PolarHBondContact N-O 2.87Å; K761-Q797 PolarHBondContact O-N 3.12Å
762	L	96.4	Very high	80.2	Confident	26 Å²	26	48.4 Å²	48.4	14%	0.136	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	129.2	165.1	179.6	66.1	0	0	0	108.2	L356 A709 Y738 A794 F796	L356-L762 HydrophobicContact CD1-CD2 3.59Å; L356-L762 HydrophobicContact CD1-CG 3.98Å; A709-L762 HydrophobicContact CB-CD1 4.2Å; A709-L762 HydrophobicContact CB-CD2 4.27Å; Y738-L762 HydrophobicContact CE1-CB 4.44Å; Y738-L762 HydrophobicContact CE1-CD2 4.27Å; Y738-L762 HydrophobicContact CE2-CB 4.22Å; L762-A794 HydrophobicContact CD1-CB 4.03Å; L762-F796 HydrophobicContact CB-CD1 4.31Å; L762-F796 HydrophobicContact CB-CE1 4.23Å; L762-F796 HydrophobicContact CD1-CD1 4.08Å; L762-F796 HydrophobicContact CD1-CE1 3.63Å; L762-F796 HydrophobicContact CD1-CZ 4.11Å
763	L	96.7	Very high	83.1	Confident	9 Å²	9	45.6 Å²	45.6	5%	0.047	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	-45.2	178.3	-66.7	-175.6	0	0	0	111.8	L356 S357 D378 K761 K795 Q797	L356-L763 CarbonylContact C-O 3.59Å; L356-L763 WeakPolarHBondContact CA-O 3.41Å; L356-L763 WeakPolarHBondContact CB-O 3.22Å; L356-L763 PolarHBondContact N-O 3.07Å; S357-L763 PolarHBondContact N-O 3.39Å; D378-L763 WeakPolarHBondContact OD2-CD1 3.31Å; K761-L763 HydrophobicContact CD-CD2 3.67Å; K761-L763 HydrophobicContact CG-CD2 4.14Å; L763-K795 HydrophobicContact CB-CB 4.43Å; L763-K795 HydrophobicContact CB-CD 4.32Å; L763-K795 HydrophobicContact CB-CG 4.32Å; L763-K795 HydrophobicContact CD1-CD 4.06Å; L763-K795 HydrophobicContact CD1-CG 4.23Å; L763-K795 PolarHBondContact N-O 3.33Å; L763-Q797 HydrophobicContact CD1-CB 3.85Å; L763-Q797 HydrophobicContact CD2-CB 4.11Å; L763-Q797 HydrophobicContact CG-CB 3.91Å
764	G	97.2	Very high	85.8	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.6	174.7	-177.9	0	0	0	0	0	111.8	E354 K795	E354-G764 CarbonylContact O-C 3.56Å; E354-G764 WeakPolarHBondContact O-CA 3.43Å; G764-K795 PolarHBondContact O-N 3.19Å
765	R	97.6	Very high	88.3	Confident	21 Å²	21	41.1 Å²	41.1	8%	0.079	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	157.5	-178.6	65.1	-172	-178.5	-179.6	15.5	111.3	E354 L356 A709 Y710 G711 L793 A794	E354-R765 HydrophobicContact CB-CG 4.18Å; E354-R765 PolarHBondContact N-O 3.1Å; E354-R765 PolarHBondContact O-N 3.35Å; E354-R765 IonicContact OE1-NH2 3.1Å; E354-R765 IonicContact OE2-CZ 3.91Å; E354-R765 IonicContact OE2-NE 3.12Å; E354-R765 PolarHBondContact OE2-NE 2.69Å; E354-R765 IonicContact OE2-NH2 2.76Å; E354-R765 PolarHBondContact OE2-NH2 2.69Å; L356-R765 HydrophobicContact CD1-CG 4.08Å; A709-R765 VanDerWaalsContact O-CD 3.31Å; A709-R765 WeakPolarHBondContact O-CD 3.4Å; A709-R765 PolarHBondContact O-NH1 3.22Å; Y710-R765 HydrophobicContact CE1-CG 4.37Å; G711-R765 VanDerWaalsContact N-NH1 3.12Å; R765-L793 CarbonylContact C-O 3.55Å; R765-L793 VanDerWaalsContact CA-O 3.24Å; R765-L793 WeakPolarHBondContact CA-O 3.3Å; R765-L793 WeakPolarHBondContact CB-O 3.42Å; R765-A794 HydrophobicContact CB-CB 4.44Å
766	L	97.3	Very high	90.4	Very high	1 Å²	1	36 Å²	36	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	122.8	168.1	-176.8	59.8	0	0	0	109.2	R351 W353 W423 Y710 L793	R351-L766 HydrophobicContact CB-CD1 3.76Å; R351-L766 HydrophobicContact CB-CG 4.08Å; W353-L766 HydrophobicContact CE3-CB 4.28Å; W353-L766 HydrophobicContact CZ3-CB 4.35Å; W423-L766 HydrophobicContact CD2-CD2 4.27Å; W423-L766 HydrophobicContact CH2-CD1 3.41Å; W423-L766 VanDerWaalsContact CH2-CD1 3.41Å; W423-L766 HydrophobicContact CH2-CD2 4.11Å; W423-L766 HydrophobicContact CH2-CG 4.38Å; W423-L766 HydrophobicContact CZ2-CD1 3.53Å; W423-L766 HydrophobicContact CZ2-CD2 3.45Å; W423-L766 VanDerWaalsContact CZ2-CD2 3.45Å; W423-L766 HydrophobicContact CZ2-CG 4.14Å; W423-L766 HydrophobicContact CZ3-CD1 4.18Å; Y710-L766 VanDerWaalsContact CE1-O 3.23Å; Y710-L766 WeakPolarHBondContact CE1-O 3.27Å; Y710-L766 PolarHBondContact OH-O 3.18Å; L766-L793 HydrophobicContact CB-CB 3.88Å; L766-L793 HydrophobicContact CB-CD2 4.27Å; L766-L793 HydrophobicContact CB-CG 4.48Å; L766-L793 HydrophobicContact CD2-CB 4.36Å; L766-L793 HydrophobicContact CD2-CD2 4.31Å; L766-L793 PolarHBondContact N-O 2.91Å
