A0A087YG14_POEFO Loading...

Diacylglycerol kinase

AlphaFold DB , UniProt , Accession A0A087YG14, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 895 aa.

						>A0A087YG14_POEFO|A0A087YG14
MAESTRPSPADPDAANCRAASPAAVKRRAQQSTMGHCFKKVTLTKPTFCHSCSDFVWGLIGFLCEVCNFMCHEKCLKTLRAVCTCMAPSKVQVPVAHCFGPAGQKKRFCCVCRKQTEGSTALRCEVCELHVHADCAAFSCADCRCCHLDQNLQQESLQHQWREGDPASARCEFCRRSCGSSEVLSGLRCEWCGVTSHASCCHRLPAECALGRLRSMLLPPPCVRLQSRNFSKMQCYRIGESGSQDRNNWDEAEPAAAAPRELQSAAPETSKQVFKVFDGDDALRRGFFRLAPSCRGVKNEEVEAALRAFYLPGEPHDFDLENVGAVQHHHSDDFQNQNTSDARVLRAKLRHDDVIKVHAAWSRSSVVSVEVSETSTAASVLSDVLLQLDRQGEDASSFSLQEVYMSSKQVQRQTLSPQEKMVDKLQEIRKLSLRQMNQTRFYIVQNQNPAVQVGLLISGLPPLLTKEEYCGLLEEHLDFKGHLVTLTHFYEAQGAVALQISCFAEAERIYMLAKDTTISNKTLTSLIIPEIQCQKLGDAVCPLLVFVNPKSGGLKGRELLHSFRKLLNPHQVFDITNGGPLAGLHAFREVPRFRVLVCGGDGTVGWVLGVLETVRHKLVCREPPIGIVPLGTGNDLARILRWGPGYGGDDPYHILASVDEADEVQMDRWTILLDAQDVSEDGKDSGVLEPPKIVQMNNYFGLGIDAELSLDFHLAREGEPDKFTSRFHNKGVYVKVGLQKISRSRSLHKELQLQVDKQPVPLPNIEGLIFLNIPSWGSGADLWGSEADGRFSRPRIDDGLLEVVGVTGVVHMGQVQSGLRSGIRIAQGSYIRLIVSKELPVQVDGEPWLQAPGHIIISAAGPKVRMLRKSKLKQRKSPSSSDGRSDSPSSRDGGH
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.7	Very low	29	Very low	244 Å²	244	146 Å²	146	100%	1.202	84%	0.84	S	S	*	*				0	96.5	0	-66.4	-167.1	178.4	0	0	106
2	A	28.2	Very low	29	Very low	93 Å²	93	141.7 Å²	141.7	77%	0.769	82%	0.821	S	S	*	*				104.4	106.4	79.6	0	0	0	0	0	108.3
3	E	26.9	Very low	28.8	Very low	190 Å²	190	143.8 Å²	143.8	89%	0.888	83%	0.828	S	S	*	*			trans	7.2	139.9	149.9	-64.4	168.4	137.1	0	0	119.7
4	S	26.3	Very low	28.7	Very low	116 Å²	116	141.1 Å²	141.1	81%	0.811	83%	0.831	S	S	*	*				-168.5	120.5	110.2	-172	0	0	0	0	111.9
5	T	27.8	Very low	28.6	Very low	123 Å²	123	137.7 Å²	137.7	76%	0.755	83%	0.825	S	S	*	*			trans	-67.6	158.3	160.2	31.2	0	0	0	0	112
6	R	28.7	Very low	28.4	Very low	244 Å²	244	138.7 Å²	138.7	92%	0.921	83%	0.825	S	S	*	*				-174.6	157.5	116.6	-96.1	-175	-169.9	-168.3	4	113.3
7	P	33	Very low	28.2	Very low	114 Å²	114	138.5 Å²	138.5	74%	0.74	83%	0.83	S	S	*	*			trans	-129.6	-171.7	-153.5	39.4	-19.7	0	0	0	115.6
8	S	29.5	Very low	28.1	Very low	112 Å²	112	144.7 Å²	144.7	78%	0.783	84%	0.836	S	S	*	*			trans	87.1	152.7	155	-91	0	0	0	0	118.8
9	P	30.1	Very low	28	Very low	128 Å²	128	142.2 Å²	142.2	83%	0.831	84%	0.835	S	S	*	*			cis	-132.9	167.5	36	36.3	-16.1	0	0	0	118.5
10	A	27.2	Very low	27.8	Very low	86 Å²	86	140.1 Å²	140.1	71%	0.711	83%	0.834	S	S	*	*			trans	-99.5	158.6	172.1	0	0	0	0	0	110.7
11	D	27.9	Very low	27.7	Very low	156 Å²	156	139 Å²	139	83%	0.834	83%	0.834	S	S	*	*			trans	178	171.2	138.6	-116.6	-4.1	0	0	0	110.5
12	P	29	Very low	27.5	Very low	94 Å²	94	133.2 Å²	133.2	61%	0.61	81%	0.814	S	S	*	*				-131.7	158	-68.4	28.1	-6.6	0	0	0	111.4
13	D	26.5	Very low	27.3	Very low	170 Å²	170	133.1 Å²	133.1	91%	0.909	81%	0.814	S	S	*	*			trans	168.7	86.3	143.3	-91.6	-21.1	0	0	0	108.8
14	A	27	Very low	27.4	Very low	105 Å²	105	129.1 Å²	129.1	87%	0.868	81%	0.813	S	S	*	*			trans	-138.8	94.5	168.6	0	0	0	0	0	108.4
15	A	26.5	Very low	27.4	Very low	90 Å²	90	129.7 Å²	129.7	74%	0.744	81%	0.811	S	S	*	*			trans	-157.3	134.8	154.3	0	0	0	0	0	111.7
16	N	26.4	Very low	27.5	Very low	154 Å²	154	133 Å²	133	82%	0.824	82%	0.816	S	S	*	*			trans	79.9	92.6	163.5	-61.6	-17.2	0	0	0	118.5
17	C	25.1	Very low	27.7	Very low	135 Å²	135	133.5 Å²	133.5	91%	0.912	82%	0.817	S	S	*	*				-164.3	122.7	98.9	-97.4	0	0	0	0	110.8
18	R	25.6	Very low	27.8	Very low	250 Å²	250	135.2 Å²	135.2	94%	0.943	81%	0.809	S	S	*	*			trans	-80.3	139.7	177.7	-85.2	179	171.3	176	-2.3	111.1
19	A	25.8	Very low	28.5	Very low	98 Å²	98	132.3 Å²	132.3	81%	0.81	79%	0.792	S	S	*	*			trans	71	102.4	142.1	0	0	0	0	0	119.8
20	A	25	Very low	29.4	Very low	99 Å²	99	133.7 Å²	133.7	82%	0.818	79%	0.787	S	S	*	*			trans	-134.1	121.6	130.5	0	0	0	0	0	108.3
21	S	25.2	Very low	30.7	Very low	119 Å²	119	134.7 Å²	134.7	83%	0.832	78%	0.777	S	S	*	*			trans	-67.2	132.3	179.4	-61.1	0	0	0	0	111.5
22	P	29.3	Very low	32.3	Very low	121 Å²	121	128.7 Å²	128.7	79%	0.786	75%	0.747	S	S	*	*			trans	-92.1	111	167.2	19	-3.8	0	0	0	110	A24	P22-A24 PolarHBondContact O-N 3.09Å
23	A	25.4	Very low	33.9	Very low	92 Å²	92	130.6 Å²	130.6	76%	0.76	76%	0.758	S	S	*	*			trans	-61.4	128.1	163.9	0	0	0	0	0	110.5	V25	A23-V25 PolarHBondContact O-N 3.25Å; A23-V25 VanDerWaalsContact O-N 3.17Å
24	A	28.3	Very low	36.6	Very low	105 Å²	105	124.1 Å²	124.1	87%	0.868	72%	0.722	S	S	*	*			trans	21.2	74.9	154.4	0	0	0	0	0	118.7	P22	P22-A24 PolarHBondContact O-N 3.09Å
25	V	26.6	Very low	39.4	Very low	129 Å²	129	119.9 Å²	119.9	78%	0.782	69%	0.688	S	S	*	*			trans	-85.9	108.2	158.4	-179.9	0	0	0	0	108.4	A23 R27	A23-V25 PolarHBondContact O-N 3.25Å; A23-V25 VanDerWaalsContact O-N 3.17Å; V25-R27 PolarHBondContact O-N 2.86Å; V25-R27 VanDerWaalsContact O-N 3.13Å
26	K	30.4	Very low	42.4	Very low	193 Å²	193	115.6 Å²	115.6	84%	0.839	65%	0.653	S	S	*	*			trans	-52.9	114.9	168	-79.6	174	174.7	172.8	0	108.9	R28	K26-R28 PolarHBondContact O-N 3.35Å
27	R	31.8	Very low	45.3	Very low	254 Å²	254	109.7 Å²	109.7	96%	0.958	62%	0.624	S	S	*	*			trans	-58.5	97.7	170.8	-79.6	179.8	167.9	179.6	-3.4	109.8	V25	V25-R27 PolarHBondContact O-N 2.86Å; V25-R27 VanDerWaalsContact O-N 3.13Å
28	R	36	Very low	48.5	Very low	149 Å²	149	104 Å²	104	56%	0.562	58%	0.583	S	S	*	*			trans	-79.8	161.2	170.2	-94.1	-176.4	174.2	-164.2	-0.5	111.2	K26 E300 E303	K26-R28 PolarHBondContact O-N 3.35Å; R28-E300 IonicContact CZ-OE1 3.68Å; R28-E300 IonicContact NH2-OE1 2.76Å; R28-E300 PolarHBondContact NH2-OE1 3.27Å; R28-E303 IonicContact NH1-OE1 3.65Å
29	A	44	Very low	51.6	Low	52 Å²	52	97.1 Å²	97.1	43%	0.43	56%	0.561	S	S	.	*			trans	-41.8	131.8	-166.6	0	0	0	0	0	116.5	Q31 C37	A29-Q31 PolarHBondContact O-N 2.83Å; A29-C37 WeakPolarHBondContact CB-SG 2.89Å
30	Q	49.3	Very low	54.8	Low	157 Å²	157	98.6 Å²	98.6	73%	0.734	55%	0.549	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.5	108.6	160.5	-91.1	178.5	-33.2	0	0	108.4	S32	Q30-S32 PolarHBondContact O-N 2.8Å
31	Q	54	Low	58	Low	106 Å²	106	95.5 Å²	95.5	50%	0.495	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	116.6	170.9	-162.9	164.2	-13.7	0	0	108.6	A29 E314	A29-Q31 PolarHBondContact O-N 2.83Å; Q31-E314 VanDerWaalsContact CD-OE1 3.23Å; Q31-E314 PolarHBondContact NE2-OE1 3.05Å; Q31-E314 PolarHBondContact OE1-OE1 3.47Å
32	S	60.3	Low	61.2	Low	30 Å²	30	94.8 Å²	94.8	21%	0.21	51%	0.51	C	S	.	.			trans	-78.5	156.5	179.8	77.3	0	0	0	0	110.9	Q30 M34 G35 H36	Q30-S32 PolarHBondContact O-N 2.8Å; S32-M34 PolarHBondContact O-N 2.97Å; S32-M34 PolarHBondContact OG-N 3.16Å; S32-G35 PolarHBondContact O-N 3.39Å; S32-H36 PolarHBondContact N-O 3.25Å; S32-H36 VanDerWaalsContact N-O 3.1Å; S32-H36 PolarHBondContact OG-N 3.39Å
33	T	63.2	Low	64.1	Low	135 Å²	135	89.8 Å²	89.8	83%	0.828	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-16.8	172.2	54.7	0	0	0	0	113.8
34	M	82.8	Confident	67	Low	34 Å²	34	91.6 Å²	91.6	17%	0.167	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	6.9	178.6	-62.4	-60.3	109.3	0	0	113.3	S32 H36 V82 C83	S32-M34 PolarHBondContact O-N 2.97Å; S32-M34 PolarHBondContact OG-N 3.16Å; M34-H36 VanDerWaalsContact C-N 3.34Å; M34-H36 PolarHBondContact O-N 3.15Å; M34-V82 HydrophobicContact SD-CG2 4Å; M34-C83 WeakPolarHBondContact O-CB 3.4Å; M34-C83 PolarHBondContact O-N 2.88Å
35	G	85.6	Confident	69.8	Low	15 Å²	15	92.8 Å²	92.8	16%	0.155	46%	0.464	C	S	.	.	S	Bend	trans	83.9	-1.8	175.2	0	0	0	0	0	115.6	S32 C83	S32-G35 PolarHBondContact O-N 3.39Å; G35-C83 VanDerWaalsContact C-CB 3.48Å
36	H	89.5	Confident	72.8	Confident	0 Å²	0	91.6 Å²	91.6	0%	0	46%	0.459	C	S	.	.			trans	-73.5	132.5	176.3	-65.4	-80.3	0	0	0	111.3	S32 M34 F38 C64 C67 F69 A81 C83	S32-H36 PolarHBondContact N-O 3.25Å; S32-H36 VanDerWaalsContact N-O 3.1Å; S32-H36 PolarHBondContact OG-N 3.39Å; M34-H36 VanDerWaalsContact C-N 3.34Å; M34-H36 PolarHBondContact O-N 3.15Å; H36-F38 HydrophobicContact CB-CD2 3.85Å; H36-F38 HydrophobicContact CB-CE1 4.38Å; H36-F38 HydrophobicContact CB-CE2 3.28Å; H36-F38 HydrophobicContact CB-CZ 3.58Å; H36-F38 AromaticContact CG-CE2 3.95Å; H36-F38 AromaticContact CG-CZ 3.8Å; H36-C64 HydrophobicContact CB-CB 4.32Å; H36-C64 PolarHBondContact ND1-SG 3.47Å; H36-C67 VanDerWaalsContact CE1-SG 3.56Å; H36-F69 AromaticContact CE1-CD2 3.68Å; H36-F69 AromaticContact CE1-CG 3.73Å; H36-A81 PolarHBondContact CD2-O 3.06Å; H36-A81 PolarHBondContact NE2-O 3.36Å; H36-C83 HydrophobicContact CB-CB 4.46Å; H36-C83 VanDerWaalsContact CE1-CA 3.47Å; H36-C83 WeakPolarHBondContact CE1-CA 3.33Å; H36-C83 PolarHBondContact ND1-SG 2.61Å; H36-C83 PolarHBondContact NE2-N 3.25Å
37	C	89.3	Confident	75.7	Confident	31 Å²	31	83.9 Å²	83.9	21%	0.209	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	102.6	167.5	-178.3	0	0	0	0	109.2	A29 C64 E65 V66	A29-C37 WeakPolarHBondContact CB-SG 2.89Å; C37-C64 CarbonylContact O-C 3.43Å; C37-C64 VanDerWaalsContact O-CA 3.25Å; C37-C64 WeakPolarHBondContact O-CA 3.12Å; C37-E65 PolarHBondContact O-N 3.47Å; C37-V66 HydrophobicContact CB-CG2 4.47Å
38	F	91	Very high	78.5	Confident	14 Å²	14	74.4 Å²	74.4	6%	0.061	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	134.1	-174.5	-74	-72.8	0	0	0	113	H36 F62 C64 F69 C71 L76 L79	H36-F38 HydrophobicContact CB-CD2 3.85Å; H36-F38 HydrophobicContact CB-CE1 4.38Å; H36-F38 HydrophobicContact CB-CE2 3.28Å; H36-F38 HydrophobicContact CB-CZ 3.58Å; H36-F38 AromaticContact CG-CE2 3.95Å; H36-F38 AromaticContact CG-CZ 3.8Å; F38-F62 HydrophobicContact CB-CB 4.47Å; F38-F62 HydrophobicContact CB-CD1 4.47Å; F38-F62 HydrophobicContact CD1-CB 4.05Å; F38-F62 HydrophobicContact CG-CB 4.49Å; F38-C64 HydrophobicContact CD1-CB 4.18Å; F38-C64 HydrophobicContact CE1-CB 3.97Å; F38-F69 HydrophobicContact CE1-CD1 4.18Å; F38-F69 HydrophobicContact CZ-CD1 4.2Å; F38-C71 HydrophobicContact CE1-CB 4.09Å; F38-C71 HydrophobicContact CZ-CB 4.41Å; F38-L76 HydrophobicContact CD1-CD2 4.04Å; F38-L76 HydrophobicContact CD2-CD2 3.57Å; F38-L76 HydrophobicContact CE1-CD2 4.1Å; F38-L76 HydrophobicContact CE2-CD2 3.61Å; F38-L76 HydrophobicContact CG-CD2 3.8Å; F38-L76 HydrophobicContact CZ-CD2 3.9Å; F38-L79 HydrophobicContact CE2-CD1 3.42Å; F38-L79 VanDerWaalsContact CE2-CD1 3.42Å; F38-L79 HydrophobicContact CZ-CD1 3.38Å
39	K	90.7	Very high	81.2	Confident	107 Å²	107	67.3 Å²	67.3	47%	0.465	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	136.4	168.5	179.6	171.7	176.6	-179.3	0	110.3	V41 F62 L63 E65	K39-V41 HydrophobicContact CG-CG1 4.44Å; K39-V41 PolarHBondContact O-N 3.3Å; K39-F62 WeakPolarHBondContact O-CA 3.06Å; K39-L63 PolarHBondContact N-O 2.74Å; K39-L63 PolarHBondContact O-N 2.7Å; K39-E65 HydrophobicContact CB-CG 3.81Å; K39-E65 HydrophobicContact CD-CG 4.26Å; K39-E65 WeakPolarHBondContact CD-OE1 3.41Å; K39-E65 IonicContact NZ-OE1 2.72Å
40	K	93.3	Very high	83.3	Confident	129 Å²	129	65.6 Å²	65.6	56%	0.561	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.7	125.6	171	-169.8	179.3	-174.3	178.8	0	109	I60 F62	K40-I60 HydrophobicContact CD-CG2 4.19Å; K40-I60 HydrophobicContact CG-CG2 3.85Å; K40-F62 HydrophobicContact CB-CD1 4.45Å; K40-F62 HydrophobicContact CB-CE1 4.17Å; K40-F62 HydrophobicContact CG-CE1 4.43Å; K40-F62 HydrophobicContact CG-CZ 4.36Å
41	V	92.4	Very high	85.2	Confident	33 Å²	33	58.9 Å²	58.9	20%	0.2	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	147.7	-177.9	-64.9	0	0	0	0	111.1	K39 L43 I60 G61 L63 M70	K39-V41 HydrophobicContact CG-CG1 4.44Å; K39-V41 PolarHBondContact O-N 3.3Å; V41-L43 HydrophobicContact CG2-CD2 3.92Å; V41-I60 WeakPolarHBondContact O-CA 3.29Å; V41-G61 WeakPolarHBondContact CG2-O 3.36Å; V41-G61 PolarHBondContact N-O 3.23Å; V41-G61 PolarHBondContact O-N 2.84Å; V41-L63 HydrophobicContact CG1-CB 3.99Å; V41-L63 HydrophobicContact CG1-CD2 4.46Å; V41-L63 HydrophobicContact CG2-CB 3.94Å; V41-M70 HydrophobicContact CG2-CE 4.15Å; V41-M70 HydrophobicContact CG2-SD 4.39Å