767	S	95.5	Very high	92.1	Very high	13 Å²	13	34.3 Å²	34.3	9%	0.091	17%	0.173	C	C	.	.			trans	-55	147.8	180	77.8	0	0	0	0	111.6	R351 V352 E354	R351-S767 PolarHBondContact NE-O 3.1Å; R351-S767 PolarHBondContact NH2-O 3.19Å; V352-S767 PolarHBondContact N-OG 2.75Å; V352-S767 WeakPolarHBondContact O-CB 3.47Å; V352-S767 PolarHBondContact O-N 3.26Å; E354-S767 WeakPolarHBondContact OE1-CB 3.27Å
768	L	95.9	Very high	93.5	Very high	2 Å²	2	37 Å²	37	1%	0.01	19%	0.185	C	C	.	.			trans	-83.4	-179.6	163.6	-70.3	168.2	0	0	0	109.7	Y710 E721 T723 L790 L792	Y710-L768 HydrophobicContact CD1-CD1 3.53Å; Y710-L768 HydrophobicContact CD1-CG 3.83Å; Y710-L768 HydrophobicContact CE1-CD1 3.92Å; Y710-L768 HydrophobicContact CE1-CG 3.7Å; Y710-L768 HydrophobicContact CG-CD1 4.04Å; E721-L768 HydrophobicContact CB-CB 3.86Å; E721-L768 HydrophobicContact CB-CD1 3.82Å; E721-L768 HydrophobicContact CG-CB 4.02Å; E721-L768 HydrophobicContact CG-CD1 4.4Å; T723-L768 HydrophobicContact CG2-CD1 3.68Å; T723-L768 HydrophobicContact CG2-CD2 4.1Å; L768-L790 HydrophobicContact CD2-CB 4.19Å; L768-L790 HydrophobicContact CD2-CD1 4.28Å; L768-L792 HydrophobicContact CD2-CD1 4.09Å; L768-L792 HydrophobicContact CD2-CG 4.46Å
769	L	94.3	Very high	94.2	Very high	8 Å²	8	33.6 Å²	33.6	4%	0.042	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-118.2	150.3	171	-63.9	175.7	0	0	0	109.1	V349 R351 V722 L774 M777 F785 L790	V349-L769 HydrophobicContact CG1-CD1 3.73Å; V349-L769 HydrophobicContact CG1-CD2 3.65Å; V349-L769 HydrophobicContact CG1-CG 4.34Å; R351-L769 HydrophobicContact CG-CD1 4.03Å; R351-L769 HydrophobicContact CG-CD2 4.32Å; R351-L769 HydrophobicContact CG-CG 3.96Å; V722-L769 VanDerWaalsContact CG2-O 3.29Å; V722-L769 WeakPolarHBondContact CG2-O 3.48Å; V722-L769 PolarHBondContact N-O 3.26Å; L769-L774 HydrophobicContact CB-CD2 4.02Å; L769-L774 HydrophobicContact CB-CG 4.14Å; L769-L774 HydrophobicContact CD1-CD2 3.66Å; L769-L774 HydrophobicContact CG-CD2 4.47Å; L769-M777 HydrophobicContact CD1-CE 3.74Å; L769-F785 HydrophobicContact CD1-CE2 4.49Å; L769-F785 HydrophobicContact CD1-CZ 4.36Å; L769-L790 HydrophobicContact CB-CD1 4.22Å
770	P	94	Very high	94.5	Very high	3 Å²	3	33.4 Å²	33.4	2%	0.019	17%	0.167	C	C	.	.			trans	-81.2	164.4	167.9	34.6	-35.4	0	0	0	111.3	I714 R719 A720 E772 D773 L774	I714-P770 HydrophobicContact CD1-CG 4.49Å; I714-P770 HydrophobicContact CG1-CB 4.15Å; I714-P770 HydrophobicContact CG1-CG 4.21Å; R719-P770 HydrophobicContact CB-CB 4.42Å; A720-P770 WeakPolarHBondContact O-CA 3.25Å; A720-P770 WeakPolarHBondContact O-CB 3.3Å; P770-E772 PolarHBondContact O-N 2.96Å; P770-D773 HydrophobicContact CG-CB 3.97Å; P770-D773 VanDerWaalsContact CG-CG 3.45Å; P770-D773 WeakPolarHBondContact CG-OD1 3.18Å; P770-D773 PolarHBondContact O-N 3.27Å; P770-L774 PolarHBondContact O-N 3.42Å
771	E	94.1	Very high	94.6	Very high	77 Å²	77	33.4 Å²	33.4	36%	0.36	17%	0.167	S	C	.	.	H	α-helix	trans	-60.6	-47.3	-171.9	180	176.4	174.2	0	0	114.2	V722 L725 D773 L774 W775	V722-E771 HydrophobicContact CG1-CB 4.38Å; L725-E771 HydrophobicContact CD1-CG 4.04Å; L725-E771 HydrophobicContact CD2-CG 4.41Å; E771-D773 VanDerWaalsContact C-N 3.25Å; E771-D773 PolarHBondContact O-N 3.11Å; E771-L774 PolarHBondContact O-N 3.13Å; E771-L774 VanDerWaalsContact O-N 3.07Å; E771-W775 PolarHBondContact O-N 3.3Å; E771-W775 PolarHBondContact OE1-NE1 3.18Å
772	E	92.1	Very high	94.6	Very high	123 Å²	123	30.2 Å²	30.2	58%	0.575	15%	0.154	S	C	*	.	H	α-helix	trans	-69.9	-22.8	-175.9	84.5	-107.1	-146.3	0	0	113.5	R719 P770 S776	R719-E772 VanDerWaalsContact CZ-CD 3.45Å; R719-E772 IonicContact CZ-OE1 2.71Å; R719-E772 IonicContact CZ-OE2 3.65Å; R719-E772 IonicContact NE-OE1 3.27Å; R719-E772 PolarHBondContact NE-OE1 3.13Å; R719-E772 IonicContact NE-OE2 3.16Å; R719-E772 PolarHBondContact NE-OE2 2.96Å; R719-E772 VanDerWaalsContact NE-OE2 3.16Å; R719-E772 VanDerWaalsContact NH2-CG 3.29Å; R719-E772 IonicContact NH2-OE1 3.67Å; R719-E772 PolarHBondContact NH2-OE1 2.67Å; R719-E772 IonicContact NH2-OE2 3.02Å; R719-E772 PolarHBondContact NH2-OE2 3.45Å; P770-E772 PolarHBondContact O-N 2.96Å; E772-S776 PolarHBondContact O-N 3.45Å
773	D	92.3	Very high	94.5	Very high	40 Å²	40	35.5 Å²	35.5	21%	0.214	18%	0.178	C	C	.	.	H	α-helix	trans	-67.9	-38.9	171.4	-69.4	28.6	0	0	0	110.3	V349 R719 P770 E771 S776	V349-D773 HydrophobicContact CG1-CB 4.1Å; V349-D773 HydrophobicContact CG2-CB 4.44Å; R719-D773 IonicContact CZ-OD1 3.64Å; R719-D773 IonicContact NH1-OD1 3.31Å; R719-D773 PolarHBondContact NH1-OD1 2.91Å; R719-D773 VanDerWaalsContact NH1-OD1 3.1Å; R719-D773 IonicContact NH2-OD1 2.73Å; R719-D773 PolarHBondContact NH2-OD1 3.25Å; P770-D773 HydrophobicContact CG-CB 3.97Å; P770-D773 VanDerWaalsContact CG-CG 3.45Å; P770-D773 WeakPolarHBondContact CG-OD1 3.18Å; P770-D773 PolarHBondContact O-N 3.27Å; E771-D773 VanDerWaalsContact C-N 3.25Å; E771-D773 PolarHBondContact O-N 3.11Å; D773-S776 WeakPolarHBondContact O-CB 3.4Å; D773-S776 PolarHBondContact O-N 3.01Å; D773-S776 PolarHBondContact O-OG 2.98Å
774	L	93.4	Very high	94.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-70.9	-40.3	175.4	-66.6	179.7	0	0	0	112.5	V722 L725 L769 P770 E771 S776 M777 G779 L780 L790	V722-L774 HydrophobicContact CG2-CD1 3.57Å; L725-L774 HydrophobicContact CB-CD1 3.92Å; L725-L774 HydrophobicContact CD2-CB 3.44Å; L725-L774 VanDerWaalsContact CD2-CB 3.44Å; L725-L774 HydrophobicContact CD2-CD1 3.97Å; L725-L774 HydrophobicContact CD2-CG 4.37Å; L769-L774 HydrophobicContact CB-CD2 4.02Å; L769-L774 HydrophobicContact CB-CG 4.14Å; L769-L774 HydrophobicContact CD1-CD2 3.66Å; L769-L774 HydrophobicContact CG-CD2 4.47Å; P770-L774 PolarHBondContact O-N 3.42Å; E771-L774 PolarHBondContact O-N 3.13Å; E771-L774 VanDerWaalsContact O-N 3.07Å; L774-S776 PolarHBondContact O-N 3.32Å; L774-M777 HydrophobicContact CD2-CE 3.69Å; L774-M777 CarbonylContact O-C 3.48Å; L774-M777 WeakPolarHBondContact O-CA 3.29Å; L774-M777 PolarHBondContact O-N 3.18Å; L774-G779 PolarHBondContact O-N 2.63Å; L774-L780 HydrophobicContact CD1-CD1 3.83Å; L774-L780 HydrophobicContact CD1-CG 4.3Å; L774-L780 HydrophobicContact CD2-CD1 4.31Å; L774-L780 HydrophobicContact CD2-CD2 4.18Å; L774-L780 HydrophobicContact CD2-CG 4.35Å; L774-L790 HydrophobicContact CD1-CD1 4.37Å; L774-L790 HydrophobicContact CD2-CD1 4.34Å; L774-L790 HydrophobicContact CD2-CD2 4.38Å
775	W	93.6	Very high	94.1	Very high	93 Å²	93	40.5 Å²	40.5	35%	0.352	20%	0.202	S	C	.	.	H	α-helix	trans	-63.1	-30.5	173.4	-78.6	124.4	0	0	0	112.7	H401 L725 E771 M777 N778	H401-W775 HydrophobicContact CB-CZ3 4.31Å; H401-W775 AromaticContact CD2-CZ3 3.82Å; H401-W775 AromaticContact CG-CZ3 3.96Å; L725-W775 HydrophobicContact CD1-CZ2 3.76Å; L725-W775 HydrophobicContact CD2-CD2 4.05Å; L725-W775 HydrophobicContact CD2-CG 4.24Å; L725-W775 HydrophobicContact CD2-CZ2 4.23Å; L725-W775 HydrophobicContact CG-CZ2 4.11Å; E771-W775 PolarHBondContact O-N 3.3Å; E771-W775 PolarHBondContact OE1-NE1 3.18Å; W775-M777 PolarHBondContact O-N 2.92Å; W775-N778 PolarHBondContact O-N 2.8Å
776	S	91.7	Very high	94.1	Very high	86 Å²	86	39.6 Å²	39.6	60%	0.601	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-21.1	171.6	85.8	0	0	0	0	113.7	E772 D773 L774	E772-S776 PolarHBondContact O-N 3.45Å; D773-S776 WeakPolarHBondContact O-CB 3.4Å; D773-S776 PolarHBondContact O-N 3.01Å; D773-S776 PolarHBondContact O-OG 2.98Å; L774-S776 PolarHBondContact O-N 3.32Å