42	T	92.4	Very high	86.7	Confident	104 Å²	104	55 Å²	55	64%	0.638	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	124.9	170.8	-53.9	0	0	0	0	109.2	L59	T42-L59 CarbonylContact C-O 3.58Å; T42-L59 WeakPolarHBondContact CA-O 3.49Å; T42-L59 HydrophobicContact CG2-CB 4.23Å; T42-L59 WeakPolarHBondContact CG2-O 3.49Å
43	L	89.9	Confident	88	Confident	16 Å²	16	54.3 Å²	54.3	8%	0.084	30%	0.3	C	S	.	.			trans	-92.3	119.3	-176.7	-57.3	175.9	0	0	0	109.7	V41 T47 V56 L59 M70	V41-L43 HydrophobicContact CG2-CD2 3.92Å; L43-T47 HydrophobicContact CD2-CG2 4.2Å; L43-V56 HydrophobicContact CD1-CB 3.83Å; L43-V56 HydrophobicContact CD1-CG1 3.6Å; L43-L59 PolarHBondContact N-O 3.46Å; L43-M70 HydrophobicContact CD2-CE 3.75Å; L43-M70 HydrophobicContact CD2-SD 4.19Å
44	T	86.4	Confident	89.1	Confident	130 Å²	130	52.2 Å²	52.2	80%	0.798	28%	0.284	S	S	*	.			trans	-101.8	-5.6	178.2	55.6	0	0	0	0	113
45	K	87.6	Confident	89.5	Confident	130 Å²	130	53.9 Å²	53.9	57%	0.565	29%	0.29	S	S	*	.	S	Bend	trans	-135	154.4	-178.7	-64.8	178.9	-177.3	173.7	0	110	T47	K45-T47 PolarHBondContact O-N 2.72Å; K45-T47 VanDerWaalsContact O-N 3.16Å; K45-T47 PolarHBondContact O-OG1 2.88Å
46	P	88.6	Confident	89.7	Confident	105 Å²	105	53.3 Å²	53.3	68%	0.682	28%	0.284	S	S	*	.			trans	-50.5	122	171.2	-28.6	36.8	0	0	0	111.3	F55	P46-F55 HydrophobicContact CB-CE2 3.85Å
47	T	91.6	Very high	89.2	Confident	31 Å²	31	63.5 Å²	63.5	19%	0.19	32%	0.322	C	S	.	.			trans	-136.8	142.4	-173.1	-54.1	0	0	0	0	110	L43 K45 V56 M70	L43-T47 HydrophobicContact CD2-CG2 4.2Å; K45-T47 PolarHBondContact O-N 2.72Å; K45-T47 VanDerWaalsContact O-N 3.16Å; K45-T47 PolarHBondContact O-OG1 2.88Å; T47-V56 PolarHBondContact O-N 2.88Å; T47-M70 HydrophobicContact CG2-CE 3.84Å; T47-M70 HydrophobicContact CG2-CG 3.63Å; T47-M70 HydrophobicContact CG2-SD 4.24Å
48	F	91.5	Very high	88.8	Confident	54 Å²	54	64.7 Å²	64.7	24%	0.237	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-115.7	148.4	-174.9	-62.3	-97.4	0	0	0	111.7	F55 E182 V183	F48-F55 HydrophobicContact CD1-CB 4.33Å; F48-F55 HydrophobicContact CE1-CB 4.15Å; F48-F55 HydrophobicContact CE1-CD2 4.13Å; F48-F55 HydrophobicContact CE2-CD2 4.49Å; F48-F55 HydrophobicContact CZ-CD2 4.1Å; F48-E182 HydrophobicContact CB-CB 4.34Å; F48-E182 HydrophobicContact CD2-CB 3.44Å; F48-E182 VanDerWaalsContact CD2-CB 3.44Å; F48-E182 HydrophobicContact CD2-CG 3.79Å; F48-E182 HydrophobicContact CE1-CG 4.4Å; F48-E182 HydrophobicContact CE2-CB 3.82Å; F48-E182 HydrophobicContact CE2-CG 3.6Å; F48-E182 HydrophobicContact CG-CB 3.85Å; F48-E182 HydrophobicContact CG-CG 4.29Å; F48-E182 HydrophobicContact CZ-CB 4.48Å; F48-E182 HydrophobicContact CZ-CG 3.93Å; F48-V183 HydrophobicContact CB-CG1 3.91Å; F48-V183 HydrophobicContact CB-CG2 3.98Å
49	C	90.8	Very high	88.5	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	37%	0.367	C	S	.	.			trans	-80.5	129.2	177.4	176.7	0	0	0	0	110.9	S51 S53 D54 V56 M70 H72	C49-S51 VanDerWaalsContact C-N 3.26Å; C49-S51 PolarHBondContact O-N 2.91Å; C49-S51 PolarHBondContact SG-N 2.82Å; C49-S53 WeakPolarHBondContact O-CA 3.36Å; C49-S53 PolarHBondContact O-N 3.16Å; C49-D54 PolarHBondContact N-O 2.85Å; C49-V56 HydrophobicContact CB-CG2 4.27Å; C49-M70 CarbonylContact C-O 3.56Å; C49-M70 WeakPolarHBondContact CA-O 3.41Å; C49-H72 WeakPolarHBondContact CB-CE1 3.49Å; C49-H72 VanDerWaalsContact CB-ND1 3.33Å; C49-H72 WeakPolarHBondContact CB-ND1 3.31Å
50	H	90.1	Very high	88.5	Confident	17 Å²	17	68.5 Å²	68.5	8%	0.079	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-22.4	176.7	-68.3	73	0	0	0	112.9	F69 M70 L184 S185	H50-F69 HydrophobicContact CB-CD1 4.05Å; H50-F69 HydrophobicContact CB-CD2 3.97Å; H50-F69 HydrophobicContact CB-CE1 3.67Å; H50-F69 HydrophobicContact CB-CE2 3.59Å; H50-F69 HydrophobicContact CB-CG 4.17Å; H50-F69 HydrophobicContact CB-CZ 3.43Å; H50-F69 VanDerWaalsContact CB-CZ 3.43Å; H50-M70 PolarHBondContact CE1-N 2.89Å; H50-M70 PolarHBondContact N-O 3.23Å; H50-M70 WeakPolarHBondContact ND1-CB 3.31Å; H50-M70 PolarHBondContact ND1-N 2.77Å; H50-M70 PolarHBondContact ND1-O 3.44Å; H50-L184 PolarHBondContact CD2-O 2.93Å; H50-L184 VanDerWaalsContact CD2-O 3.25Å; H50-S185 WeakPolarHBondContact O-CB 3.46Å
51	S	87.8	Confident	88.4	Confident	16 Å²	16	62.4 Å²	62.4	11%	0.112	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-39.9	-177.8	-173.5	0	0	0	0	113.8	C49	C49-S51 VanDerWaalsContact C-N 3.26Å; C49-S51 PolarHBondContact O-N 2.91Å; C49-S51 PolarHBondContact SG-N 2.82Å
52	C	86.1	Confident	88.5	Confident	25 Å²	25	62.2 Å²	62.2	17%	0.169	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.6	-2.3	-176.9	74.1	0	0	0	0	113.7	D54 H72	C52-D54 PolarHBondContact O-N 2.9Å; C52-H72 PolarHBondContact SG-CE1 2.86Å
53	S	87	Confident	88.5	Confident	14 Å²	14	59.3 Å²	59.3	10%	0.098	32%	0.315	C	S	.	.			trans	67.1	-4.5	-179.5	-47.9	0	0	0	0	115.2	C49 C178 S185	C49-S53 WeakPolarHBondContact O-CA 3.36Å; C49-S53 PolarHBondContact O-N 3.16Å; S53-C178 PolarHBondContact OG-O 2.85Å; S53-S185 VanDerWaalsContact OG-CB 3.25Å; S53-S185 WeakPolarHBondContact OG-CB 3.03Å; S53-S185 PolarHBondContact OG-OG 2.94Å
54	D	87.4	Confident	88.7	Confident	92 Å²	92	58.5 Å²	58.5	49%	0.492	31%	0.311	S	S	.	.			trans	-79.3	157.2	179.9	-59.8	-37.6	0	0	0	112.9	C49 C52	C49-D54 PolarHBondContact N-O 2.85Å; C52-D54 PolarHBondContact O-N 2.9Å
55	F	90.1	Very high	88.8	Confident	68 Å²	68	55.5 Å²	55.5	30%	0.298	29%	0.288	S	S	.	.	B	Isolated β-bridge	trans	-58.2	139.1	171.7	-174.2	-104.9	0	0	0	112.4	P46 F48 W57 H72	P46-F55 HydrophobicContact CB-CE2 3.85Å; F48-F55 HydrophobicContact CD1-CB 4.33Å; F48-F55 HydrophobicContact CE1-CB 4.15Å; F48-F55 HydrophobicContact CE1-CD2 4.13Å; F48-F55 HydrophobicContact CE2-CD2 4.49Å; F48-F55 HydrophobicContact CZ-CD2 4.1Å; F55-W57 AromaticContact CD1-CD2 3.84Å; F55-W57 HydrophobicContact CD1-CD2 3.84Å; F55-W57 HydrophobicContact CD1-CE3 4.05Å; F55-W57 HydrophobicContact CD1-CG 4.16Å; F55-W57 HydrophobicContact CD1-CZ2 4.46Å; F55-W57 HydrophobicContact CD1-CZ3 4.44Å; F55-W57 HydrophobicContact CE1-CD2 4.32Å; F55-W57 HydrophobicContact CE1-CE3 4.12Å; F55-W57 PolarHBondContact O-N 2.89Å; F55-H72 PolarHBondContact O-NE2 3.02Å
56	V	89.6	Confident	88.9	Confident	4 Å²	4	50.1 Å²	50.1	2%	0.024	27%	0.266	C	S	.	.			trans	-83.8	98.6	173.2	-173.9	0	0	0	0	109.7	L43 T47 C49 I60 H72	L43-V56 HydrophobicContact CD1-CB 3.83Å; L43-V56 HydrophobicContact CD1-CG1 3.6Å; T47-V56 PolarHBondContact O-N 2.88Å; C49-V56 HydrophobicContact CB-CG2 4.27Å; V56-I60 WeakPolarHBondContact CG1-O 3.44Å; V56-H72 WeakPolarHBondContact CA-NE2 3.4Å
57	W	80.4	Confident	89.1	Confident	213 Å²	213	45.1 Å²	45.1	81%	0.807	23%	0.233	S	C	*	.			trans	-67.7	129.7	176.8	-66.1	100.2	0	0	0	111.6	F55	F55-W57 AromaticContact CD1-CD2 3.84Å; F55-W57 HydrophobicContact CD1-CD2 3.84Å; F55-W57 HydrophobicContact CD1-CE3 4.05Å; F55-W57 HydrophobicContact CD1-CG 4.16Å; F55-W57 HydrophobicContact CD1-CZ2 4.46Å; F55-W57 HydrophobicContact CD1-CZ3 4.44Å; F55-W57 HydrophobicContact CE1-CD2 4.32Å; F55-W57 HydrophobicContact CE1-CE3 4.12Å; F55-W57 PolarHBondContact O-N 2.89Å
58	G	79.9	Confident	89.1	Confident	56 Å²	56	46 Å²	46	58%	0.577	24%	0.237	S	C	*	.	S	Bend	trans	97.3	178.6	-179.6	0	0	0	0	0	113.8	I60	G58-I60 VanDerWaalsContact C-N 3.28Å; G58-I60 PolarHBondContact O-N 2.86Å
59	L	84.3	Confident	89.2	Confident	122 Å²	122	43.5 Å²	43.5	64%	0.639	23%	0.226	S	C	*	.	S	Bend	trans	-84.8	5.3	-178.4	-65.8	176.4	0	0	0	113.4	T42 L43	T42-L59 CarbonylContact C-O 3.58Å; T42-L59 WeakPolarHBondContact CA-O 3.49Å; T42-L59 HydrophobicContact CG2-CB 4.23Å; T42-L59 WeakPolarHBondContact CG2-O 3.49Å; L43-L59 PolarHBondContact N-O 3.46Å
60	I	90.4	Very high	89.3	Confident	80 Å²	80	44.3 Å²	44.3	41%	0.41	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	128.8	-168.9	-62.7	175.2	0	0	0	110.7	K40 V41 V56 G58	K40-I60 HydrophobicContact CD-CG2 4.19Å; K40-I60 HydrophobicContact CG-CG2 3.85Å; V41-I60 WeakPolarHBondContact O-CA 3.29Å; V56-I60 WeakPolarHBondContact CG1-O 3.44Å; G58-I60 VanDerWaalsContact C-N 3.28Å; G58-I60 PolarHBondContact O-N 2.86Å
61	G	92.1	Very high	89.4	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	172.5	172.2	0	0	0	0	0	112.5	V41	V41-G61 WeakPolarHBondContact CG2-O 3.36Å; V41-G61 PolarHBondContact N-O 3.23Å; V41-G61 PolarHBondContact O-N 2.84Å
62	F	94	Very high	89.6	Confident	29 Å²	29	43.5 Å²	43.5	13%	0.127	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	118.1	174.8	-69.5	-100.7	0	0	0	109.6	F38 K39 K40 M70 C71 E73 L76	F38-F62 HydrophobicContact CB-CB 4.47Å; F38-F62 HydrophobicContact CB-CD1 4.47Å; F38-F62 HydrophobicContact CD1-CB 4.05Å; F38-F62 HydrophobicContact CG-CB 4.49Å; K39-F62 WeakPolarHBondContact O-CA 3.06Å; K40-F62 HydrophobicContact CB-CD1 4.45Å; K40-F62 HydrophobicContact CB-CE1 4.17Å; K40-F62 HydrophobicContact CG-CE1 4.43Å; K40-F62 HydrophobicContact CG-CZ 4.36Å; F62-M70 WeakPolarHBondContact O-CA 3.43Å; F62-C71 PolarHBondContact N-O 3.15Å; F62-C71 PolarHBondContact O-N 3.45Å; F62-E73 HydrophobicContact CD2-CB 4.13Å; F62-E73 HydrophobicContact CE2-CB 3.56Å; F62-E73 HydrophobicContact CE2-CG 3.7Å; F62-E73 HydrophobicContact CZ-CB 4.35Å; F62-E73 HydrophobicContact CZ-CG 3.98Å; F62-L76 HydrophobicContact CB-CD1 4.36Å; F62-L76 HydrophobicContact CB-CD2 4.17Å; F62-L76 HydrophobicContact CD1-CD1 3.78Å; F62-L76 HydrophobicContact CD2-CD1 4.08Å; F62-L76 HydrophobicContact CE1-CD1 4Å; F62-L76 HydrophobicContact CE2-CD1 4.32Å; F62-L76 HydrophobicContact CG-CD1 3.81Å; F62-L76 HydrophobicContact CZ-CD1 4.26Å
63	L	93.6	Very high	89.8	Confident	43 Å²	43	48.6 Å²	48.6	23%	0.225	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	129.5	-178	-179.5	64.2	0	0	0	109.8	K39 V41 E65 N68 F69 M70	K39-L63 PolarHBondContact N-O 2.74Å; K39-L63 PolarHBondContact O-N 2.7Å; V41-L63 HydrophobicContact CG1-CB 3.99Å; V41-L63 HydrophobicContact CG1-CD2 4.46Å; V41-L63 HydrophobicContact CG2-CB 3.94Å; L63-E65 PolarHBondContact O-N 3.28Å; L63-N68 HydrophobicContact CD1-CB 4.16Å; L63-N68 WeakPolarHBondContact CD1-O 3.41Å; L63-F69 CarbonylContact C-O 3.55Å; L63-M70 HydrophobicContact CB-CE 4Å; L63-M70 HydrophobicContact CB-SD 4.33Å; L63-M70 HydrophobicContact CD1-CE 3.79Å; L63-M70 HydrophobicContact CG-CE 4.34Å
64	C	92.8	Very high	89.8	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	122.8	169.6	-179.8	0	0	0	0	110.1	H36 C37 F38 V66 N68 F69	H36-C64 HydrophobicContact CB-CB 4.32Å; H36-C64 PolarHBondContact ND1-SG 3.47Å; C37-C64 CarbonylContact O-C 3.43Å; C37-C64 VanDerWaalsContact O-CA 3.25Å; C37-C64 WeakPolarHBondContact O-CA 3.12Å; F38-C64 HydrophobicContact CD1-CB 4.18Å; F38-C64 HydrophobicContact CE1-CB 3.97Å; C64-V66 PolarHBondContact O-N 2.79Å; C64-V66 PolarHBondContact SG-N 3.31Å; C64-N68 VanDerWaalsContact O-CA 3.26Å; C64-N68 WeakPolarHBondContact O-CA 3.43Å; C64-N68 PolarHBondContact O-N 3.5Å; C64-F69 HydrophobicContact CB-CB 3.79Å; C64-F69 PolarHBondContact N-O 2.82Å
65	E	89.4	Confident	89.9	Confident	66 Å²	66	50.9 Å²	50.9	31%	0.308	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-4.6	-178.5	-64.6	-171.3	112	0	0	113.9	C37 K39 L63 R307	C37-E65 PolarHBondContact O-N 3.47Å; K39-E65 HydrophobicContact CB-CG 3.81Å; K39-E65 HydrophobicContact CD-CG 4.26Å; K39-E65 WeakPolarHBondContact CD-OE1 3.41Å; K39-E65 IonicContact NZ-OE1 2.72Å; L63-E65 PolarHBondContact O-N 3.28Å; E65-R307 IonicContact OE1-NH1 3.77Å
66	V	90.2	Very high	89.8	Confident	18 Å²	18	49.2 Å²	49.2	11%	0.109	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-62.9	177.5	178.9	0	0	0	0	110.4	C37 C64 C85 R307 Y310	C37-V66 HydrophobicContact CB-CG2 4.47Å; C64-V66 PolarHBondContact O-N 2.79Å; C64-V66 PolarHBondContact SG-N 3.31Å; V66-C85 HydrophobicContact CG1-CB 4.07Å; V66-R307 HydrophobicContact CG2-CG 4.06Å; V66-Y310 HydrophobicContact CG1-CD1 3.83Å; V66-Y310 WeakPolarHBondContact O-CE1 3.45Å