777	M	90.1	Very high	94.2	Very high	36 Å²	36	39.5 Å²	39.5	18%	0.177	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	20.5	174.9	-58.2	-178.2	-69.5	0	0	112.7	V349 L769 L774 W775 N782 M784 F785	V349-M777 HydrophobicContact CB-CE 4.49Å; V349-M777 HydrophobicContact CB-SD 4.2Å; V349-M777 HydrophobicContact CG1-CE 3.9Å; V349-M777 HydrophobicContact CG1-SD 4.21Å; L769-M777 HydrophobicContact CD1-CE 3.74Å; L774-M777 HydrophobicContact CD2-CE 3.69Å; L774-M777 CarbonylContact O-C 3.48Å; L774-M777 WeakPolarHBondContact O-CA 3.29Å; L774-M777 PolarHBondContact O-N 3.18Å; W775-M777 PolarHBondContact O-N 2.92Å; M777-N782 PolarHBondContact O-ND2 3.16Å; M777-M784 HydrophobicContact CG-CE 4.3Å; M777-M784 HydrophobicContact SD-CE 3.37Å; M777-M784 WeakPolarHBondContact SD-CE 3.43Å; M777-F785 HydrophobicContact CE-CD2 4.5Å; M777-F785 HydrophobicContact CE-CE2 3.84Å; M777-F785 HydrophobicContact SD-CE2 4.19Å
778	N	91.3	Very high	94.3	Very high	87 Å²	87	39.2 Å²	39.2	47%	0.465	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	39.9	-177.6	-165.2	89.9	0	0	0	113.5	H401 W775	H401-N778 PolarHBondContact CD2-O 2.98Å; H401-N778 PolarHBondContact O-ND2 3.35Å; W775-N778 PolarHBondContact O-N 2.8Å
779	G	94.1	Very high	94.4	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.197	C	C	.	.	S	Bend	trans	71.3	-160.9	174.4	0	0	0	0	0	113.3	L774 N782	L774-G779 PolarHBondContact O-N 2.63Å; G779-N782 PolarHBondContact O-ND2 3.27Å
780	L	96.9	Very high	94.6	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.195	C	C	.	.	S	Bend	trans	-129.2	153.6	173.2	-55.4	173.7	0	0	0	110.5	H401 L725 L774 F785 D788 L790	H401-L780 PolarHBondContact NE2-O 3.43Å; L725-L780 HydrophobicContact CB-CD1 4.21Å; L725-L780 HydrophobicContact CB-CG 4.41Å; L725-L780 WeakPolarHBondContact O-CB 3.05Å; L774-L780 HydrophobicContact CD1-CD1 3.83Å; L774-L780 HydrophobicContact CD1-CG 4.3Å; L774-L780 HydrophobicContact CD2-CD1 4.31Å; L774-L780 HydrophobicContact CD2-CD2 4.18Å; L774-L780 HydrophobicContact CD2-CG 4.35Å; L780-F785 HydrophobicContact CD2-CB 3.42Å; L780-F785 VanDerWaalsContact CD2-CB 3.42Å; L780-F785 HydrophobicContact CD2-CD2 3.82Å; L780-F785 HydrophobicContact CD2-CG 3.84Å; L780-D788 WeakPolarHBondContact CD1-O 3.41Å; L780-L790 HydrophobicContact CD1-CD2 3.91Å; L780-L790 HydrophobicContact CD1-CG 4.13Å; L780-L790 HydrophobicContact CD2-CD2 4.36Å
781	P	97.4	Very high	94.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.194	C	C	.	.	S	Bend	cis	-63	156.1	-15.8	-15.5	29.2	0	0	0	112.2	L387 C402 L407 F785 D788	L387-P781 HydrophobicContact CD2-CG 3.72Å; C402-P781 PolarHBondContact SG-O 3.06Å; L407-P781 HydrophobicContact CD2-CB 4.41Å; L407-P781 HydrophobicContact CD2-CG 3.99Å; P781-F785 WeakPolarHBondContact CA-O 3.32Å; P781-D788 HydrophobicContact CG-CB 4.43Å
782	N	95.1	Very high	95	Very high	10 Å²	10	35.5 Å²	35.5	5%	0.053	18%	0.177	C	C	.	.			trans	-143.7	-173.9	177.3	70.5	39.8	0	0	0	112.4	M777 G779 M784 F785	M777-N782 PolarHBondContact O-ND2 3.16Å; G779-N782 PolarHBondContact O-ND2 3.27Å; N782-M784 PolarHBondContact O-N 2.94Å; N782-M784 VanDerWaalsContact O-N 3.15Å; N782-M784 PolarHBondContact OD1-N 3.33Å; N782-F785 PolarHBondContact N-O 3.1Å; N782-F785 PolarHBondContact O-N 3.44Å; N782-F785 PolarHBondContact OD1-N 3.45Å
783	E	93.7	Very high	95.4	Very high	136 Å²	136	29.7 Å²	29.7	64%	0.636	15%	0.15	S	C	*	.	S	Bend	trans	-60.1	-24	-177.1	-63.4	-174	175.9	0	0	114.1	V406 Y411 N415	V406-E783 HydrophobicContact CG1-CG 3.91Å; Y411-E783 WeakPolarHBondContact OH-CA 3.38Å; Y411-E783 WeakPolarHBondContact OH-CB 3.23Å; Y411-E783 PolarHBondContact OH-O 3.3Å; N415-E783 PolarHBondContact ND2-O 3.48Å; N415-E783 VanDerWaalsContact ND2-O 3.1Å
784	M	90.7	Very high	95.7	Very high	91 Å²	91	27.8 Å²	27.8	45%	0.448	14%	0.14	S	C	.	.	S	Bend	trans	-103.6	-32.3	179.6	-61.3	-168.9	-64.9	0	0	113.3	W350 M777 N782	W350-M784 HydrophobicContact CZ3-SD 4.24Å; M777-M784 HydrophobicContact CG-CE 4.3Å; M777-M784 HydrophobicContact SD-CE 3.37Å; M777-M784 WeakPolarHBondContact SD-CE 3.43Å; N782-M784 PolarHBondContact O-N 2.94Å; N782-M784 VanDerWaalsContact O-N 3.15Å; N782-M784 PolarHBondContact OD1-N 3.33Å
785	F	95.8	Very high	95.9	Very high	24 Å²	24	30.4 Å²	30.4	11%	0.105	15%	0.152	C	C	.	.			trans	-115.1	107.9	-174.9	-65.3	-69.7	0	0	0	110.7	R351 L769 M777 L780 P781 N782 S787 L790	R351-F785 HydrophobicContact CG-CZ 4.34Å; L769-F785 HydrophobicContact CD1-CE2 4.49Å; L769-F785 HydrophobicContact CD1-CZ 4.36Å; M777-F785 HydrophobicContact CE-CD2 4.5Å; M777-F785 HydrophobicContact CE-CE2 3.84Å; M777-F785 HydrophobicContact SD-CE2 4.19Å; L780-F785 HydrophobicContact CD2-CB 3.42Å; L780-F785 VanDerWaalsContact CD2-CB 3.42Å; L780-F785 HydrophobicContact CD2-CD2 3.82Å; L780-F785 HydrophobicContact CD2-CG 3.84Å; P781-F785 WeakPolarHBondContact CA-O 3.32Å; N782-F785 PolarHBondContact N-O 3.1Å; N782-F785 PolarHBondContact O-N 3.44Å; N782-F785 PolarHBondContact OD1-N 3.45Å; F785-S787 VanDerWaalsContact C-N 3.27Å; F785-S787 PolarHBondContact O-N 3.35Å; F785-L790 HydrophobicContact CD1-CD2 3.72Å; F785-L790 HydrophobicContact CE1-CD2 3.9Å; F785-L790 HydrophobicContact CG-CD2 4.06Å; F785-L790 HydrophobicContact CZ-CD2 4.38Å
786	P	97.1	Very high	96.1	Very high	1 Å²	1	26 Å²	26	1%	0.006	14%	0.135	C	C	.	.	S	Bend	trans	-86	14.7	-168.6	36.1	-39.6	0	0	0	115.2	R412 N415 L416	R412-P786 HydrophobicContact CB-CB 3.88Å; R412-P786 VanDerWaalsContact CD-O 3.28Å; R412-P786 WeakPolarHBondContact CD-O 3.08Å; R412-P786 HydrophobicContact CG-CB 4.28Å; R412-P786 PolarHBondContact NH1-O 2.57Å; R412-P786 WeakPolarHBondContact O-CB 3.48Å; N415-P786 HydrophobicContact CB-CB 3.74Å; N415-P786 HydrophobicContact CB-CG 3.9Å; L416-P786 HydrophobicContact CB-CG 4.36Å; L416-P786 HydrophobicContact CD2-CB 4.42Å; L416-P786 HydrophobicContact CD2-CG 3.63Å; L416-P786 HydrophobicContact CG-CB 4Å; L416-P786 HydrophobicContact CG-CG 3.59Å
787	S	98.3	Very high	96.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.112	C	C	.	.	S	Bend	trans	-140.6	158.5	176.6	-179.4	0	0	0	0	107.7	Y384 N385 F785 H789	Y384-S787 WeakPolarHBondContact OH-CB 3.39Å; N385-S787 WeakPolarHBondContact O-CB 3.29Å; N385-S787 PolarHBondContact O-OG 3.28Å; F785-S787 VanDerWaalsContact C-N 3.27Å; F785-S787 PolarHBondContact O-N 3.35Å; S787-H789 PolarHBondContact O-N 3.09Å; S787-H789 PolarHBondContact OG-N 3.43Å; S787-H789 VanDerWaalsContact OG-N 3.16Å
788	D	98.1	Very high	96.4	Very high	7 Å²	7	21.5 Å²	21.5	4%	0.037	10%	0.104	C	C	.	.	S	Bend	trans	-72.2	-13	167.1	50.7	-8	0	0	0	112.4	L387 Y399 T724 L725 L780 P781	L387-D788 HydrophobicContact CD2-CB 4.43Å; Y399-D788 HydrophobicContact CE1-CB 3.84Å; Y399-D788 VanDerWaalsContact CE1-OD2 3.25Å; Y399-D788 WeakPolarHBondContact CE1-OD2 3.4Å; Y399-D788 PolarHBondContact OH-OD2 2.93Å; T724-D788 CarbonylContact C-O 3.54Å; T724-D788 VanDerWaalsContact CA-O 3.31Å; T724-D788 WeakPolarHBondContact CA-O 3.36Å; T724-D788 PolarHBondContact OG1-O 2.84Å; L725-D788 PolarHBondContact N-O 3.03Å; L780-D788 WeakPolarHBondContact CD1-O 3.41Å; P781-D788 HydrophobicContact CG-CB 4.43Å
789	H	98.6	Very high	96.1	Very high	10 Å²	10	18.5 Å²	18.5	5%	0.046	9%	0.088	C	C	.	.	B	Isolated β-bridge	trans	-97.9	162.9	169.1	-67.9	-127	0	0	0	113.2	Y384 N385 D570 T723 T724 D734 S787	Y384-H789 HydrophobicContact CE2-CB 4.35Å; Y384-H789 VanDerWaalsContact CE2-O 3.28Å; Y384-H789 WeakPolarHBondContact CE2-O 3.46Å; N385-H789 HydrophobicContact CB-CB 4.01Å; N385-H789 PolarHBondContact ND2-NE2 2.93Å; D570-H789 IonicContact OD2-CE1 3.43Å; D570-H789 PolarHBondContact OD2-CE1 2.78Å; T723-H789 CarbonylContact O-C 3.48Å; T723-H789 WeakPolarHBondContact O-CA 3.3Å; T723-H789 WeakPolarHBondContact O-CB 3.32Å; T724-H789 PolarHBondContact OG1-CD2 2.79Å; T724-H789 PolarHBondContact OG1-NE2 2.9Å; T724-H789 VanDerWaalsContact OG1-NE2 3.14Å; D734-H789 IonicContact OD1-CE1 2.69Å; D734-H789 IonicContact OD1-ND1 2.69Å; D734-H789 PolarHBondContact OD1-ND1 2.87Å; D734-H789 IonicContact OD2-CE1 3.93Å; D734-H789 IonicContact OD2-CG 2.69Å; D734-H789 IonicContact OD2-ND1 3.25Å; D734-H789 PolarHBondContact OD2-ND1 3.03Å; S787-H789 PolarHBondContact O-N 3.09Å; S787-H789 PolarHBondContact OG-N 3.43Å; S787-H789 VanDerWaalsContact OG-N 3.16Å