67	C	91.5	Very high	89.4	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	8.1	-171.7	69.5	0	0	0	0	114.7	H36 F69 T84 V111 C112 R113	H36-C67 VanDerWaalsContact CE1-SG 3.56Å; C67-F69 PolarHBondContact O-N 3.15Å; C67-T84 VanDerWaalsContact CB-OG1 3.24Å; C67-T84 WeakPolarHBondContact CB-OG1 3.38Å; C67-V111 WeakPolarHBondContact CB-O 3.41Å; C67-C112 CarbonylContact O-C 3.58Å; C67-C112 VanDerWaalsContact O-C 3.23Å; C67-R113 WeakPolarHBondContact O-CB 3.28Å; C67-R113 WeakPolarHBondContact O-CD 3.37Å; C67-R113 VanDerWaalsContact O-CG 3.25Å; C67-R113 WeakPolarHBondContact O-CG 3.46Å
68	N	93.1	Very high	89.5	Confident	48 Å²	48	52.2 Å²	52.2	26%	0.257	27%	0.27	S	S	.	.			trans	60	24.3	-175.1	-51.2	-77.1	0	0	0	115.1	L63 C64 M70 C112	L63-N68 HydrophobicContact CD1-CB 4.16Å; L63-N68 WeakPolarHBondContact CD1-O 3.41Å; C64-N68 VanDerWaalsContact O-CA 3.26Å; C64-N68 WeakPolarHBondContact O-CA 3.43Å; C64-N68 PolarHBondContact O-N 3.5Å; N68-M70 PolarHBondContact O-N 2.97Å; N68-M70 VanDerWaalsContact O-N 3.14Å; N68-C112 WeakPolarHBondContact CB-O 3.26Å; N68-C112 PolarHBondContact ND2-O 2.83Å
69	F	93.1	Very high	89.8	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.009	25%	0.245	C	C	.	.			trans	-63	115.6	173.5	-165.4	-73.1	0	0	0	110.5	H36 F38 H50 L63 C64 C67 C71 L79 A81 R113	H36-F69 AromaticContact CE1-CD2 3.68Å; H36-F69 AromaticContact CE1-CG 3.73Å; F38-F69 HydrophobicContact CE1-CD1 4.18Å; F38-F69 HydrophobicContact CZ-CD1 4.2Å; H50-F69 HydrophobicContact CB-CD1 4.05Å; H50-F69 HydrophobicContact CB-CD2 3.97Å; H50-F69 HydrophobicContact CB-CE1 3.67Å; H50-F69 HydrophobicContact CB-CE2 3.59Å; H50-F69 HydrophobicContact CB-CG 4.17Å; H50-F69 HydrophobicContact CB-CZ 3.43Å; H50-F69 VanDerWaalsContact CB-CZ 3.43Å; L63-F69 CarbonylContact C-O 3.55Å; C64-F69 HydrophobicContact CB-CB 3.79Å; C64-F69 PolarHBondContact N-O 2.82Å; C67-F69 PolarHBondContact O-N 3.15Å; F69-C71 HydrophobicContact CD1-CB 4.09Å; F69-C71 HydrophobicContact CE1-CB 3.98Å; F69-L79 HydrophobicContact CD1-CD2 4.33Å; F69-L79 HydrophobicContact CE1-CD2 3.53Å; F69-L79 HydrophobicContact CE2-CD2 4.44Å; F69-L79 HydrophobicContact CZ-CD2 3.59Å; F69-A81 HydrophobicContact CE2-CB 3.63Å; F69-A81 HydrophobicContact CZ-CB 4.1Å; F69-R113 VanDerWaalsContact CD2-CZ 3.42Å
70	M	93.2	Very high	89.8	Confident	17 Å²	17	51.4 Å²	51.4	8%	0.084	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	130.9	176	-173.7	65.1	70.9	0	0	111.3	V41 L43 T47 C49 H50 F62 L63 N68	V41-M70 HydrophobicContact CG2-CE 4.15Å; V41-M70 HydrophobicContact CG2-SD 4.39Å; L43-M70 HydrophobicContact CD2-CE 3.75Å; L43-M70 HydrophobicContact CD2-SD 4.19Å; T47-M70 HydrophobicContact CG2-CE 3.84Å; T47-M70 HydrophobicContact CG2-CG 3.63Å; T47-M70 HydrophobicContact CG2-SD 4.24Å; C49-M70 CarbonylContact C-O 3.56Å; C49-M70 WeakPolarHBondContact CA-O 3.41Å; H50-M70 PolarHBondContact CE1-N 2.89Å; H50-M70 PolarHBondContact N-O 3.23Å; H50-M70 WeakPolarHBondContact ND1-CB 3.31Å; H50-M70 PolarHBondContact ND1-N 2.77Å; H50-M70 PolarHBondContact ND1-O 3.44Å; F62-M70 WeakPolarHBondContact O-CA 3.43Å; L63-M70 HydrophobicContact CB-CE 4Å; L63-M70 HydrophobicContact CB-SD 4.33Å; L63-M70 HydrophobicContact CD1-CE 3.79Å; L63-M70 HydrophobicContact CG-CE 4.34Å; N68-M70 PolarHBondContact O-N 2.97Å; N68-M70 VanDerWaalsContact O-N 3.14Å
71	C	91.9	Very high	89.7	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	147.5	-175.6	-164.4	0	0	0	0	112.8	F38 F62 F69 C75 L76	F38-C71 HydrophobicContact CE1-CB 4.09Å; F38-C71 HydrophobicContact CZ-CB 4.41Å; F62-C71 PolarHBondContact N-O 3.15Å; F62-C71 PolarHBondContact O-N 3.45Å; F69-C71 HydrophobicContact CD1-CB 4.09Å; F69-C71 HydrophobicContact CE1-CB 3.98Å; C71-C75 WeakPolarHBondContact SG-CB 3.22Å; C71-L76 HydrophobicContact CB-CD2 4.2Å
72	H	91.3	Very high	89.5	Confident	16 Å²	16	49.5 Å²	49.5	7%	0.074	23%	0.234	C	C	.	.			trans	-69.3	155.7	162.7	-56.6	104	0	0	0	110.5	C49 C52 F55 V56 K74 C75 L76	C49-H72 WeakPolarHBondContact CB-CE1 3.49Å; C49-H72 VanDerWaalsContact CB-ND1 3.33Å; C49-H72 WeakPolarHBondContact CB-ND1 3.31Å; C52-H72 PolarHBondContact SG-CE1 2.86Å; F55-H72 PolarHBondContact O-NE2 3.02Å; V56-H72 WeakPolarHBondContact CA-NE2 3.4Å; H72-K74 VanDerWaalsContact C-N 3.32Å; H72-K74 HydrophobicContact CB-CG 3.83Å; H72-K74 PolarHBondContact O-N 2.85Å; H72-C75 HydrophobicContact CB-CB 4.14Å; H72-C75 PolarHBondContact O-N 3.4Å; H72-C75 VanDerWaalsContact O-N 3.1Å; H72-L76 PolarHBondContact O-N 2.92Å
73	E	89.6	Confident	89.4	Confident	133 Å²	133	48.1 Å²	48.1	62%	0.621	23%	0.228	S	C	*	.	H	α-helix	trans	-54.4	-46.8	170.3	-164.7	166.7	-177.4	0	0	112.4	F62 C75 L76	F62-E73 HydrophobicContact CD2-CB 4.13Å; F62-E73 HydrophobicContact CE2-CB 3.56Å; F62-E73 HydrophobicContact CE2-CG 3.7Å; F62-E73 HydrophobicContact CZ-CB 4.35Å; F62-E73 HydrophobicContact CZ-CG 3.98Å; E73-C75 PolarHBondContact O-N 3.31Å; E73-L76 WeakPolarHBondContact O-CB 3.15Å; E73-L76 PolarHBondContact O-N 3.15Å
74	K	88.3	Confident	89.3	Confident	144 Å²	144	46.7 Å²	46.7	63%	0.626	22%	0.221	S	C	*	.	H	α-helix	trans	-60.8	-33.6	178.3	67.9	-178.1	-178.3	179.5	0	113.1	H72 L76	H72-K74 VanDerWaalsContact C-N 3.32Å; H72-K74 HydrophobicContact CB-CG 3.83Å; H72-K74 PolarHBondContact O-N 2.85Å; K74-L76 VanDerWaalsContact C-N 3.33Å
75	C	88.9	Confident	89	Confident	10 Å²	10	46.9 Å²	46.9	7%	0.068	22%	0.223	C	C	.	.	H	α-helix	trans	-79.8	-17.8	-176.5	-68.6	0	0	0	0	111.8	C71 H72 E73 K77 T78 L79	C71-C75 WeakPolarHBondContact SG-CB 3.22Å; H72-C75 HydrophobicContact CB-CB 4.14Å; H72-C75 PolarHBondContact O-N 3.4Å; H72-C75 VanDerWaalsContact O-N 3.1Å; E73-C75 PolarHBondContact O-N 3.31Å; C75-K77 VanDerWaalsContact C-N 3.25Å; C75-K77 PolarHBondContact O-N 2.73Å; C75-T78 PolarHBondContact O-N 3.28Å; C75-T78 VanDerWaalsContact O-N 3.13Å; C75-T78 PolarHBondContact O-OG1 3.44Å; C75-L79 PolarHBondContact O-N 2.77Å
76	L	87.3	Confident	89.1	Confident	33 Å²	33	46.6 Å²	46.6	17%	0.173	22%	0.222	C	C	.	.	H	α-helix	trans	-56.5	-39.9	178.1	-68.9	173.1	0	0	0	112.3	F38 F62 C71 H72 E73 K74 T78 L79	F38-L76 HydrophobicContact CD1-CD2 4.04Å; F38-L76 HydrophobicContact CD2-CD2 3.57Å; F38-L76 HydrophobicContact CE1-CD2 4.1Å; F38-L76 HydrophobicContact CE2-CD2 3.61Å; F38-L76 HydrophobicContact CG-CD2 3.8Å; F38-L76 HydrophobicContact CZ-CD2 3.9Å; F62-L76 HydrophobicContact CB-CD1 4.36Å; F62-L76 HydrophobicContact CB-CD2 4.17Å; F62-L76 HydrophobicContact CD1-CD1 3.78Å; F62-L76 HydrophobicContact CD2-CD1 4.08Å; F62-L76 HydrophobicContact CE1-CD1 4Å; F62-L76 HydrophobicContact CE2-CD1 4.32Å; F62-L76 HydrophobicContact CG-CD1 3.81Å; F62-L76 HydrophobicContact CZ-CD1 4.26Å; C71-L76 HydrophobicContact CB-CD2 4.2Å; H72-L76 PolarHBondContact O-N 2.92Å; E73-L76 WeakPolarHBondContact O-CB 3.15Å; E73-L76 PolarHBondContact O-N 3.15Å; K74-L76 VanDerWaalsContact C-N 3.33Å; L76-T78 VanDerWaalsContact C-N 3.27Å; L76-T78 PolarHBondContact O-N 3.42Å; L76-L79 HydrophobicContact CD2-CD1 3.93Å
77	K	82.4	Confident	89	Confident	200 Å²	200	47 Å²	47	87%	0.87	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-20.3	-177.4	-62.9	-176.4	-179.2	-179	0	113.5	C75	C75-K77 VanDerWaalsContact C-N 3.25Å; C75-K77 PolarHBondContact O-N 2.73Å
78	T	82.7	Confident	88.9	Confident	79 Å²	79	47.3 Å²	47.3	49%	0.485	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.8	9.9	-176.4	56.4	0	0	0	0	113	C75 L76 R80	C75-T78 PolarHBondContact O-N 3.28Å; C75-T78 VanDerWaalsContact O-N 3.13Å; C75-T78 PolarHBondContact O-OG1 3.44Å; L76-T78 VanDerWaalsContact C-N 3.27Å; L76-T78 PolarHBondContact O-N 3.42Å; T78-R80 PolarHBondContact O-N 2.85Å
79	L	84.8	Confident	88.5	Confident	12 Å²	12	47.3 Å²	47.3	6%	0.063	23%	0.233	C	C	.	.			trans	-62.3	126.2	-179.2	-93.3	164.5	0	0	0	111.5	F38 F69 C75 L76	F38-L79 HydrophobicContact CE2-CD1 3.42Å; F38-L79 VanDerWaalsContact CE2-CD1 3.42Å; F38-L79 HydrophobicContact CZ-CD1 3.38Å; F69-L79 HydrophobicContact CD1-CD2 4.33Å; F69-L79 HydrophobicContact CE1-CD2 3.53Å; F69-L79 HydrophobicContact CE2-CD2 4.44Å; F69-L79 HydrophobicContact CZ-CD2 3.59Å; C75-L79 PolarHBondContact O-N 2.77Å; L76-L79 HydrophobicContact CD2-CD1 3.93Å
80	R	85.9	Confident	88.1	Confident	149 Å²	149	53.3 Å²	53.3	56%	0.562	26%	0.259	S	S	*	.			trans	-122.7	-13.9	173.1	-63.6	-63.7	-171.1	141.5	1.1	113.1	T78 V82	T78-R80 PolarHBondContact O-N 2.85Å; R80-V82 PolarHBondContact O-N 3.02Å
81	A	86.8	Confident	87.8	Confident	7 Å²	7	52.9 Å²	52.9	6%	0.058	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-68.7	125.4	175.3	0	0	0	0	0	109.7	H36 F69 A198	H36-A81 PolarHBondContact CD2-O 3.06Å; H36-A81 PolarHBondContact NE2-O 3.36Å; F69-A81 HydrophobicContact CE2-CB 3.63Å; F69-A81 HydrophobicContact CZ-CB 4.1Å; A81-A198 HydrophobicContact CB-CB 4.47Å
82	V	89.3	Confident	87.2	Confident	34 Å²	34	57 Å²	57	21%	0.206	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-80.2	140.3	-177.4	-179.1	0	0	0	0	109.5	M34 R80 M86 K90	M34-V82 HydrophobicContact SD-CG2 4Å; R80-V82 PolarHBondContact O-N 3.02Å; V82-M86 HydrophobicContact CG1-CB 3.63Å; V82-K90 HydrophobicContact CG1-CG 4.21Å; V82-K90 HydrophobicContact CG2-CG 4.2Å
83	C	91.6	Very high	86.8	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-68.1	146.4	174.2	-163.3	0	0	0	0	110.5	M34 G35 H36 C85 M86 A87	M34-C83 WeakPolarHBondContact O-CB 3.4Å; M34-C83 PolarHBondContact O-N 2.88Å; G35-C83 VanDerWaalsContact C-CB 3.48Å; H36-C83 HydrophobicContact CB-CB 4.46Å; H36-C83 VanDerWaalsContact CE1-CA 3.47Å; H36-C83 WeakPolarHBondContact CE1-CA 3.33Å; H36-C83 PolarHBondContact ND1-SG 2.61Å; H36-C83 PolarHBondContact NE2-N 3.25Å; C83-C85 PolarHBondContact O-N 2.9Å; C83-C85 VanDerWaalsContact O-N 3.09Å; C83-C85 VanDerWaalsContact SG-SG 3.66Å; C83-M86 CarbonylContact O-C 3.42Å; C83-M86 PolarHBondContact O-N 2.82Å; C83-A87 PolarHBondContact O-N 2.83Å
84	T	90.3	Very high	86.7	Confident	12 Å²	12	52 Å²	52	7%	0.074	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-34.9	179.9	-51.6	0	0	0	0	112.9	C67 M86 A87 P88 V111 Y310	C67-T84 VanDerWaalsContact CB-OG1 3.24Å; C67-T84 WeakPolarHBondContact CB-OG1 3.38Å; T84-M86 VanDerWaalsContact C-N 3.27Å; T84-M86 PolarHBondContact O-N 2.89Å; T84-A87 WeakPolarHBondContact O-CB 3.45Å; T84-A87 PolarHBondContact O-N 2.85Å; T84-P88 WeakPolarHBondContact O-CD 3.48Å; T84-V111 HydrophobicContact CG2-CB 4.09Å; T84-V111 HydrophobicContact CG2-CG1 3.68Å; T84-V111 HydrophobicContact CG2-CG2 4.35Å; T84-V111 PolarHBondContact OG1-O 3.04Å; T84-Y310 HydrophobicContact CG2-CD1 4.08Å; T84-Y310 HydrophobicContact CG2-CG 4.45Å
85	C	88.5	Confident	86.7	Confident	5 Å²	5	45.4 Å²	45.4	3%	0.034	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-28.2	177.7	59.5	0	0	0	0	114.3	V66 C83 Y310 P312 N437	V66-C85 HydrophobicContact CG1-CB 4.07Å; C83-C85 PolarHBondContact O-N 2.9Å; C83-C85 VanDerWaalsContact O-N 3.09Å; C83-C85 VanDerWaalsContact SG-SG 3.66Å; C85-Y310 WeakPolarHBondContact CA-O 3.45Å; C85-Y310 WeakPolarHBondContact CB-O 3.33Å; C85-P312 HydrophobicContact CB-CB 4.43Å; C85-N437 PolarHBondContact O-ND2 3.05Å; C85-N437 VanDerWaalsContact O-ND2 3.11Å
86	M	89.6	Confident	86.9	Confident	60 Å²	60	45 Å²	45	30%	0.296	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-9.4	178.6	-69.6	-58.9	-66.5	0	0	112.7	V82 C83 T84 P88 S89 P312	V82-M86 HydrophobicContact CG1-CB 3.63Å; C83-M86 CarbonylContact O-C 3.42Å; C83-M86 PolarHBondContact O-N 2.82Å; T84-M86 VanDerWaalsContact C-N 3.27Å; T84-M86 PolarHBondContact O-N 2.89Å; M86-P88 VanDerWaalsContact C-CD 3.46Å; M86-P88 VanDerWaalsContact C-N 3.34Å; M86-S89 WeakPolarHBondContact O-CB 3.36Å; M86-S89 PolarHBondContact O-N 2.9Å; M86-S89 PolarHBondContact O-OG 2.94Å; M86-P312 HydrophobicContact CG-CB 4.46Å; M86-P312 HydrophobicContact SD-CB 3.43Å; M86-P312 WeakPolarHBondContact SD-CB 3.36Å; M86-P312 HydrophobicContact SD-CG 4.16Å
87	A	88.8	Confident	87.1	Confident	27 Å²	27	43.7 Å²	43.7	22%	0.223	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-56.5	-39.3	-178	0	0	0	0	0	113.2	C83 T84 S89 K90 C140	C83-A87 PolarHBondContact O-N 2.83Å; T84-A87 WeakPolarHBondContact O-CB 3.45Å; T84-A87 PolarHBondContact O-N 2.85Å; A87-S89 PolarHBondContact O-N 3.04Å; A87-S89 VanDerWaalsContact O-N 3.16Å; A87-K90 PolarHBondContact O-N 3.21Å; A87-C140 WeakPolarHBondContact CB-SG 3.36Å
88	P	88.9	Confident	87.7	Confident	6 Å²	6	34.1 Å²	34.1	4%	0.039	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-58.5	-31.6	175.6	-27.2	36.4	0	0	0	113.1	T84 M86 K90 V91 C140 N437 R440	T84-P88 WeakPolarHBondContact O-CD 3.48Å; M86-P88 VanDerWaalsContact C-CD 3.46Å; M86-P88 VanDerWaalsContact C-N 3.34Å; P88-K90 PolarHBondContact O-N 3.47Å; P88-V91 PolarHBondContact O-N 3.46Å; P88-C140 WeakPolarHBondContact CD-SG 3.37Å; P88-N437 WeakPolarHBondContact CB-O 3.37Å; P88-R440 PolarHBondContact O-NH2 3.36Å
89	S	85.6	Confident	88.1	Confident	47 Å²	47	31.6 Å²	31.6	33%	0.329	16%	0.159	S	C	.	.	G	3₁₀ helix	trans	-68.1	-13.3	179.2	77.5	0	0	0	0	113.9	M86 A87 R440	M86-S89 WeakPolarHBondContact O-CB 3.36Å; M86-S89 PolarHBondContact O-N 2.9Å; M86-S89 PolarHBondContact O-OG 2.94Å; A87-S89 PolarHBondContact O-N 3.04Å; A87-S89 VanDerWaalsContact O-N 3.16Å; S89-R440 VanDerWaalsContact CA-NH2 3.29Å
90	K	85.7	Confident	88.2	Confident	128 Å²	128	31.4 Å²	31.4	56%	0.557	16%	0.16	S	C	*	.	G	3₁₀ helix	trans	-97.8	-8.8	179	-56.5	-57.4	-177.6	-174.9	0	113.3	V82 A87 P88 Q92	V82-K90 HydrophobicContact CG1-CG 4.21Å; V82-K90 HydrophobicContact CG2-CG 4.2Å; A87-K90 PolarHBondContact O-N 3.21Å; P88-K90 PolarHBondContact O-N 3.47Å; K90-Q92 PolarHBondContact O-N 3.22Å
91	V	85.9	Confident	88.2	Confident	9 Å²	9	28.5 Å²	28.5	6%	0.055	16%	0.161	C	C	.	.			trans	-75	110.7	177.8	-177.7	0	0	0	0	109.2	P88 P94 C140 A141 D142 M405	P88-V91 PolarHBondContact O-N 3.46Å; V91-P94 HydrophobicContact CG1-CB 4.11Å; V91-C140 HydrophobicContact CG2-CB 3.86Å; V91-A141 WeakPolarHBondContact CG1-O 3.15Å; V91-D142 HydrophobicContact CG2-CB 4.34Å; V91-M405 HydrophobicContact CB-CE 4.16Å; V91-M405 HydrophobicContact CB-SD 4.18Å; V91-M405 HydrophobicContact CG1-CE 4.43Å; V91-M405 HydrophobicContact CG1-SD 3.83Å
92	Q	80.2	Confident	87.8	Confident	87 Å²	87	29.2 Å²	29.2	41%	0.407	17%	0.167	S	C	.	.	S	Bend	trans	-93.9	-34.5	174.8	-68.7	177.3	-21.9	0	0	112.5	K90 R363 Y442	K90-Q92 PolarHBondContact O-N 3.22Å; Q92-R363 PolarHBondContact NE2-O 2.85Å; Q92-R363 PolarHBondContact OE1-O 3.03Å; Q92-R363 VanDerWaalsContact OE1-O 3.13Å; Q92-Y442 PolarHBondContact O-OH 2.87Å
93	V	81.7	Confident	87	Confident	31 Å²	31	30.1 Å²	30.1	19%	0.188	18%	0.183	C	C	.	.	S	Bend	trans	-126.3	101.4	178.4	-179.5	0	0	0	0	107.4	V95 L152 R363	V93-V95 HydrophobicContact CG1-CG2 4.27Å; V93-V95 PolarHBondContact O-N 2.86Å; V93-L152 HydrophobicContact CG1-CD1 3.78Å; V93-L152 HydrophobicContact CG2-CD2 4.03Å; V93-R363 HydrophobicContact CG2-CG 3.92Å
94	P	87.7	Confident	85.8	Confident	11 Å²	11	40 Å²	40	7%	0.071	23%	0.229	C	C	.	.			trans	-71.8	125.5	-177.1	24.9	-31	0	0	0	111.3	V91 A141 V403 M405 V410 Y442	V91-P94 HydrophobicContact CG1-CB 4.11Å; P94-A141 CarbonylContact C-O 3.55Å; P94-A141 VanDerWaalsContact CA-O 3.27Å; P94-A141 WeakPolarHBondContact CA-O 3.26Å; P94-A141 HydrophobicContact CB-CB 4.29Å; P94-V403 HydrophobicContact CG-CG1 3.91Å; P94-M405 HydrophobicContact CB-CB 4.08Å; P94-M405 HydrophobicContact CB-CG 3.56Å; P94-M405 HydrophobicContact CB-SD 3.64Å; P94-M405 HydrophobicContact CG-CG 4Å; P94-M405 HydrophobicContact CG-SD 3.94Å; P94-V410 HydrophobicContact CB-CG1 3.85Å; P94-V410 HydrophobicContact CB-CG2 3.85Å; P94-V410 HydrophobicContact CG-CG1 3.84Å; P94-Y442 WeakPolarHBondContact CD-OH 3.41Å
95	V	89	Confident	84.8	Confident	7 Å²	7	46.8 Å²	46.8	4%	0.042	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-135.2	116.7	175.6	-171.5	0	0	0	0	108.4	V93 A141 D142 C143 C145	V93-V95 HydrophobicContact CG1-CG2 4.27Å; V93-V95 PolarHBondContact O-N 2.86Å; V95-A141 PolarHBondContact N-O 3.33Å; V95-A141 CarbonylContact O-C 3.59Å; V95-A141 WeakPolarHBondContact O-CA 3.37Å; V95-D142 PolarHBondContact O-N 3.07Å; V95-C143 HydrophobicContact CB-CB 4.13Å; V95-C143 VanDerWaalsContact CB-O 3.24Å; V95-C143 WeakPolarHBondContact CB-O 3.29Å; V95-C143 HydrophobicContact CG1-CB 3.88Å; V95-C143 WeakPolarHBondContact O-CB 3.06Å; V95-C143 PolarHBondContact O-N 3.34Å; V95-C145 HydrophobicContact CG2-CB 4.18Å
96	A	91.9	Very high	84.1	Confident	2 Å²	2	50.9 Å²	50.9	2%	0.017	28%	0.275	C	S	.	.			trans	-65.6	152	178	0	0	0	0	0	113.1	C143 K232 K408 V410	A96-C143 WeakPolarHBondContact O-CB 3.48Å; A96-K232 HydrophobicContact CB-CG 4.1Å; A96-K408 VanDerWaalsContact CB-C 3.42Å; A96-K408 WeakPolarHBondContact CB-O 3.49Å; A96-V410 HydrophobicContact CB-CG2 4.2Å
97	H	92.9	Very high	84	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.019	28%	0.276	C	S	.	.			trans	-85.5	146.1	175.1	-66.5	-74.2	0	0	0	112.1	F99 C124 C127 C140 D142 C143 S407	H97-F99 HydrophobicContact CB-CD2 3.87Å; H97-F99 HydrophobicContact CB-CE1 4.29Å; H97-F99 HydrophobicContact CB-CE2 3.58Å; H97-F99 HydrophobicContact CB-CG 4.36Å; H97-F99 HydrophobicContact CB-CZ 3.81Å; H97-F99 PolarHBondContact O-N 2.86Å; H97-C124 HydrophobicContact CB-CB 4.19Å; H97-C127 VanDerWaalsContact CE1-SG 3.58Å; H97-C127 PolarHBondContact ND1-SG 2.81Å; H97-C140 PolarHBondContact CD2-O 3.03Å; H97-C140 VanDerWaalsContact CD2-O 3.31Å; H97-C140 PolarHBondContact NE2-O 2.97Å; H97-D142 IonicContact CE1-OD1 2.9Å; H97-D142 PolarHBondContact CE1-OD1 3.2Å; H97-D142 IonicContact NE2-OD1 3.17Å; H97-D142 PolarHBondContact NE2-OD1 3.22Å; H97-D142 VanDerWaalsContact NE2-OD1 3.14Å; H97-C143 WeakPolarHBondContact ND1-CB 3.3Å; H97-S407 WeakPolarHBondContact CB-O 3.33Å; H97-S407 PolarHBondContact N-O 3.32Å
98	C	93.2	Very high	84.1	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.271	C	S	.	.			trans	-93.3	74.2	172.1	-67.8	0	0	0	0	110.6	C124 E125 V126 M233 I238	C98-C124 PolarHBondContact N-SG 2.86Å; C98-C124 CarbonylContact O-C 3.57Å; C98-C124 VanDerWaalsContact O-CA 3.27Å; C98-C124 WeakPolarHBondContact O-CA 3.13Å; C98-E125 HydrophobicContact CB-CB 4.48Å; C98-E125 PolarHBondContact O-N 2.85Å; C98-V126 HydrophobicContact CB-CG2 4.02Å; C98-M233 VanDerWaalsContact CA-SD 3.53Å; C98-M233 HydrophobicContact CB-CG 4.41Å; C98-M233 HydrophobicContact CB-SD 3.35Å; C98-M233 WeakPolarHBondContact CB-SD 3.47Å; C98-I238 HydrophobicContact CB-CD1 3.81Å
99	F	91.8	Very high	84.2	Confident	25 Å²	25	51.8 Å²	51.8	11%	0.11	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	129.4	-176.7	-75.2	-60.7	0	0	0	112.6	H97 L122 C124 L129 V131 K408	H97-F99 HydrophobicContact CB-CD2 3.87Å; H97-F99 HydrophobicContact CB-CE1 4.29Å; H97-F99 HydrophobicContact CB-CE2 3.58Å; H97-F99 HydrophobicContact CB-CG 4.36Å; H97-F99 HydrophobicContact CB-CZ 3.81Å; H97-F99 PolarHBondContact O-N 2.86Å; F99-L122 HydrophobicContact CB-CB 4.32Å; F99-L122 HydrophobicContact CB-CD1 4.33Å; F99-L122 HydrophobicContact CD1-CB 3.75Å; F99-L122 HydrophobicContact CE1-CB 4.4Å; F99-L122 HydrophobicContact CG-CB 4.24Å; F99-L122 HydrophobicContact CG-CD1 4.41Å; F99-C124 HydrophobicContact CD1-CB 4.45Å; F99-C124 HydrophobicContact CE1-CB 4.42Å; F99-L129 HydrophobicContact CE1-CD2 3.55Å; F99-L129 HydrophobicContact CZ-CD2 3.49Å; F99-L129 VanDerWaalsContact CZ-CD2 3.49Å; F99-V131 HydrophobicContact CD1-CG2 4.33Å; F99-V131 HydrophobicContact CE1-CG2 3.56Å; F99-V131 HydrophobicContact CZ-CG2 3.8Å; F99-K408 HydrophobicContact CD2-CG 3.98Å
100	G	88.1	Confident	84.5	Confident	8 Å²	8	51 Å²	51	8%	0.082	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	-177.5	163.6	0	0	0	0	0	110.8	A102 L122 R123	G100-A102 PolarHBondContact O-N 3.04Å; G100-L122 CarbonylContact O-C 3.6Å; G100-L122 WeakPolarHBondContact O-CA 3.17Å; G100-R123 PolarHBondContact N-O 2.83Å; G100-R123 PolarHBondContact O-N 2.89Å
101	P	85.4	Confident	84.9	Confident	88 Å²	88	45 Å²	45	57%	0.571	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-57.4	131.9	178	-23.8	33.7	0	0	0	112
102	A	77.9	Confident	85.2	Confident	23 Å²	23	44.8 Å²	44.8	19%	0.19	24%	0.237	C	C	.	.			trans	-77.9	126.9	168.6	0	0	0	0	0	109.1	G100 A121 R123	G100-A102 PolarHBondContact O-N 3.04Å; A102-A121 VanDerWaalsContact CB-C 3.48Å; A102-A121 HydrophobicContact CB-CB 3.66Å; A102-A121 VanDerWaalsContact CB-O 3.23Å; A102-A121 WeakPolarHBondContact CB-O 3.4Å; A102-A121 PolarHBondContact N-O 2.66Å; A102-R123 HydrophobicContact CB-CB 3.95Å
103	G	71.8	Confident	85.7	Confident	53 Å²	53	41.2 Å²	41.2	55%	0.546	22%	0.219	S	C	.	.			trans	-63.3	177.1	171.2	0	0	0	0	0	112.3	K105	G103-K105 PolarHBondContact O-N 3.24Å
104	Q	66.2	Low	86.1	Confident	207 Å²	207	43.7 Å²	43.7	97%	0.967	23%	0.227	S	C	*	.	S	Bend	trans	-74.8	13.6	-170.5	-62.4	-172.1	-16.8	0	0	116.1
105	K	70.8	Confident	86.2	Confident	154 Å²	154	46.6 Å²	46.6	67%	0.67	24%	0.24	S	C	*	.	S	Bend	trans	-79.2	138.6	-177.2	-70.9	-174.9	-179.9	178.1	0	111.1	G103 R107	G103-K105 PolarHBondContact O-N 3.24Å; K105-R107 PolarHBondContact O-N 2.86Å; K105-R107 VanDerWaalsContact O-N 3.14Å
106	K	72.6	Confident	86.1	Confident	91 Å²	91	46.8 Å²	46.8	40%	0.396	24%	0.241	S	C	.	.			trans	-56.1	114.8	171.3	-162.9	168.2	-172.9	179.7	0	111	E117	K106-E117 HydrophobicContact CB-CG 4.37Å; K106-E117 WeakPolarHBondContact CB-OE1 3.44Å; K106-E117 WeakPolarHBondContact CD-OE1 3.33Å; K106-E117 HydrophobicContact CG-CG 4.16Å; K106-E117 WeakPolarHBondContact CG-OE1 3.35Å
107	R	87.3	Confident	85.5	Confident	87 Å²	87	51.7 Å²	51.7	33%	0.328	26%	0.264	S	S	.	.			trans	-140.5	173.5	177	-63.5	-65.2	-173.3	-171.7	6.2	109.5	K105 Q115 T116 H130	K105-R107 PolarHBondContact O-N 2.86Å; K105-R107 VanDerWaalsContact O-N 3.14Å; R107-Q115 CarbonylContact O-C 3.51Å; R107-Q115 WeakPolarHBondContact O-CA 3.46Å; R107-T116 PolarHBondContact O-N 2.77Å; R107-T116 PolarHBondContact O-OG1 3.41Å; R107-T116 VanDerWaalsContact O-OG1 3.13Å; R107-H130 HydrophobicContact CB-CB 4.15Å
108	F	90.9	Very high	84.2	Confident	26 Å²	26	56 Å²	56	11%	0.114	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-115.2	140.6	178.1	-63.2	-86.9	0	0	0	109.9	C110 R113 K114 Q115 S181 E182 L184	F108-C110 PolarHBondContact O-N 2.97Å; F108-R113 WeakPolarHBondContact CD1-O 3.39Å; F108-K114 WeakPolarHBondContact CA-O 3.37Å; F108-Q115 HydrophobicContact CD1-CG 3.83Å; F108-Q115 HydrophobicContact CE1-CG 3.39Å; F108-Q115 HydrophobicContact CZ-CG 4.02Å; F108-S181 WeakPolarHBondContact CZ-O 3.27Å; F108-E182 WeakPolarHBondContact CE1-O 3.41Å; F108-E182 WeakPolarHBondContact CZ-O 3.44Å; F108-L184 HydrophobicContact CB-CB 3.77Å; F108-L184 HydrophobicContact CB-CD1 4.23Å; F108-L184 HydrophobicContact CB-CG 4.43Å; F108-L184 HydrophobicContact CG-CB 4.13Å
109	C	92.4	Very high	82.9	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	33%	0.329	C	S	.	.			trans	-70.5	125.5	173.6	176.6	0	0	0	0	109.7	V111 C112 R113 K114 T116 H130 H132 C135	C109-V111 PolarHBondContact O-N 3.42Å; C109-V111 VanDerWaalsContact O-N 3.17Å; C109-C112 VanDerWaalsContact CB-SG 3.56Å; C109-C112 VanDerWaalsContact SG-SG 3.62Å; C109-R113 WeakPolarHBondContact O-CA 3.42Å; C109-R113 PolarHBondContact O-N 2.77Å; C109-K114 PolarHBondContact N-O 2.94Å; C109-T116 HydrophobicContact CB-CG2 4.1Å; C109-H130 CarbonylContact C-O 3.51Å; C109-H130 WeakPolarHBondContact CA-O 3.49Å; C109-H132 WeakPolarHBondContact CB-ND1 3.39Å; C109-H132 PolarHBondContact SG-N 2.81Å; C109-C135 WeakPolarHBondContact SG-CB 3.41Å; C109-C135 VanDerWaalsContact SG-SG 3.63Å
110	C	91.9	Very high	82.5	Confident	29 Å²	29	62.9 Å²	62.9	20%	0.196	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-10.9	-178.5	-63.3	0	0	0	0	113.9	F108 L129 H130 V131 L184	F108-C110 PolarHBondContact O-N 2.97Å; C110-L129 HydrophobicContact CB-CD1 3.87Å; C110-L129 HydrophobicContact CB-CG 4.09Å; C110-H130 PolarHBondContact N-O 2.92Å; C110-H130 PolarHBondContact SG-O 2.79Å; C110-V131 HydrophobicContact CB-CG1 4.4Å; C110-L184 HydrophobicContact CB-CD2 4.49Å