790	L	98.3	Very high	95.6	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.088	C	C	.	.			trans	-105.2	139.1	170.8	-63.1	-178.5	0	0	0	110.9	T723 L768 L769 L774 L780 F785 L792	T723-L790 PolarHBondContact O-N 2.97Å; L768-L790 HydrophobicContact CD2-CB 4.19Å; L768-L790 HydrophobicContact CD2-CD1 4.28Å; L769-L790 HydrophobicContact CB-CD1 4.22Å; L774-L790 HydrophobicContact CD1-CD1 4.37Å; L774-L790 HydrophobicContact CD2-CD1 4.34Å; L774-L790 HydrophobicContact CD2-CD2 4.38Å; L780-L790 HydrophobicContact CD1-CD2 3.91Å; L780-L790 HydrophobicContact CD1-CG 4.13Å; L780-L790 HydrophobicContact CD2-CD2 4.36Å; F785-L790 HydrophobicContact CD1-CD2 3.72Å; F785-L790 HydrophobicContact CE1-CD2 3.9Å; F785-L790 HydrophobicContact CG-CD2 4.06Å; F785-L790 HydrophobicContact CZ-CD2 4.38Å; L790-L792 WeakPolarHBondContact O-CD1 3.46Å; L790-L792 PolarHBondContact O-N 3.23Å
791	S	98.3	Very high	94.8	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.099	C	C	.	.			trans	-64.8	113.8	176.3	67.4	0	0	0	0	112.3	R351 E419	R351-S791 PolarHBondContact NH1-O 3.22Å; R351-S791 PolarHBondContact NH1-OG 3.33Å; R351-S791 PolarHBondContact NH2-O 3.32Å; E419-S791 PolarHBondContact OE1-OG 3.29Å
792	L	98.8	Very high	93.8	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	137.8	168.5	-81.7	66.4	0	0	0	108.4	M382 S383 Y710 T723 D734 I736 L768 L790	M382-L792 CarbonylContact C-O 3.47Å; M382-L792 WeakPolarHBondContact CA-O 3.35Å; M382-L792 WeakPolarHBondContact CG-O 3.31Å; S383-L792 PolarHBondContact N-O 3.42Å; S383-L792 PolarHBondContact O-N 3.5Å; Y710-L792 HydrophobicContact CD2-CD2 3.72Å; Y710-L792 HydrophobicContact CD2-CG 4.03Å; Y710-L792 HydrophobicContact CE2-CB 3.77Å; Y710-L792 HydrophobicContact CE2-CD2 3.78Å; Y710-L792 HydrophobicContact CE2-CG 3.62Å; T723-L792 HydrophobicContact CG2-CD1 3.74Å; D734-L792 HydrophobicContact CB-CD1 3.7Å; D734-L792 HydrophobicContact CB-CD2 4.12Å; D734-L792 WeakPolarHBondContact O-CD2 3.32Å; I736-L792 HydrophobicContact CD1-CB 3.78Å; I736-L792 HydrophobicContact CG1-CB 3.95Å; I736-L792 HydrophobicContact CG1-CD2 4.21Å; L768-L792 HydrophobicContact CD2-CD1 4.09Å; L768-L792 HydrophobicContact CD2-CG 4.46Å; L790-L792 WeakPolarHBondContact O-CD1 3.46Å; L790-L792 PolarHBondContact O-N 3.23Å
793	L	98.8	Very high	92.8	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.01	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	121.4	-179.4	177.4	68.7	0	0	0	110.3	W353 V381 M382 W423 P425 Y710 R765 L766	W353-L793 HydrophobicContact CZ3-CD2 3.94Å; W353-L793 HydrophobicContact CZ3-CG 4.01Å; V381-L793 WeakPolarHBondContact O-CA 3.47Å; M382-L793 HydrophobicContact CB-CD1 4.03Å; M382-L793 HydrophobicContact CE-CD1 4.34Å; W423-L793 HydrophobicContact CB-CD2 3.72Å; W423-L793 HydrophobicContact CD2-CD2 3.79Å; W423-L793 HydrophobicContact CE3-CD2 3.94Å; W423-L793 HydrophobicContact CG-CD2 3.71Å; P425-L793 HydrophobicContact CB-CD1 3.85Å; Y710-L793 PolarHBondContact OH-N 2.98Å; Y710-L793 PolarHBondContact OH-O 3.24Å; R765-L793 CarbonylContact C-O 3.55Å; R765-L793 VanDerWaalsContact CA-O 3.24Å; R765-L793 WeakPolarHBondContact CA-O 3.3Å; R765-L793 WeakPolarHBondContact CB-O 3.42Å; L766-L793 HydrophobicContact CB-CB 3.88Å; L766-L793 HydrophobicContact CB-CD2 4.27Å; L766-L793 HydrophobicContact CB-CG 4.48Å; L766-L793 HydrophobicContact CD2-CB 4.36Å; L766-L793 HydrophobicContact CD2-CD2 4.31Å; L766-L793 PolarHBondContact N-O 2.91Å
794	A	98.7	Very high	92.7	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	143.8	-179.1	0	0	0	0	0	111.8	T380 V381 A709 I736 L762 R765 F796	T380-A794 CarbonylContact C-O 3.39Å; T380-A794 WeakPolarHBondContact CA-O 3.37Å; V381-A794 PolarHBondContact N-O 3.43Å; V381-A794 PolarHBondContact O-N 3.28Å; A709-A794 HydrophobicContact CB-CB 3.99Å; I736-A794 HydrophobicContact CD1-CB 4.18Å; L762-A794 HydrophobicContact CD1-CB 4.03Å; R765-A794 HydrophobicContact CB-CB 4.44Å; A794-F796 HydrophobicContact CB-CE2 3.71Å; A794-F796 HydrophobicContact CB-CZ 3.73Å