111	V	92.5	Very high	82.6	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.012	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-57.4	-178.9	171.9	0	0	0	0	110.5	C67 T84 C109 V131 C135 F138 Y310	C67-V111 WeakPolarHBondContact CB-O 3.41Å; T84-V111 HydrophobicContact CG2-CB 4.09Å; T84-V111 HydrophobicContact CG2-CG1 3.68Å; T84-V111 HydrophobicContact CG2-CG2 4.35Å; T84-V111 PolarHBondContact OG1-O 3.04Å; C109-V111 PolarHBondContact O-N 3.42Å; C109-V111 VanDerWaalsContact O-N 3.17Å; V111-V131 HydrophobicContact CG2-CG1 3.93Å; V111-C135 HydrophobicContact CB-CB 3.81Å; V111-C135 HydrophobicContact CG1-CB 3.96Å; V111-C135 HydrophobicContact CG2-CB 4.15Å; V111-F138 HydrophobicContact CG1-CB 3.76Å; V111-F138 HydrophobicContact CG2-CB 4.47Å; V111-Y310 HydrophobicContact CG1-CD1 4.3Å; V111-Y310 HydrophobicContact CG1-CD2 4.29Å; V111-Y310 HydrophobicContact CG1-CE1 3.98Å; V111-Y310 HydrophobicContact CG1-CE2 3.99Å; V111-Y310 HydrophobicContact CG1-CG 4.45Å
112	C	92.2	Very high	82.9	Confident	6 Å²	6	60.7 Å²	60.7	4%	0.041	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-4.7	-175.5	78.3	0	0	0	0	114	C67 N68 C109 K114 H132 Y310	C67-C112 CarbonylContact O-C 3.58Å; C67-C112 VanDerWaalsContact O-C 3.23Å; N68-C112 WeakPolarHBondContact CB-O 3.26Å; N68-C112 PolarHBondContact ND2-O 2.83Å; C109-C112 VanDerWaalsContact CB-SG 3.56Å; C109-C112 VanDerWaalsContact SG-SG 3.62Å; C112-K114 PolarHBondContact O-N 3.12Å; C112-H132 PolarHBondContact SG-CE1 2.88Å; C112-H132 PolarHBondContact SG-ND1 2.86Å; C112-Y310 VanDerWaalsContact CB-OH 3.26Å; C112-Y310 WeakPolarHBondContact CB-OH 3.41Å
113	R	91.9	Very high	83.5	Confident	11 Å²	11	62 Å²	62	4%	0.042	34%	0.339	C	S	.	.			trans	61.8	0.8	179.8	-56.8	-179.3	175.1	-88.3	-2.6	116.5	C67 F69 F108 C109 E163 L184	C67-R113 WeakPolarHBondContact O-CB 3.28Å; C67-R113 WeakPolarHBondContact O-CD 3.37Å; C67-R113 VanDerWaalsContact O-CG 3.25Å; C67-R113 WeakPolarHBondContact O-CG 3.46Å; F69-R113 VanDerWaalsContact CD2-CZ 3.42Å; F108-R113 WeakPolarHBondContact CD1-O 3.39Å; C109-R113 WeakPolarHBondContact O-CA 3.42Å; C109-R113 PolarHBondContact O-N 2.77Å; R113-E163 IonicContact CZ-OE2 3.75Å; R113-E163 VanDerWaalsContact CZ-OE2 3.22Å; R113-E163 IonicContact NH1-OE2 3.82Å; R113-E163 PolarHBondContact NH1-OE2 3.2Å; R113-E163 IonicContact NH2-OE1 3.17Å; R113-E163 PolarHBondContact NH2-OE1 2.65Å; R113-E163 IonicContact NH2-OE2 3.97Å; R113-E163 PolarHBondContact NH2-OE2 2.97Å; R113-L184 HydrophobicContact CG-CD2 4.39Å
114	K	90.6	Very high	84.5	Confident	83 Å²	83	59.4 Å²	59.4	36%	0.361	31%	0.313	S	S	.	.	S	Bend	trans	-76.3	161.2	173.9	-63.2	-173	174	-163.5	0	111.9	F108 C109 C112 E261	F108-K114 WeakPolarHBondContact CA-O 3.37Å; C109-K114 PolarHBondContact N-O 2.94Å; C112-K114 PolarHBondContact O-N 3.12Å; K114-E261 IonicContact NZ-OE2 3.55Å; K114-E261 PolarHBondContact NZ-OE2 2.79Å
115	Q	89.4	Confident	85.6	Confident	73 Å²	73	50.3 Å²	50.3	34%	0.341	27%	0.271	S	S	.	.	B	Isolated β-bridge	trans	-65.4	146.6	175.7	-68.7	173.7	7.1	0	0	111	R107 F108 H132	R107-Q115 CarbonylContact O-C 3.51Å; R107-Q115 WeakPolarHBondContact O-CA 3.46Å; F108-Q115 HydrophobicContact CD1-CG 3.83Å; F108-Q115 HydrophobicContact CE1-CG 3.39Å; F108-Q115 HydrophobicContact CZ-CG 4.02Å; Q115-H132 PolarHBondContact O-CE1 3.2Å; Q115-H132 PolarHBondContact O-NE2 3.27Å
116	T	87.3	Confident	86.6	Confident	10 Å²	10	43 Å²	43	6%	0.061	24%	0.239	C	C	.	.			trans	-92.7	-0.2	-178.2	57.5	0	0	0	0	113.8	R107 C109 S119 A121	R107-T116 PolarHBondContact O-N 2.77Å; R107-T116 PolarHBondContact O-OG1 3.41Å; R107-T116 VanDerWaalsContact O-OG1 3.13Å; C109-T116 HydrophobicContact CB-CG2 4.1Å; T116-S119 PolarHBondContact O-OG 3.26Å; T116-S119 VanDerWaalsContact O-OG 3.09Å; T116-A121 HydrophobicContact CG2-CB 4.26Å
117	E	77.6	Confident	87.4	Confident	105 Å²	105	38.7 Å²	38.7	49%	0.491	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	145	177.4	-67.9	-179.8	165.8	0	0	111.5	K106 S119	K106-E117 HydrophobicContact CB-CG 4.37Å; K106-E117 WeakPolarHBondContact CB-OE1 3.44Å; K106-E117 WeakPolarHBondContact CD-OE1 3.33Å; K106-E117 HydrophobicContact CG-CG 4.16Å; K106-E117 WeakPolarHBondContact CG-OE1 3.35Å; E117-S119 VanDerWaalsContact C-N 3.28Å; E117-S119 PolarHBondContact O-N 3.35Å
118	G	67.3	Low	87.5	Confident	96 Å²	96	37 Å²	37	99%	0.99	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.3	9	176.3	0	0	0	0	0	116.2
119	S	65.6	Low	87.5	Confident	57 Å²	57	36.2 Å²	36.2	40%	0.399	21%	0.213	S	C	.	.	S	Bend	trans	-135.2	158.7	-179.6	53.1	0	0	0	0	111.5	T116 E117 A121 H132	T116-S119 PolarHBondContact O-OG 3.26Å; T116-S119 VanDerWaalsContact O-OG 3.09Å; E117-S119 VanDerWaalsContact C-N 3.28Å; E117-S119 PolarHBondContact O-N 3.35Å; S119-A121 PolarHBondContact O-N 2.68Å; S119-H132 PolarHBondContact OG-CD2 2.8Å; S119-H132 PolarHBondContact OG-NE2 3.08Å
120	T	82.9	Confident	87.5	Confident	112 Å²	112	37.3 Å²	37.3	69%	0.687	22%	0.218	S	C	*	.			trans	-66.7	104.4	170.5	45.1	0	0	0	0	108.6	A133	T120-A133 WeakPolarHBondContact O-CB 3.3Å; T120-A133 PolarHBondContact O-N 3Å
121	A	89.3	Confident	87.5	Confident	13 Å²	13	36 Å²	36	11%	0.107	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	146.1	179.2	0	0	0	0	0	110.7	A102 T116 S119 V131	A102-A121 VanDerWaalsContact CB-C 3.48Å; A102-A121 HydrophobicContact CB-CB 3.66Å; A102-A121 VanDerWaalsContact CB-O 3.23Å; A102-A121 WeakPolarHBondContact CB-O 3.4Å; A102-A121 PolarHBondContact N-O 2.66Å; T116-A121 HydrophobicContact CG2-CB 4.26Å; S119-A121 PolarHBondContact O-N 2.68Å; A121-V131 CarbonylContact C-O 3.59Å; A121-V131 WeakPolarHBondContact CA-O 3.38Å
122	L	91.5	Very high	87.5	Confident	37 Å²	37	37.1 Å²	37.1	19%	0.194	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	145.3	175.5	-59.3	178.8	0	0	0	109.7	F99 G100 H130 V131 A136	F99-L122 HydrophobicContact CB-CB 4.32Å; F99-L122 HydrophobicContact CB-CD1 4.33Å; F99-L122 HydrophobicContact CD1-CB 3.75Å; F99-L122 HydrophobicContact CE1-CB 4.4Å; F99-L122 HydrophobicContact CG-CB 4.24Å; F99-L122 HydrophobicContact CG-CD1 4.41Å; G100-L122 CarbonylContact O-C 3.6Å; G100-L122 WeakPolarHBondContact O-CA 3.17Å; L122-H130 WeakPolarHBondContact O-CA 3.12Å; L122-V131 HydrophobicContact CB-CG2 4.09Å; L122-V131 PolarHBondContact N-O 2.92Å; L122-V131 PolarHBondContact O-N 3.44Å; L122-A136 HydrophobicContact CD1-CB 3.83Å
123	R	91.4	Very high	87.3	Confident	49 Å²	49	38.5 Å²	38.5	19%	0.185	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	130.9	176.9	179.1	-169	67.8	-173.9	1.7	109.4	G100 A102 E125 L129 H130 H561	G100-R123 PolarHBondContact N-O 2.83Å; G100-R123 PolarHBondContact O-N 2.89Å; A102-R123 HydrophobicContact CB-CB 3.95Å; R123-E125 PolarHBondContact O-N 2.94Å; R123-L129 CarbonylContact C-O 3.57Å; R123-L129 WeakPolarHBondContact CA-O 3.49Å; R123-H130 WeakPolarHBondContact CD-NE2 3.49Å; R123-H130 WeakPolarHBondContact CG-NE2 3.41Å; R123-H561 PolarHBondContact NH2-CE1 2.64Å; R123-H561 VanDerWaalsContact NH2-CE1 3.26Å; R123-H561 PolarHBondContact NH2-ND1 2.85Å; R123-H561 VanDerWaalsContact NH2-ND1 3.18Å
124	C	92.3	Very high	87.1	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	125.3	168.8	-176.2	0	0	0	0	110.9	H97 C98 F99 V126 E128 L129	H97-C124 HydrophobicContact CB-CB 4.19Å; C98-C124 PolarHBondContact N-SG 2.86Å; C98-C124 CarbonylContact O-C 3.57Å; C98-C124 VanDerWaalsContact O-CA 3.27Å; C98-C124 WeakPolarHBondContact O-CA 3.13Å; F99-C124 HydrophobicContact CD1-CB 4.45Å; F99-C124 HydrophobicContact CE1-CB 4.42Å; C124-V126 PolarHBondContact O-N 2.79Å; C124-V126 PolarHBondContact SG-N 2.83Å; C124-E128 VanDerWaalsContact O-CA 3.29Å; C124-E128 WeakPolarHBondContact O-CA 3.45Å; C124-E128 PolarHBondContact O-N 3.12Å; C124-L129 HydrophobicContact CB-CB 4.21Å; C124-L129 PolarHBondContact N-O 2.77Å
125	E	89.9	Confident	87.1	Confident	16 Å²	16	38 Å²	38	8%	0.075	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-15.6	178.3	-75.7	-163.8	-145.9	0	0	114.7	C98 R123 I238 H561 R564	C98-E125 HydrophobicContact CB-CB 4.48Å; C98-E125 PolarHBondContact O-N 2.85Å; R123-E125 PolarHBondContact O-N 2.94Å; E125-I238 HydrophobicContact CB-CD1 4.13Å; E125-I238 VanDerWaalsContact CD-CG2 3.45Å; E125-I238 WeakPolarHBondContact OE1-CG2 3.26Å; E125-I238 WeakPolarHBondContact OE2-CG2 3.5Å; E125-H561 VanDerWaalsContact CD-CD2 3.46Å; E125-H561 IonicContact OE1-NE2 3.81Å; E125-H561 IonicContact OE2-CD2 2.91Å; E125-H561 PolarHBondContact OE2-CD2 3.35Å; E125-H561 VanDerWaalsContact OE2-CD2 3.22Å; E125-H561 IonicContact OE2-NE2 2.76Å; E125-R564 IonicContact OE2-CZ 3.54Å; E125-R564 IonicContact OE2-NH1 3.82Å; E125-R564 PolarHBondContact OE2-NH1 3Å
126	V	91.5	Very high	87.2	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-46	-175.2	177.4	0	0	0	0	112	C98 C124 R144 Y236 I238 P569	C98-V126 HydrophobicContact CB-CG2 4.02Å; C124-V126 PolarHBondContact O-N 2.79Å; C124-V126 PolarHBondContact SG-N 2.83Å; V126-R144 HydrophobicContact CG1-CB 3.83Å; V126-Y236 HydrophobicContact CG2-CD2 3.69Å; V126-Y236 HydrophobicContact CG2-CE2 3.88Å; V126-I238 HydrophobicContact CG2-CD1 4.15Å; V126-P569 HydrophobicContact CG1-CG 3.8Å; V126-P569 HydrophobicContact CG2-CG 4.12Å
127	C	90.3	Very high	87.1	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.007	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.8	4.1	-173.5	73.5	0	0	0	0	114.2	H97 L129 R144 R162 E190	H97-C127 VanDerWaalsContact CE1-SG 3.58Å; H97-C127 PolarHBondContact ND1-SG 2.81Å; C127-L129 PolarHBondContact O-N 2.86Å; C127-R144 HydrophobicContact CB-CB 4.43Å; C127-R162 WeakPolarHBondContact O-CD 3.43Å; C127-R162 PolarHBondContact SG-NE 2.75Å; C127-E190 WeakPolarHBondContact CA-OE2 3.38Å
128	E	88.6	Confident	87.6	Confident	50 Å²	50	31.4 Å²	31.4	23%	0.234	20%	0.204	C	C	.	.			trans	53.6	26.3	-178.7	-65.3	-162.9	162.8	0	0	115.7	C124 H130 K565	C124-E128 VanDerWaalsContact O-CA 3.29Å; C124-E128 WeakPolarHBondContact O-CA 3.45Å; C124-E128 PolarHBondContact O-N 3.12Å; E128-H130 PolarHBondContact O-CE1 3.1Å; E128-H130 VanDerWaalsContact O-CE1 3.23Å; E128-H130 PolarHBondContact O-N 2.94Å; E128-H130 PolarHBondContact O-ND1 3.4Å; E128-K565 VanDerWaalsContact CD-CE 3.43Å; E128-K565 VanDerWaalsContact CD-NZ 3.31Å; E128-K565 HydrophobicContact CG-CB 4.47Å; E128-K565 HydrophobicContact CG-CD 3.88Å; E128-K565 HydrophobicContact CG-CG 4Å; E128-K565 WeakPolarHBondContact OE1-CD 3.37Å; E128-K565 IonicContact OE1-NZ 2.66Å; E128-K565 WeakPolarHBondContact OE2-CE 3.3Å; E128-K565 IonicContact OE2-NZ 2.88Å; E128-K565 PolarHBondContact OE2-NZ 3.01Å
129	L	91.3	Very high	88.7	Confident	10 Å²	10	27 Å²	27	5%	0.052	16%	0.158	C	C	.	.			trans	-62.8	124.9	166.9	-178.1	130.8	0	0	0	109.5	F99 C110 R123 C124 C127 V131	F99-L129 HydrophobicContact CE1-CD2 3.55Å; F99-L129 HydrophobicContact CZ-CD2 3.49Å; F99-L129 VanDerWaalsContact CZ-CD2 3.49Å; C110-L129 HydrophobicContact CB-CD1 3.87Å; C110-L129 HydrophobicContact CB-CG 4.09Å; R123-L129 CarbonylContact C-O 3.57Å; R123-L129 WeakPolarHBondContact CA-O 3.49Å; C124-L129 HydrophobicContact CB-CB 4.21Å; C124-L129 PolarHBondContact N-O 2.77Å; C127-L129 PolarHBondContact O-N 2.86Å; L129-V131 HydrophobicContact CD2-CG1 3.52Å; L129-V131 HydrophobicContact CD2-CG2 4.33Å; L129-V131 HydrophobicContact CG-CG1 4.36Å
130	H	91.9	Very high	89.8	Confident	24 Å²	24	24.9 Å²	24.9	11%	0.111	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	133.7	176.2	-65.5	75	0	0	0	109.7	R107 C109 C110 L122 R123 E128	R107-H130 HydrophobicContact CB-CB 4.15Å; C109-H130 CarbonylContact C-O 3.51Å; C109-H130 WeakPolarHBondContact CA-O 3.49Å; C110-H130 PolarHBondContact N-O 2.92Å; C110-H130 PolarHBondContact SG-O 2.79Å; L122-H130 WeakPolarHBondContact O-CA 3.12Å; R123-H130 WeakPolarHBondContact CD-NE2 3.49Å; R123-H130 WeakPolarHBondContact CG-NE2 3.41Å; E128-H130 PolarHBondContact O-CE1 3.1Å; E128-H130 VanDerWaalsContact O-CE1 3.23Å; E128-H130 PolarHBondContact O-N 2.94Å; E128-H130 PolarHBondContact O-ND1 3.4Å
131	V	92.8	Very high	90.2	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	154.2	177.4	-70	0	0	0	0	110.1	F99 C110 V111 A121 L122 L129 C135 A136	F99-V131 HydrophobicContact CD1-CG2 4.33Å; F99-V131 HydrophobicContact CE1-CG2 3.56Å; F99-V131 HydrophobicContact CZ-CG2 3.8Å; C110-V131 HydrophobicContact CB-CG1 4.4Å; V111-V131 HydrophobicContact CG2-CG1 3.93Å; A121-V131 CarbonylContact C-O 3.59Å; A121-V131 WeakPolarHBondContact CA-O 3.38Å; L122-V131 HydrophobicContact CB-CG2 4.09Å; L122-V131 PolarHBondContact N-O 2.92Å; L122-V131 PolarHBondContact O-N 3.44Å; L129-V131 HydrophobicContact CD2-CG1 3.52Å; L129-V131 HydrophobicContact CD2-CG2 4.33Å; L129-V131 HydrophobicContact CG-CG1 4.36Å; V131-C135 HydrophobicContact CB-CB 4.26Å; V131-A136 HydrophobicContact CG2-CB 3.94Å
132	H	91.8	Very high	90.2	Very high	26 Å²	26	21.7 Å²	21.7	12%	0.12	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	150.5	160.4	-58.2	117.5	0	0	0	109.8	C109 C112 Q115 S119 D134 C135 A136	C109-H132 WeakPolarHBondContact CB-ND1 3.39Å; C109-H132 PolarHBondContact SG-N 2.81Å; C112-H132 PolarHBondContact SG-CE1 2.88Å; C112-H132 PolarHBondContact SG-ND1 2.86Å; Q115-H132 PolarHBondContact O-CE1 3.2Å; Q115-H132 PolarHBondContact O-NE2 3.27Å; S119-H132 PolarHBondContact OG-CD2 2.8Å; S119-H132 PolarHBondContact OG-NE2 3.08Å; H132-D134 VanDerWaalsContact C-N 3.26Å; H132-D134 PolarHBondContact O-N 2.71Å; H132-C135 HydrophobicContact CB-CB 3.99Å; H132-C135 CarbonylContact O-C 3.58Å; H132-C135 WeakPolarHBondContact O-CA 3.45Å; H132-C135 WeakPolarHBondContact O-CB 3.44Å; H132-C135 PolarHBondContact O-N 2.9Å; H132-A136 PolarHBondContact O-N 3.05Å; H132-A136 VanDerWaalsContact O-N 3.08Å
133	A	88.7	Confident	90.2	Very high	35 Å²	35	20 Å²	20	29%	0.289	11%	0.111	S	C	.	.	G	3₁₀ helix	trans	-52.2	-48.1	175.2	0	0	0	0	0	111.1	T120 C135 A136	T120-A133 WeakPolarHBondContact O-CB 3.3Å; T120-A133 PolarHBondContact O-N 3Å; A133-C135 PolarHBondContact O-N 3.19Å; A133-A136 VanDerWaalsContact O-CB 3.25Å; A133-A136 WeakPolarHBondContact O-CB 3.32Å; A133-A136 PolarHBondContact O-N 3.5Å; A133-A136 VanDerWaalsContact O-N 3.07Å
134	D	87.6	Confident	90.2	Very high	75 Å²	75	17.6 Å²	17.6	40%	0.401	10%	0.102	S	C	.	.	G	3₁₀ helix	trans	-60.9	-27.6	175.2	-72.8	9.3	0	0	0	114.2	H132 F138 R289	H132-D134 VanDerWaalsContact C-N 3.26Å; H132-D134 PolarHBondContact O-N 2.71Å; D134-F138 WeakPolarHBondContact O-CE2 3.38Å; D134-R289 PolarHBondContact O-NH2 2.95Å; D134-R289 IonicContact OD2-NH1 2.72Å
135	C	90.7	Very high	89.9	Confident	9 Å²	9	18.2 Å²	18.2	6%	0.061	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	-85.3	-15.7	179.7	-75.2	0	0	0	0	112.4	C109 V111 V131 H132 A133 A137 F138 S139	C109-C135 WeakPolarHBondContact SG-CB 3.41Å; C109-C135 VanDerWaalsContact SG-SG 3.63Å; V111-C135 HydrophobicContact CB-CB 3.81Å; V111-C135 HydrophobicContact CG1-CB 3.96Å; V111-C135 HydrophobicContact CG2-CB 4.15Å; V131-C135 HydrophobicContact CB-CB 4.26Å; H132-C135 HydrophobicContact CB-CB 3.99Å; H132-C135 CarbonylContact O-C 3.58Å; H132-C135 WeakPolarHBondContact O-CA 3.45Å; H132-C135 WeakPolarHBondContact O-CB 3.44Å; H132-C135 PolarHBondContact O-N 2.9Å; A133-C135 PolarHBondContact O-N 3.19Å; C135-A137 VanDerWaalsContact C-N 3.29Å; C135-A137 PolarHBondContact O-N 3.38Å; C135-F138 PolarHBondContact O-N 2.94Å; C135-S139 PolarHBondContact O-N 3.42Å
136	A	90	Very high	90	Very high	4 Å²	4	17.5 Å²	17.5	3%	0.033	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	-60	-37.6	-170.5	0	0	0	0	0	113.1	L122 V131 H132 A133 F138 S139 S407	L122-A136 HydrophobicContact CD1-CB 3.83Å; V131-A136 HydrophobicContact CG2-CB 3.94Å; H132-A136 PolarHBondContact O-N 3.05Å; H132-A136 VanDerWaalsContact O-N 3.08Å; A133-A136 VanDerWaalsContact O-CB 3.25Å; A133-A136 WeakPolarHBondContact O-CB 3.32Å; A133-A136 PolarHBondContact O-N 3.5Å; A133-A136 VanDerWaalsContact O-N 3.07Å; A136-F138 PolarHBondContact O-N 2.83Å; A136-S139 PolarHBondContact O-N 2.87Å; A136-S139 PolarHBondContact O-OG 3.41Å; A136-S407 WeakPolarHBondContact O-CB 3.43Å; A136-S407 PolarHBondContact O-OG 3.43Å
137	A	86.2	Confident	89.9	Confident	35 Å²	35	17.7 Å²	17.7	29%	0.289	10%	0.104	S	C	.	.	G	3₁₀ helix	trans	-66.1	-17.7	178.2	0	0	0	0	0	114.1	C135 Q438	C135-A137 VanDerWaalsContact C-N 3.29Å; C135-A137 PolarHBondContact O-N 3.38Å; A137-Q438 PolarHBondContact O-NE2 3.25Å
138	F	88.8	Confident	89.5	Confident	10 Å²	10	18.4 Å²	18.4	4%	0.044	11%	0.107	C	C	.	.	G	3₁₀ helix	trans	-99.8	-5.2	179.1	-53.4	-81.6	0	0	0	113	V111 D134 C135 A136 F309 Y310 R434	V111-F138 HydrophobicContact CG1-CB 3.76Å; V111-F138 HydrophobicContact CG2-CB 4.47Å; D134-F138 WeakPolarHBondContact O-CE2 3.38Å; C135-F138 PolarHBondContact O-N 2.94Å; A136-F138 PolarHBondContact O-N 2.83Å; F138-F309 VanDerWaalsContact CD1-O 3.3Å; F138-F309 WeakPolarHBondContact CD1-O 3.47Å; F138-F309 HydrophobicContact CE1-CB 4.24Å; F138-F309 AromaticContact CE1-CD1 3.96Å; F138-F309 HydrophobicContact CE1-CD1 3.96Å; F138-F309 VanDerWaalsContact CE1-O 3.25Å; F138-F309 WeakPolarHBondContact CE1-O 3.36Å; F138-F309 HydrophobicContact CZ-CD1 4.04Å; F138-Y310 HydrophobicContact CB-CD2 4.19Å; F138-Y310 AromaticContact CD1-CD2 3.81Å; F138-Y310 HydrophobicContact CD1-CD2 3.81Å; F138-Y310 HydrophobicContact CD2-CD2 4.17Å; F138-Y310 HydrophobicContact CD2-CE2 4.28Å; F138-Y310 HydrophobicContact CE1-CD2 4.22Å; F138-Y310 AromaticContact CG-CD2 3.78Å; F138-Y310 HydrophobicContact CG-CD2 3.78Å; F138-Y310 HydrophobicContact CG-CE2 4.31Å; F138-R434 HydrophobicContact CD1-CG 4.43Å; F138-R434 HydrophobicContact CE1-CG 4.44Å
139	S	90.6	Very high	88.7	Confident	4 Å²	4	17.5 Å²	17.5	3%	0.028	10%	0.104	C	C	.	.	S	Bend	trans	-71.6	145.1	173.7	65	0	0	0	0	110.7	C135 A136 S407	C135-S139 PolarHBondContact O-N 3.42Å; A136-S139 PolarHBondContact O-N 2.87Å; A136-S139 PolarHBondContact O-OG 3.41Å; S139-S407 WeakPolarHBondContact O-CB 3.4Å; S139-S407 WeakPolarHBondContact OG-CB 3.49Å
140	C	88.2	Confident	87.3	Confident	12 Å²	12	20.1 Å²	20.1	8%	0.081	12%	0.116	C	C	.	.			trans	-79.5	144.8	-178.6	-64.2	0	0	0	0	110.9	A87 P88 V91 H97 D142	A87-C140 WeakPolarHBondContact CB-SG 3.36Å; P88-C140 WeakPolarHBondContact CD-SG 3.37Å; V91-C140 HydrophobicContact CG2-CB 3.86Å; H97-C140 PolarHBondContact CD2-O 3.03Å; H97-C140 VanDerWaalsContact CD2-O 3.31Å; H97-C140 PolarHBondContact NE2-O 2.97Å; C140-D142 HydrophobicContact CB-CB 4.37Å; C140-D142 PolarHBondContact O-N 3.49Å
141	A	90.6	Very high	85.7	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.008	12%	0.123	C	C	.	.	S	Bend	trans	-72.5	66.7	170.9	0	0	0	0	0	111.3	V91 P94 V95 M405 S406 V410	V91-A141 WeakPolarHBondContact CG1-O 3.15Å; P94-A141 CarbonylContact C-O 3.55Å; P94-A141 VanDerWaalsContact CA-O 3.27Å; P94-A141 WeakPolarHBondContact CA-O 3.26Å; P94-A141 HydrophobicContact CB-CB 4.29Å; V95-A141 PolarHBondContact N-O 3.33Å; V95-A141 CarbonylContact O-C 3.59Å; V95-A141 WeakPolarHBondContact O-CA 3.37Å; A141-M405 HydrophobicContact CB-CB 3.98Å; A141-S406 WeakPolarHBondContact CB-O 3.17Å; A141-V410 HydrophobicContact CB-CG2 4.07Å
142	D	90.4	Very high	84.2	Confident	58 Å²	58	22.9 Å²	22.9	31%	0.31	13%	0.132	S	C	.	.	B	Isolated β-bridge	trans	-117.1	19.9	-175.5	71.2	3.5	0	0	0	113.3	V91 V95 H97 C140 Q160 R162	V91-D142 HydrophobicContact CG2-CB 4.34Å; V95-D142 PolarHBondContact O-N 3.07Å; H97-D142 IonicContact CE1-OD1 2.9Å; H97-D142 PolarHBondContact CE1-OD1 3.2Å; H97-D142 IonicContact NE2-OD1 3.17Å; H97-D142 PolarHBondContact NE2-OD1 3.22Å; H97-D142 VanDerWaalsContact NE2-OD1 3.14Å; C140-D142 HydrophobicContact CB-CB 4.37Å; C140-D142 PolarHBondContact O-N 3.49Å; D142-Q160 PolarHBondContact O-NE2 3.31Å; D142-R162 PolarHBondContact O-NH2 3.17Å; D142-R162 IonicContact OD1-CZ 3.11Å; D142-R162 IonicContact OD1-NH1 3.51Å; D142-R162 PolarHBondContact OD1-NH1 2.88Å; D142-R162 IonicContact OD1-NH2 3.65Å; D142-R162 PolarHBondContact OD1-NH2 3.46Å
143	C	91.5	Very high	82.5	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.158	C	C	.	.			trans	-58.6	163.3	-177.6	-167.9	0	0	0	0	112	V95 A96 H97 C145 Q160	V95-C143 HydrophobicContact CB-CB 4.13Å; V95-C143 VanDerWaalsContact CB-O 3.24Å; V95-C143 WeakPolarHBondContact CB-O 3.29Å; V95-C143 HydrophobicContact CG1-CB 3.88Å; V95-C143 WeakPolarHBondContact O-CB 3.06Å; V95-C143 PolarHBondContact O-N 3.34Å; A96-C143 WeakPolarHBondContact O-CB 3.48Å; H97-C143 WeakPolarHBondContact ND1-CB 3.3Å; C143-C145 PolarHBondContact O-N 3.42Å; C143-Q160 PolarHBondContact O-NE2 2.71Å
144	R	89.6	Confident	81.2	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.151	C	C	.	.			trans	-56.7	124.6	-177.6	-166.3	179.7	-179.7	-171.7	3.6	111.6	V126 C127 C146 E190 W191 K565 L567	V126-R144 HydrophobicContact CG1-CB 3.83Å; C127-R144 HydrophobicContact CB-CB 4.43Å; R144-C146 PolarHBondContact O-N 2.88Å; R144-C146 PolarHBondContact O-SG 3.08Å; R144-C146 VanDerWaalsContact O-SG 3.37Å; R144-E190 HydrophobicContact CG-CB 4.28Å; R144-E190 VanDerWaalsContact CZ-O 3.23Å; R144-E190 PolarHBondContact NE-O 2.82Å; R144-E190 PolarHBondContact NH2-O 3.19Å; R144-W191 HydrophobicContact CG-CH2 4.19Å; R144-W191 HydrophobicContact CG-CZ2 3.39Å; R144-W191 VanDerWaalsContact CZ-CZ3 3.4Å; R144-K565 PolarHBondContact NH1-O 3.48Å; R144-L567 PolarHBondContact NH1-O 3.22Å
145	C	87.9	Confident	79.7	Confident	12 Å²	12	34.4 Å²	34.4	8%	0.081	18%	0.177	C	C	.	.			trans	-81.1	100	176.5	178.9	0	0	0	0	110.1	V95 C143 H147 W191 P220	V95-C145 HydrophobicContact CG2-CB 4.18Å; C143-C145 PolarHBondContact O-N 3.42Å; C145-H147 PolarHBondContact SG-O 2.8Å; C145-W191 WeakPolarHBondContact O-CZ2 3.48Å; C145-P220 VanDerWaalsContact O-CB 3.3Å; C145-P220 WeakPolarHBondContact O-CB 3.45Å; C145-P220 VanDerWaalsContact O-CG 3.23Å; C145-P220 WeakPolarHBondContact O-CG 3.42Å
146	C	91.7	Very high	78.7	Confident	1 Å²	1	36 Å²	36	1%	0.007	19%	0.188	C	C	.	.			trans	-98.5	-5	-170.4	-58.7	0	0	0	0	115	R144 W191 Y236 N568 P569	R144-C146 PolarHBondContact O-N 2.88Å; R144-C146 PolarHBondContact O-SG 3.08Å; R144-C146 VanDerWaalsContact O-SG 3.37Å; C146-W191 HydrophobicContact CB-CH2 4.49Å; C146-Y236 HydrophobicContact CB-CE1 3.9Å; C146-Y236 WeakPolarHBondContact CB-OH 3.44Å; C146-N568 PolarHBondContact O-ND2 3.31Å; C146-P569 WeakPolarHBondContact SG-CD 3.18Å
147	H	89.5	Confident	78.5	Confident	5 Å²	5	37 Å²	37	2%	0.023	19%	0.193	C	C	.	.	S	Bend	trans	-155.6	160.6	177.1	52.4	-101.4	0	0	0	109.9	C145 V223 L225 K232 Y236 H570	C145-H147 PolarHBondContact SG-O 2.8Å; H147-V223 CarbonylContact C-O 3.58Å; H147-V223 WeakPolarHBondContact CA-O 3.4Å; H147-V223 HydrophobicContact CB-CB 3.86Å; H147-V223 HydrophobicContact CB-CG1 3.78Å; H147-V223 WeakPolarHBondContact CB-O 3.39Å; H147-L225 HydrophobicContact CB-CB 4.34Å; H147-K232 PolarHBondContact CE1-NZ 2.96Å; H147-K232 VanDerWaalsContact CE1-NZ 3.25Å; H147-K232 PolarHBondContact NE2-NZ 3.04Å; H147-Y236 AromaticContact CE1-CE1 3.88Å; H147-Y236 AromaticContact ND1-CE1 3.83Å; H147-H570 AromaticContact CE1-NE2 3.77Å; H147-H570 AromaticContact CG-NE2 3.79Å; H147-H570 AromaticContact ND1-CD2 3.88Å; H147-H570 AromaticContact ND1-CE1 3.79Å; H147-H570 AromaticContact ND1-NE2 2.89Å; H147-H570 PolarHBondContact ND1-NE2 3.01Å
148	L	80.9	Confident	78.5	Confident	15 Å²	15	39.1 Å²	39.1	8%	0.079	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-79.2	130.9	167.8	-60.8	176.8	0	0	0	110.1	L152 Q154 P221 V223 L225	L148-L152 HydrophobicContact CD2-CB 4.47Å; L148-Q154 HydrophobicContact CD2-CB 3.89Å; L148-P221 HydrophobicContact CD1-CB 4.35Å; L148-P221 WeakPolarHBondContact CD1-O 3.44Å; L148-V223 PolarHBondContact N-O 3.48Å; L148-L225 PolarHBondContact O-N 2.93Å