795	K	98.6	Very high	92.8	Very high	55 Å²	55	22.4 Å²	22.4	24%	0.239	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	127.8	175.4	-172.4	-176.1	177.6	-159.9	0	110.7	W353 D378 F379 T380 L763 G764	W353-K795 HydrophobicContact CH2-CB 3.67Å; W353-K795 HydrophobicContact CZ2-CB 3.52Å; W353-K795 HydrophobicContact CZ2-CD 4.22Å; W353-K795 HydrophobicContact CZ2-CG 4.5Å; D378-K795 WeakPolarHBondContact OD2-CE 3.41Å; D378-K795 IonicContact OD2-NZ 2.69Å; D378-K795 PolarHBondContact OD2-NZ 3.37Å; F379-K795 CarbonylContact O-C 3.58Å; F379-K795 WeakPolarHBondContact O-CA 3.47Å; T380-K795 HydrophobicContact CG2-CB 3.98Å; T380-K795 HydrophobicContact CG2-CG 4.09Å; L763-K795 HydrophobicContact CB-CB 4.43Å; L763-K795 HydrophobicContact CB-CD 4.32Å; L763-K795 HydrophobicContact CB-CG 4.32Å; L763-K795 HydrophobicContact CD1-CD 4.06Å; L763-K795 HydrophobicContact CD1-CG 4.23Å; L763-K795 PolarHBondContact N-O 3.33Å; G764-K795 PolarHBondContact O-N 3.19Å
796	F	97.8	Very high	92.7	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	162.8	179.9	-60.8	-75.6	0	0	0	111.7	D378 F379 V381 A709 I736 Y738 L760 K761 L762 A794	D378-F796 CarbonylContact C-O 3.58Å; D378-F796 VanDerWaalsContact CA-O 3.28Å; D378-F796 WeakPolarHBondContact CA-O 3.42Å; F379-F796 HydrophobicContact CD1-CB 4.2Å; F379-F796 HydrophobicContact CE1-CB 3.68Å; F379-F796 HydrophobicContact CE2-CB 4.26Å; F379-F796 HydrophobicContact CE2-CD2 4.23Å; F379-F796 HydrophobicContact CZ-CB 3.72Å; F379-F796 HydrophobicContact CZ-CD2 4.35Å; F379-F796 HydrophobicContact CZ-CG 4.35Å; F379-F796 PolarHBondContact N-O 3.03Å; F379-F796 PolarHBondContact O-N 3.14Å; V381-F796 HydrophobicContact CB-CE2 4.27Å; V381-F796 HydrophobicContact CG2-CD2 3.98Å; V381-F796 HydrophobicContact CG2-CE2 4.06Å; A709-F796 HydrophobicContact CB-CZ 4.38Å; I736-F796 HydrophobicContact CG2-CE2 4.11Å; I736-F796 HydrophobicContact CG2-CZ 3.93Å; Y738-F796 AromaticContact CD1-CE1 3.65Å; Y738-F796 HydrophobicContact CD1-CE1 3.65Å; Y738-F796 HydrophobicContact CD1-CZ 4.07Å; Y738-F796 HydrophobicContact CD2-CD1 4.09Å; Y738-F796 AromaticContact CD2-CE1 3.66Å; Y738-F796 HydrophobicContact CD2-CE1 3.66Å; Y738-F796 HydrophobicContact CE1-CE1 4.13Å; Y738-F796 HydrophobicContact CE2-CE1 4.13Å; Y738-F796 HydrophobicContact CG-CD1 4.23Å; Y738-F796 AromaticContact CG-CE1 3.39Å; Y738-F796 HydrophobicContact CG-CE1 3.39Å; Y738-F796 AromaticContact CG-CZ 3.97Å; Y738-F796 HydrophobicContact CG-CZ 3.97Å; L760-F796 HydrophobicContact CB-CB 4.35Å; L760-F796 HydrophobicContact CB-CD1 4.15Å; L760-F796 HydrophobicContact CD1-CB 4.38Å; L760-F796 HydrophobicContact CD1-CD1 4.32Å; L760-F796 HydrophobicContact CD1-CG 4.25Å; K761-F796 CarbonylContact O-C 3.45Å; K761-F796 VanDerWaalsContact O-CA 3.27Å; K761-F796 WeakPolarHBondContact O-CA 3.44Å; L762-F796 HydrophobicContact CB-CD1 4.31Å; L762-F796 HydrophobicContact CB-CE1 4.23Å; L762-F796 HydrophobicContact CD1-CD1 4.08Å; L762-F796 HydrophobicContact CD1-CE1 3.63Å; L762-F796 HydrophobicContact CD1-CZ 4.11Å; A794-F796 HydrophobicContact CB-CE2 3.71Å; A794-F796 HydrophobicContact CB-CZ 3.73Å
797	Q	95.3	Very high	92.4	Very high	25 Å²	25	23.6 Å²	23.6	12%	0.117	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	138.2	175.9	175.1	177.9	89.5	0	0	110.9	L376 F377 D378 K761 L763	L376-Q797 HydrophobicContact CB-CG 4.48Å; L376-Q797 HydrophobicContact CD2-CG 4.39Å; F377-Q797 WeakPolarHBondContact O-CA 3.45Å; D378-Q797 WeakPolarHBondContact OD1-CG 3.3Å; D378-Q797 PolarHBondContact OD1-NE2 3.1Å; K761-Q797 HydrophobicContact CB-CB 4.32Å; K761-Q797 PolarHBondContact N-O 2.87Å; K761-Q797 PolarHBondContact O-N 3.12Å; L763-Q797 HydrophobicContact CD1-CB 3.85Å; L763-Q797 HydrophobicContact CD2-CB 4.11Å; L763-Q797 HydrophobicContact CG-CB 3.91Å