149	D	71.4	Confident	78.5	Confident	32 Å²	32	40.1 Å²	40.1	17%	0.171	20%	0.201	C	C	.	.			trans	-95.5	152.6	165.2	-159.7	-9.1	0	0	0	108.3	N151 L152	D149-N151 PolarHBondContact O-N 3.24Å; D149-L152 PolarHBondContact O-N 3.39Å
150	Q	62.3	Low	78.4	Confident	64 Å²	64	41.5 Å²	41.5	30%	0.299	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-42.8	-34.7	-161.6	-72	177.9	-20.5	0	0	116.1	Q226 P449	Q150-Q226 HydrophobicContact CG-CG 4.02Å; Q150-P449 HydrophobicContact CG-CG 4.48Å
151	N	57.9	Low	78.5	Confident	48 Å²	48	44.1 Å²	44.1	26%	0.257	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-6.9	-170.3	-61	-23.4	0	0	0	114.7	D149 A360 W361	D149-N151 PolarHBondContact O-N 3.24Å; N151-A360 HydrophobicContact CB-CB 3.96Å; N151-A360 CarbonylContact O-C 3.6Å; N151-A360 VanDerWaalsContact O-O 3.13Å; N151-W361 WeakPolarHBondContact O-CA 3.16Å
152	L	61.3	Low	78.4	Confident	35 Å²	35	44.8 Å²	44.8	18%	0.183	22%	0.218	C	C	.	.			trans	-95.9	104.3	-177.9	-75.5	157.4	0	0	0	110.2	V93 L148 D149 A360	V93-L152 HydrophobicContact CG1-CD1 3.78Å; V93-L152 HydrophobicContact CG2-CD2 4.03Å; L148-L152 HydrophobicContact CD2-CB 4.47Å; D149-L152 PolarHBondContact O-N 3.39Å; L152-A360 WeakPolarHBondContact CD2-O 3.28Å
153	Q	57	Low	78.2	Confident	142 Å²	142	44.3 Å²	44.3	66%	0.664	21%	0.214	S	C	*	.			trans	-85.5	115.1	162	-69.6	-176.3	-9.2	0	0	107.9
154	Q	60.5	Low	77.5	Confident	34 Å²	34	45.4 Å²	45.4	16%	0.159	23%	0.225	C	C	.	.			trans	-114.9	110.8	177.8	-171.5	168.4	0.3	0	0	109.4	L148 S156	L148-Q154 HydrophobicContact CD2-CB 3.89Å; Q154-S156 WeakPolarHBondContact CG-O 3.37Å; Q154-S156 PolarHBondContact NE2-O 2.92Å
155	E	57	Low	76.5	Confident	202 Å²	202	46.9 Å²	46.9	94%	0.944	23%	0.233	S	C	*	.	S	Bend	trans	-78.2	-36.9	175.6	-64	-172	161.4	0	0	111.7
156	S	70.3	Confident	75.2	Confident	41 Å²	41	49.7 Å²	49.7	29%	0.287	25%	0.251	S	S	.	.	S	Bend	trans	-139	147.2	177.7	76.8	0	0	0	0	114.4	Q154 Q158 E207	Q154-S156 WeakPolarHBondContact CG-O 3.37Å; Q154-S156 PolarHBondContact NE2-O 2.92Å; S156-Q158 PolarHBondContact O-N 3.28Å; S156-E207 WeakPolarHBondContact CB-OE1 3.18Å; S156-E207 PolarHBondContact OG-OE1 3.06Å
157	L	83.8	Confident	73.8	Confident	25 Å²	25	52.6 Å²	52.6	13%	0.131	28%	0.275	C	S	.	.			trans	-81.6	111.6	-179.4	-175.2	68.3	0	0	0	111	W191 C208 L210 P220	L157-W191 HydrophobicContact CD2-CG 4.47Å; L157-C208 HydrophobicContact CG-CB 4.36Å; L157-C208 PolarHBondContact O-N 3.49Å; L157-L210 HydrophobicContact CD2-CD1 4.39Å; L157-L210 HydrophobicContact CD2-CD2 3.18Å; L157-L210 HydrophobicContact CD2-CG 3.82Å; L157-P220 HydrophobicContact CD1-CG 4.22Å
158	Q	86.9	Confident	73	Confident	81 Å²	81	57.4 Å²	57.4	38%	0.379	31%	0.309	S	S	.	.	B	Isolated β-bridge	trans	-85.8	157.1	175.7	-67	-175.4	-10.4	0	0	112.9	S156 Q160 A206	S156-Q158 PolarHBondContact O-N 3.28Å; Q158-Q160 PolarHBondContact O-N 3.48Å; Q158-A206 WeakPolarHBondContact CA-O 3.39Å
159	H	89.3	Confident	73.2	Confident	30 Å²	30	57.2 Å²	57.2	14%	0.139	31%	0.31	C	S	.	.			trans	-60.9	127.3	170.8	-73.1	-79.7	0	0	0	111.5	W161 C189 C192 P205 A206 E207	H159-W161 HydrophobicContact CB-CD2 4.44Å; H159-W161 HydrophobicContact CB-CZ2 3.96Å; H159-W161 AromaticContact CG-CZ2 3.9Å; H159-C189 PolarHBondContact ND1-SG 3.06Å; H159-C192 PolarHBondContact CE1-SG 2.67Å; H159-C192 PolarHBondContact ND1-SG 3.41Å; H159-P205 PolarHBondContact CD2-O 2.9Å; H159-P205 PolarHBondContact NE2-O 3.03Å; H159-A206 PolarHBondContact CD2-O 2.96Å; H159-A206 PolarHBondContact N-O 3.09Å; H159-A206 VanDerWaalsContact N-O 3.16Å; H159-E207 PolarHBondContact NE2-O 3.09Å
160	Q	89.1	Confident	74.1	Confident	34 Å²	34	64.5 Å²	64.5	16%	0.159	34%	0.335	C	S	.	.			trans	-100.8	99.8	169.3	-171.5	165.2	1.1	0	0	109.3	D142 C143 Q158 C189 E190	D142-Q160 PolarHBondContact O-NE2 3.31Å; C143-Q160 PolarHBondContact O-NE2 2.71Å; Q158-Q160 PolarHBondContact O-N 3.48Å; Q160-C189 WeakPolarHBondContact O-CA 3.45Å; Q160-E190 PolarHBondContact O-N 3.44Å
161	W	89	Confident	75.5	Confident	67 Å²	67	61.4 Å²	61.4	25%	0.254	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	137.9	-176.4	-63.9	105	0	0	0	111.8	H159 L187 R188 C189 V194 C201 L204	H159-W161 HydrophobicContact CB-CD2 4.44Å; H159-W161 HydrophobicContact CB-CZ2 3.96Å; H159-W161 AromaticContact CG-CZ2 3.9Å; W161-L187 HydrophobicContact CB-CD1 4.4Å; W161-L187 HydrophobicContact CD2-CB 4.43Å; W161-L187 HydrophobicContact CE3-CB 3.73Å; W161-L187 HydrophobicContact CZ3-CB 4.37Å; W161-R188 CarbonylContact C-O 3.49Å; W161-R188 WeakPolarHBondContact CA-O 3.49Å; W161-C189 HydrophobicContact CE3-CB 4.16Å; W161-C189 HydrophobicContact CH2-CB 4.32Å; W161-C189 HydrophobicContact CZ3-CB 4.01Å; W161-V194 HydrophobicContact CH2-CG1 4.07Å; W161-V194 WeakPolarHBondContact CZ3-O 3.29Å; W161-C201 HydrophobicContact CD2-CB 4.43Å; W161-C201 HydrophobicContact CZ2-CB 4.29Å; W161-L204 HydrophobicContact CH2-CD1 3.46Å; W161-L204 VanDerWaalsContact CH2-CD1 3.46Å; W161-L204 HydrophobicContact CZ2-CD1 3.74Å
162	R	88.8	Confident	77.2	Confident	15 Å²	15	62.7 Å²	62.7	6%	0.057	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	137.8	173.9	-173.8	160	-65.4	-80.9	-4.5	110	C127 D142 L187 R188 E190	C127-R162 WeakPolarHBondContact O-CD 3.43Å; C127-R162 PolarHBondContact SG-NE 2.75Å; D142-R162 PolarHBondContact O-NH2 3.17Å; D142-R162 IonicContact OD1-CZ 3.11Å; D142-R162 IonicContact OD1-NH1 3.51Å; D142-R162 PolarHBondContact OD1-NH1 2.88Å; D142-R162 IonicContact OD1-NH2 3.65Å; D142-R162 PolarHBondContact OD1-NH2 3.46Å; R162-L187 CarbonylContact O-C 3.58Å; R162-L187 VanDerWaalsContact O-CA 3.29Å; R162-L187 WeakPolarHBondContact O-CA 3.47Å; R162-R188 PolarHBondContact N-O 3.04Å; R162-R188 PolarHBondContact O-N 2.91Å; R162-E190 HydrophobicContact CB-CG 4Å
163	E	87.1	Confident	78.7	Confident	48 Å²	48	65.4 Å²	65.4	22%	0.224	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	139.5	171.9	-81	-170.5	-167.8	0	0	111	R113 G186 L187	R113-E163 IonicContact CZ-OE2 3.75Å; R113-E163 VanDerWaalsContact CZ-OE2 3.22Å; R113-E163 IonicContact NH1-OE2 3.82Å; R113-E163 PolarHBondContact NH1-OE2 3.2Å; R113-E163 IonicContact NH2-OE1 3.17Å; R113-E163 PolarHBondContact NH2-OE1 2.65Å; R113-E163 IonicContact NH2-OE2 3.97Å; R113-E163 PolarHBondContact NH2-OE2 2.97Å; E163-G186 WeakPolarHBondContact CA-O 3.31Å; E163-L187 HydrophobicContact CB-CD2 4.36Å; E163-L187 HydrophobicContact CG-CD2 3.49Å; E163-L187 VanDerWaalsContact CG-CD2 3.49Å
164	G	76.8	Confident	80.3	Confident	22 Å²	22	60.7 Å²	60.7	23%	0.227	32%	0.318	C	S	.	.			trans	106.3	136.6	178.5	0	0	0	0	0	112.2	G186	G164-G186 PolarHBondContact N-O 2.78Å; G164-G186 VanDerWaalsContact N-O 3.07Å
165	D	68.6	Low	81.8	Confident	32 Å²	32	66.2 Å²	66.2	17%	0.171	34%	0.337	C	S	.	.			trans	-167.1	172.9	174.8	-134.7	10.6	0	0	0	112.5	A169 R188 T195	D165-A169 HydrophobicContact CB-CB 4.35Å; D165-R188 HydrophobicContact CB-CB 4.42Å; D165-R188 WeakPolarHBondContact OD1-CD 3.43Å; D165-R188 IonicContact OD1-NE 2.73Å; D165-R188 WeakPolarHBondContact OD2-CB 3.4Å; D165-R188 VanDerWaalsContact OD2-CD 3.25Å; D165-R188 WeakPolarHBondContact OD2-CD 3.46Å; D165-T195 WeakPolarHBondContact OD2-CG2 3.2Å
166	P	59.8	Low	83.4	Confident	70 Å²	70	65.6 Å²	65.6	46%	0.455	33%	0.326	S	S	.	.			trans	-71.5	154.3	-170.6	32	-33.8	0	0	0	111.3	S168 A169	P166-S168 PolarHBondContact O-N 3.42Å; P166-A169 PolarHBondContact O-N 2.93Å
167	A	61.6	Low	84.2	Confident	63 Å²	63	66.8 Å²	66.8	52%	0.521	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.6	135	167.4	0	0	0	0	0	109.4
168	S	73.4	Confident	84.4	Confident	106 Å²	106	65.6 Å²	65.6	74%	0.741	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.9	8.5	-177.8	78.6	0	0	0	0	118.8	P166 R170	P166-S168 PolarHBondContact O-N 3.42Å; S168-R170 PolarHBondContact O-N 2.92Å
169	A	85.9	Confident	84.4	Confident	11 Å²	11	62 Å²	62	9%	0.091	31%	0.313	C	S	.	.			trans	-58.1	136.6	172.5	0	0	0	0	0	112.6	D165 P166 S177 C178 G179 T195	D165-A169 HydrophobicContact CB-CB 4.35Å; P166-A169 PolarHBondContact O-N 2.93Å; A169-S177 WeakPolarHBondContact O-CA 3.49Å; A169-C178 PolarHBondContact O-N 3.04Å; A169-G179 PolarHBondContact O-N 3.07Å; A169-T195 HydrophobicContact CB-CG2 4.28Å
170	R	90.3	Very high	84.2	Confident	184 Å²	184	61.6 Å²	61.6	69%	0.694	31%	0.313	S	S	*	.	B	Isolated β-bridge	trans	-117.6	129.5	-179.5	-76.9	-176.5	158.8	-179.5	-5.9	111.3	S168 E172 R176 T195	S168-R170 PolarHBondContact O-N 2.92Å; R170-E172 PolarHBondContact O-N 2.79Å; R170-R176 WeakPolarHBondContact CA-O 3.43Å; R170-T195 PolarHBondContact O-OG1 3.37Å
171	C	91.4	Very high	84.1	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.328	C	S	.	.			trans	-61.9	128.8	-179.9	172.1	0	0	0	0	111	F173 R175 R176 C178 T195 H197	C171-F173 VanDerWaalsContact C-N 3.26Å; C171-F173 PolarHBondContact O-N 2.77Å; C171-F173 PolarHBondContact SG-N 3.24Å; C171-R175 WeakPolarHBondContact O-CA 3.39Å; C171-R175 PolarHBondContact O-N 3.28Å; C171-R176 PolarHBondContact N-O 3.42Å; C171-C178 HydrophobicContact CB-CB 4.05Å; C171-C178 PolarHBondContact N-SG 2.95Å; C171-T195 WeakPolarHBondContact CA-O 3.39Å; C171-H197 WeakPolarHBondContact CB-ND1 3.36Å
172	E	92.9	Very high	84	Confident	75 Å²	75	63.7 Å²	63.7	35%	0.35	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-35.5	-179.7	-175.7	55.9	-142.3	0	0	112.5	R170 R175 V194 T195 L204	R170-E172 PolarHBondContact O-N 2.79Å; E172-R175 PolarHBondContact O-NE 2.81Å; E172-R175 IonicContact OE1-CZ 3.19Å; E172-R175 VanDerWaalsContact OE1-CZ 3.27Å; E172-R175 IonicContact OE1-NH1 2.79Å; E172-R175 PolarHBondContact OE1-NH1 2.87Å; E172-R175 IonicContact OE1-NH2 3.61Å; E172-R175 PolarHBondContact OE1-NH2 2.81Å; E172-R175 IonicContact OE2-CZ 3.44Å; E172-R175 IonicContact OE2-NH1 2.68Å; E172-R175 PolarHBondContact OE2-NH1 3.21Å; E172-V194 HydrophobicContact CB-CG1 3.58Å; E172-V194 HydrophobicContact CG-CG1 3.89Å; E172-T195 PolarHBondContact N-O 3.42Å; E172-L204 HydrophobicContact CB-CD1 4.49Å; E172-L204 HydrophobicContact CB-CD2 4.12Å; E172-L204 HydrophobicContact CG-CD2 4.04Å
173	F	93.1	Very high	84	Confident	92 Å²	92	63.6 Å²	63.6	40%	0.404	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-58.5	-179.5	179.8	-92.4	0	0	0	112.8	C171 C200 R203 L204	C171-F173 VanDerWaalsContact C-N 3.26Å; C171-F173 PolarHBondContact O-N 2.77Å; C171-F173 PolarHBondContact SG-N 3.24Å; F173-C200 HydrophobicContact CB-CB 4.1Å; F173-C200 HydrophobicContact CD1-CB 4.26Å; F173-C200 HydrophobicContact CG-CB 4.45Å; F173-R203 HydrophobicContact CD2-CB 3.56Å; F173-R203 HydrophobicContact CE2-CB 3.61Å; F173-R203 HydrophobicContact CE2-CG 4.29Å; F173-R203 HydrophobicContact CG-CB 4.11Å; F173-R203 HydrophobicContact CZ-CB 4.22Å; F173-R203 VanDerWaalsContact CZ-CD 3.45Å; F173-R203 HydrophobicContact CZ-CG 4.44Å; F173-L204 HydrophobicContact CB-CD2 4.11Å
174	C	91.8	Very high	84.1	Confident	42 Å²	42	61.8 Å²	61.8	28%	0.284	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-5.4	-171.6	75.7	0	0	0	0	114.5	R176 H197	C174-R176 PolarHBondContact O-N 3.42Å; C174-H197 PolarHBondContact SG-CE1 2.88Å; C174-H197 PolarHBondContact SG-ND1 2.99Å; C174-H197 VanDerWaalsContact SG-ND1 3.38Å
175	R	92.2	Very high	84.7	Confident	150 Å²	150	61 Å²	61	57%	0.566	32%	0.317	S	S	*	.			trans	61.4	1.9	-178.3	-52.7	-61.7	-176	-170.6	-8.9	116.1	C171 E172	C171-R175 WeakPolarHBondContact O-CA 3.39Å; C171-R175 PolarHBondContact O-N 3.28Å; E172-R175 PolarHBondContact O-NE 2.81Å; E172-R175 IonicContact OE1-CZ 3.19Å; E172-R175 VanDerWaalsContact OE1-CZ 3.27Å; E172-R175 IonicContact OE1-NH1 2.79Å; E172-R175 PolarHBondContact OE1-NH1 2.87Å; E172-R175 IonicContact OE1-NH2 3.61Å; E172-R175 PolarHBondContact OE1-NH2 2.81Å; E172-R175 IonicContact OE2-CZ 3.44Å; E172-R175 IonicContact OE2-NH1 2.68Å; E172-R175 PolarHBondContact OE2-NH1 3.21Å