798	L	92.3	Very high	92.1	Very high	2 Å²	2	25.1 Å²	25.1	1%	0.01	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	161	173	60.8	79.8	0	0	0	111.8	F377 F379 P506 P519 L760 L800	F377-L798 HydrophobicContact CB-CD1 3.8Å; F377-L798 HydrophobicContact CB-CG 4.32Å; F377-L798 HydrophobicContact CD1-CD1 4.28Å; F377-L798 HydrophobicContact CD1-CG 4.3Å; F377-L798 HydrophobicContact CG-CD1 4.4Å; F377-L798 PolarHBondContact N-O 3.03Å; F377-L798 PolarHBondContact O-N 3.07Å; F379-L798 HydrophobicContact CE1-CD2 3.84Å; F379-L798 HydrophobicContact CE1-CG 4.3Å; P506-L798 HydrophobicContact CG-CD2 4.09Å; P519-L798 HydrophobicContact CG-CD1 4.41Å; L760-L798 HydrophobicContact CD2-CB 3.93Å; L760-L798 HydrophobicContact CD2-CD2 3.8Å; L760-L798 HydrophobicContact CD2-CG 4.42Å; L798-L800 HydrophobicContact CD1-CD2 3.66Å; L798-L800 HydrophobicContact CD1-CG 4.44Å
799	D	86.2	Confident	91.6	Very high	24 Å²	24	26.3 Å²	26.3	13%	0.128	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	135.8	173.8	-42.2	-30.2	0	0	0	109.7	P519 R741 S757	P519-D799 WeakPolarHBondContact CD-O 3.49Å; R741-D799 IonicContact CZ-OD1 2.73Å; R741-D799 IonicContact NH1-OD1 2.71Å; R741-D799 PolarHBondContact NH1-OD1 3.08Å; R741-D799 IonicContact NH1-OD2 3.58Å; R741-D799 IonicContact NH2-OD1 3.64Å; R741-D799 PolarHBondContact NH2-OD1 3.24Å; R741-D799 VanDerWaalsContact NH2-OD1 3.15Å; R741-D799 IonicContact NH2-OD2 3.23Å; S757-D799 WeakPolarHBondContact CB-OD2 3.45Å; S757-D799 PolarHBondContact N-OD2 3.34Å; S757-D799 PolarHBondContact OG-OD1 3.47Å; S757-D799 PolarHBondContact OG-OD2 2.92Å
800	L	82.9	Confident	91.2	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.156	C	C	.	.			trans	-92.7	168.8	170.1	-58.1	178.4	0	0	0	112.2	P375 F377 P506 I508 A516 L798	P375-L800 HydrophobicContact CB-CD1 4.33Å; P375-L800 HydrophobicContact CG-CB 4.12Å; P375-L800 VanDerWaalsContact O-CB 3.3Å; P375-L800 WeakPolarHBondContact O-CB 3.47Å; P375-L800 PolarHBondContact O-N 3.41Å; F377-L800 HydrophobicContact CB-CD1 3.94Å; F377-L800 HydrophobicContact CB-CD2 3.65Å; F377-L800 HydrophobicContact CB-CG 3.71Å; F377-L800 HydrophobicContact CD2-CD1 4.23Å; F377-L800 HydrophobicContact CD2-CD2 4.31Å; F377-L800 HydrophobicContact CG-CD2 4.1Å; P506-L800 HydrophobicContact CB-CD2 4.3Å; I508-L800 HydrophobicContact CD1-CD1 3.33Å; I508-L800 HydrophobicContact CG1-CD1 3.68Å; A516-L800 HydrophobicContact CB-CB 4.31Å; A516-L800 HydrophobicContact CB-CD1 3.88Å; L798-L800 HydrophobicContact CD1-CD2 3.66Å; L798-L800 HydrophobicContact CD1-CG 4.44Å
801	N	80.6	Confident	90.6	Very high	44 Å²	44	29.5 Å²	29.5	24%	0.235	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	139	161.7	-42.6	-88	0	0	0	107.8	R374 A516 K517 Q756	R374-N801 PolarHBondContact NH1-OD1 2.89Å; A516-N801 CarbonylContact C-O 3.51Å; A516-N801 WeakPolarHBondContact CA-O 3.3Å; K517-N801 PolarHBondContact N-O 3.33Å; K517-N801 PolarHBondContact O-N 2.81Å; K517-N801 PolarHBondContact O-ND2 3.47Å; K517-N801 VanDerWaalsContact O-O 3.13Å; Q756-N801 PolarHBondContact NE2-OD1 2.8Å; Q756-N801 VanDerWaalsContact NE2-OD1 3.08Å
802	P	75.6	Confident	90	Very high	97 Å²	97	32 Å²	32	63%	0.63	18%	0.182	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-61.9	155.4	166	29.4	-34.6	0	0	0	110.3
803	V	74.2	Confident	89.2	Confident	134 Å²	134	34.8 Å²	34.8	81%	0.812	20%	0.198	S	C	*	.			trans	-86.6	0	176.7	174.8	0	0	0	0	111.2	V514 T515 K517	V514-V803 HydrophobicContact CG1-CG2 4.3Å; V514-V803 WeakPolarHBondContact O-CG2 3.24Å; T515-V803 PolarHBondContact O-N 2.93Å; K517-V803 HydrophobicContact CB-CG2 4.26Å; K517-V803 HydrophobicContact CD-CG2 3.85Å; K517-V803 HydrophobicContact CG-CG2 3.7Å

Retrieved 803 of 803 residues in 407.6 ms (Link to these results)

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