176	R	89.1	Confident	85.6	Confident	190 Å²	190	60 Å²	60	72%	0.717	31%	0.314	S	S	*	.	S	Bend	trans	-80.5	160	174.3	-58.9	-178.6	-176	-176.7	0.3	111.4	R170 C171 C174 C178	R170-R176 WeakPolarHBondContact CA-O 3.43Å; C171-R176 PolarHBondContact N-O 3.42Å; C174-R176 PolarHBondContact O-N 3.42Å; R176-C178 PolarHBondContact O-N 3.08Å
177	S	88.2	Confident	87.1	Confident	65 Å²	65	57.5 Å²	57.5	46%	0.455	30%	0.297	S	S	.	.	B	Isolated β-bridge	trans	-58.1	130.4	173.6	-166	0	0	0	0	110.2	A169 G179 H197	A169-S177 WeakPolarHBondContact O-CA 3.49Å; S177-G179 PolarHBondContact OG-O 2.76Å; S177-H197 PolarHBondContact O-CE1 3.43Å; S177-H197 PolarHBondContact O-NE2 3.42Å
178	C	87.7	Confident	88.5	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.277	C	S	.	.			trans	-123.5	-7.8	173.4	63.2	0	0	0	0	113.2	S53 A169 C171 R176 S185 G186 H197	S53-C178 PolarHBondContact OG-O 2.85Å; A169-C178 PolarHBondContact O-N 3.04Å; C171-C178 HydrophobicContact CB-CB 4.05Å; C171-C178 PolarHBondContact N-SG 2.95Å; R176-C178 PolarHBondContact O-N 3.08Å; C178-S185 CarbonylContact O-C 3.5Å; C178-G186 WeakPolarHBondContact O-CA 3.39Å; C178-G186 PolarHBondContact O-N 2.78Å; C178-H197 WeakPolarHBondContact CA-NE2 3.19Å; C178-H197 VanDerWaalsContact CB-CD2 3.41Å; C178-H197 WeakPolarHBondContact CB-CD2 3.29Å; C178-H197 WeakPolarHBondContact CB-NE2 3.41Å
179	G	85.7	Confident	89.4	Confident	6 Å²	6	50.8 Å²	50.8	6%	0.062	24%	0.242	C	C	.	.			trans	-92.1	157.6	171.2	0	0	0	0	0	112.6	A169 S177	A169-G179 PolarHBondContact O-N 3.07Å; S177-G179 PolarHBondContact OG-O 2.76Å
180	S	85.8	Confident	89.6	Confident	21 Å²	21	50.7 Å²	50.7	15%	0.147	24%	0.24	C	C	.	.			trans	-145.7	143.7	175.7	-175.6	0	0	0	0	111.3	E182 V183 S185	S180-E182 PolarHBondContact OG-N 3.35Å; S180-E182 VanDerWaalsContact OG-N 3.07Å; S180-V183 PolarHBondContact OG-N 3.39Å; S180-S185 WeakPolarHBondContact CB-OG 3.41Å
181	S	87.1	Confident	89.6	Confident	67 Å²	67	42.5 Å²	42.5	47%	0.469	21%	0.209	S	C	.	.	S	Bend	trans	-82.1	-17.6	167.1	53.1	0	0	0	0	112.9	F108	F108-S181 WeakPolarHBondContact CZ-O 3.27Å
182	E	87.8	Confident	89.6	Confident	79 Å²	79	43.6 Å²	43.6	37%	0.369	22%	0.216	S	C	.	.	S	Bend	trans	-99.6	-24.5	-168.5	-55.9	-50.9	134.5	0	0	113.2	F48 F108 S180	F48-E182 HydrophobicContact CB-CB 4.34Å; F48-E182 HydrophobicContact CD2-CB 3.44Å; F48-E182 VanDerWaalsContact CD2-CB 3.44Å; F48-E182 HydrophobicContact CD2-CG 3.79Å; F48-E182 HydrophobicContact CE1-CG 4.4Å; F48-E182 HydrophobicContact CE2-CB 3.82Å; F48-E182 HydrophobicContact CE2-CG 3.6Å; F48-E182 HydrophobicContact CG-CB 3.85Å; F48-E182 HydrophobicContact CG-CG 4.29Å; F48-E182 HydrophobicContact CZ-CB 4.48Å; F48-E182 HydrophobicContact CZ-CG 3.93Å; F108-E182 WeakPolarHBondContact CE1-O 3.41Å; F108-E182 WeakPolarHBondContact CZ-O 3.44Å; S180-E182 PolarHBondContact OG-N 3.35Å; S180-E182 VanDerWaalsContact OG-N 3.07Å
183	V	88	Confident	89.5	Confident	12 Å²	12	41.2 Å²	41.2	7%	0.073	21%	0.211	C	C	.	.	S	Bend	trans	-145.3	152.5	-179.6	-70.8	0	0	0	0	112.1	F48 S180 S185	F48-V183 HydrophobicContact CB-CG1 3.91Å; F48-V183 HydrophobicContact CB-CG2 3.98Å; S180-V183 PolarHBondContact OG-N 3.39Å; V183-S185 PolarHBondContact O-N 2.8Å; V183-S185 PolarHBondContact O-OG 3.03Å
184	L	89.3	Confident	89.4	Confident	10 Å²	10	38.7 Å²	38.7	5%	0.052	20%	0.204	C	C	.	.			trans	-66.2	105.7	169.6	-174.5	66.4	0	0	0	109.7	H50 F108 C110 R113	H50-L184 PolarHBondContact CD2-O 2.93Å; H50-L184 VanDerWaalsContact CD2-O 3.25Å; F108-L184 HydrophobicContact CB-CB 3.77Å; F108-L184 HydrophobicContact CB-CD1 4.23Å; F108-L184 HydrophobicContact CB-CG 4.43Å; F108-L184 HydrophobicContact CG-CB 4.13Å; C110-L184 HydrophobicContact CB-CD2 4.49Å; R113-L184 HydrophobicContact CG-CD2 4.39Å
185	S	88.2	Confident	89.5	Confident	5 Å²	5	37.6 Å²	37.6	4%	0.035	20%	0.196	C	C	.	.			trans	-148.9	164.6	-178.2	58.9	0	0	0	0	111	H50 S53 C178 S180 V183	H50-S185 WeakPolarHBondContact O-CB 3.46Å; S53-S185 VanDerWaalsContact OG-CB 3.25Å; S53-S185 WeakPolarHBondContact OG-CB 3.03Å; S53-S185 PolarHBondContact OG-OG 2.94Å; C178-S185 CarbonylContact O-C 3.5Å; S180-S185 WeakPolarHBondContact CB-OG 3.41Å; V183-S185 PolarHBondContact O-N 2.8Å; V183-S185 PolarHBondContact O-OG 3.03Å
186	G	88.5	Confident	89.5	Confident	11 Å²	11	30.5 Å²	30.5	11%	0.113	17%	0.169	C	C	.	.			trans	79.1	153.3	-176.4	0	0	0	0	0	112.9	E163 G164 C178	E163-G186 WeakPolarHBondContact CA-O 3.31Å; G164-G186 PolarHBondContact N-O 2.78Å; G164-G186 VanDerWaalsContact N-O 3.07Å; C178-G186 WeakPolarHBondContact O-CA 3.39Å; C178-G186 PolarHBondContact O-N 2.78Å
187	L	90.4	Very high	89.5	Confident	18 Å²	18	22.4 Å²	22.4	9%	0.094	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	139.9	171	-63.6	177.8	0	0	0	108.9	W161 R162 E163 T195 S196 A198 C201	W161-L187 HydrophobicContact CB-CD1 4.4Å; W161-L187 HydrophobicContact CD2-CB 4.43Å; W161-L187 HydrophobicContact CE3-CB 3.73Å; W161-L187 HydrophobicContact CZ3-CB 4.37Å; R162-L187 CarbonylContact O-C 3.58Å; R162-L187 VanDerWaalsContact O-CA 3.29Å; R162-L187 WeakPolarHBondContact O-CA 3.47Å; E163-L187 HydrophobicContact CB-CD2 4.36Å; E163-L187 HydrophobicContact CG-CD2 3.49Å; E163-L187 VanDerWaalsContact CG-CD2 3.49Å; L187-T195 CarbonylContact O-C 3.59Å; L187-T195 WeakPolarHBondContact O-CA 3.37Å; L187-S196 WeakPolarHBondContact CB-O 3.47Å; L187-S196 PolarHBondContact N-O 3.44Å; L187-S196 PolarHBondContact O-N 2.89Å; L187-A198 HydrophobicContact CD1-CB 4.14Å; L187-A198 HydrophobicContact CG-CB 4.36Å; L187-C201 HydrophobicContact CD1-CB 3.85Å
188	R	91.4	Very high	89.5	Confident	29 Å²	29	20.2 Å²	20.2	11%	0.109	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	139.2	168.5	178.2	168.5	172.1	-88	2.8	110.2	W161 R162 D165 E190 V194 T195	W161-R188 CarbonylContact C-O 3.49Å; W161-R188 WeakPolarHBondContact CA-O 3.49Å; R162-R188 PolarHBondContact N-O 3.04Å; R162-R188 PolarHBondContact O-N 2.91Å; D165-R188 HydrophobicContact CB-CB 4.42Å; D165-R188 WeakPolarHBondContact OD1-CD 3.43Å; D165-R188 IonicContact OD1-NE 2.73Å; D165-R188 WeakPolarHBondContact OD2-CB 3.4Å; D165-R188 VanDerWaalsContact OD2-CD 3.25Å; D165-R188 WeakPolarHBondContact OD2-CD 3.46Å; R188-E190 IonicContact NH1-OE1 2.9Å; R188-E190 PolarHBondContact NH1-OE1 2.94Å; R188-V194 CarbonylContact C-O 3.6Å; R188-V194 WeakPolarHBondContact CA-O 3.33Å; R188-T195 HydrophobicContact CG-CG2 4.47Å
189	C	91.8	Very high	89.4	Confident	0 Å²	0	22 Å²	22	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	124.9	168.3	-178.4	0	0	0	0	109.9	H159 Q160 W161 W191 C192 G193 V194	H159-C189 PolarHBondContact ND1-SG 3.06Å; Q160-C189 WeakPolarHBondContact O-CA 3.45Å; W161-C189 HydrophobicContact CE3-CB 4.16Å; W161-C189 HydrophobicContact CH2-CB 4.32Å; W161-C189 HydrophobicContact CZ3-CB 4.01Å; C189-W191 PolarHBondContact O-N 3.19Å; C189-W191 VanDerWaalsContact O-N 3.16Å; C189-C192 VanDerWaalsContact CB-SG 3.5Å; C189-G193 VanDerWaalsContact O-CA 3.23Å; C189-G193 WeakPolarHBondContact O-CA 3.37Å; C189-G193 PolarHBondContact O-N 2.92Å; C189-V194 PolarHBondContact N-O 3.05Å
190	E	90.4	Very high	89.6	Confident	8 Å²	8	21.9 Å²	21.9	4%	0.037	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-12.7	-177.7	-67.7	-59.7	106.4	0	0	114.3	C127 R144 Q160 R162 R188	C127-E190 WeakPolarHBondContact CA-OE2 3.38Å; R144-E190 HydrophobicContact CG-CB 4.28Å; R144-E190 VanDerWaalsContact CZ-O 3.23Å; R144-E190 PolarHBondContact NE-O 2.82Å; R144-E190 PolarHBondContact NH2-O 3.19Å; Q160-E190 PolarHBondContact O-N 3.44Å; R162-E190 HydrophobicContact CB-CG 4Å; R188-E190 IonicContact NH1-OE1 2.9Å; R188-E190 PolarHBondContact NH1-OE1 2.94Å
191	W	91.4	Very high	89.8	Confident	13 Å²	13	22.2 Å²	22.2	5%	0.049	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-59	179.4	-70.4	104.4	0	0	0	112.7	R144 C145 C146 L157 C189 L210 L217 P220 N568	R144-W191 HydrophobicContact CG-CH2 4.19Å; R144-W191 HydrophobicContact CG-CZ2 3.39Å; R144-W191 VanDerWaalsContact CZ-CZ3 3.4Å; C145-W191 WeakPolarHBondContact O-CZ2 3.48Å; C146-W191 HydrophobicContact CB-CH2 4.49Å; L157-W191 HydrophobicContact CD2-CG 4.47Å; C189-W191 PolarHBondContact O-N 3.19Å; C189-W191 VanDerWaalsContact O-N 3.16Å; W191-L210 HydrophobicContact CB-CD2 3.99Å; W191-L210 HydrophobicContact CD2-CD2 4.38Å; W191-L210 HydrophobicContact CE3-CD2 4.01Å; W191-L210 HydrophobicContact CG-CD2 4.38Å; W191-L217 HydrophobicContact CE3-CD1 3.97Å; W191-L217 HydrophobicContact CE3-CD2 3.79Å; W191-L217 HydrophobicContact CE3-CG 4.43Å; W191-L217 HydrophobicContact CZ3-CD1 4.24Å; W191-L217 HydrophobicContact CZ3-CD2 3.76Å; W191-L217 HydrophobicContact CZ3-CG 4.35Å; W191-P220 HydrophobicContact CD2-CG 4.27Å; W191-P220 HydrophobicContact CE3-CG 4.27Å; W191-P220 HydrophobicContact CH2-CG 3.31Å; W191-P220 HydrophobicContact CZ2-CB 4.43Å; W191-P220 HydrophobicContact CZ2-CG 3.19Å; W191-P220 HydrophobicContact CZ3-CG 3.83Å; W191-N568 HydrophobicContact CH2-CB 4.36Å; W191-N568 HydrophobicContact CZ3-CB 4.26Å
192	C	91.2	Very high	89.8	Confident	22 Å²	22	24.4 Å²	24.4	15%	0.149	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-9.9	-177.3	65	0	0	0	0	114.3	H159 C189 V194 G211	H159-C192 PolarHBondContact CE1-SG 2.67Å; H159-C192 PolarHBondContact ND1-SG 3.41Å; C189-C192 VanDerWaalsContact CB-SG 3.5Å; C192-V194 HydrophobicContact CB-CG2 4.36Å; C192-V194 PolarHBondContact O-N 2.79Å; C192-V194 VanDerWaalsContact SG-CB 3.59Å; C192-V194 WeakPolarHBondContact SG-CG2 3.32Å; C192-G211 VanDerWaalsContact CB-N 3.34Å
193	G	90.2	Very high	90	Very high	25 Å²	25	26.9 Å²	26.9	26%	0.258	15%	0.146	S	C	.	.			trans	72.6	1.5	-178.7	0	0	0	0	0	115.2	C189 T195	C189-G193 VanDerWaalsContact O-CA 3.23Å; C189-G193 WeakPolarHBondContact O-CA 3.37Å; C189-G193 PolarHBondContact O-N 2.92Å; G193-T195 WeakPolarHBondContact O-CG2 3.42Å
194	V	91.8	Very high	90.1	Very high	39 Å²	39	27.5 Å²	27.5	24%	0.236	15%	0.149	C	C	.	.			trans	-58.1	138.4	175.1	169.7	0	0	0	0	109.8	W161 E172 R188 C189 C192 L204	W161-V194 HydrophobicContact CH2-CG1 4.07Å; W161-V194 WeakPolarHBondContact CZ3-O 3.29Å; E172-V194 HydrophobicContact CB-CG1 3.58Å; E172-V194 HydrophobicContact CG-CG1 3.89Å; R188-V194 CarbonylContact C-O 3.6Å; R188-V194 WeakPolarHBondContact CA-O 3.33Å; C189-V194 PolarHBondContact N-O 3.05Å; C192-V194 HydrophobicContact CB-CG2 4.36Å; C192-V194 PolarHBondContact O-N 2.79Å; C192-V194 VanDerWaalsContact SG-CB 3.59Å; C192-V194 WeakPolarHBondContact SG-CG2 3.32Å; V194-L204 HydrophobicContact CG1-CD1 4.06Å
195	T	93	Very high	90.3	Very high	20 Å²	20	31.7 Å²	31.7	12%	0.123	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	149.3	-179.5	81.3	0	0	0	0	111.2	D165 A169 R170 C171 E172 L187 R188 G193	D165-T195 WeakPolarHBondContact OD2-CG2 3.2Å; A169-T195 HydrophobicContact CB-CG2 4.28Å; R170-T195 PolarHBondContact O-OG1 3.37Å; C171-T195 WeakPolarHBondContact CA-O 3.39Å; E172-T195 PolarHBondContact N-O 3.42Å; L187-T195 CarbonylContact O-C 3.59Å; L187-T195 WeakPolarHBondContact O-CA 3.37Å; R188-T195 HydrophobicContact CG-CG2 4.47Å; G193-T195 WeakPolarHBondContact O-CG2 3.42Å
196	S	92.5	Very high	90.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	154.8	-178.9	-178.3	0	0	0	0	112.1	L187 C200 C201	L187-S196 WeakPolarHBondContact CB-O 3.47Å; L187-S196 PolarHBondContact N-O 3.44Å; L187-S196 PolarHBondContact O-N 2.89Å; S196-C200 WeakPolarHBondContact OG-CB 3.34Å; S196-C201 WeakPolarHBondContact OG-CA 3.37Å; S196-C201 PolarHBondContact OG-N 2.93Å
197	H	89.2	Confident	90.3	Very high	20 Å²	20	39.9 Å²	39.9	9%	0.093	22%	0.224	C	C	.	.			trans	-63.4	151.3	158.7	-60.1	102.4	0	0	0	110.4	C171 C174 S177 C178 S199 C200 C201	C171-H197 WeakPolarHBondContact CB-ND1 3.36Å; C174-H197 PolarHBondContact SG-CE1 2.88Å; C174-H197 PolarHBondContact SG-ND1 2.99Å; C174-H197 VanDerWaalsContact SG-ND1 3.38Å; S177-H197 PolarHBondContact O-CE1 3.43Å; S177-H197 PolarHBondContact O-NE2 3.42Å; C178-H197 WeakPolarHBondContact CA-NE2 3.19Å; C178-H197 VanDerWaalsContact CB-CD2 3.41Å; C178-H197 WeakPolarHBondContact CB-CD2 3.29Å; C178-H197 WeakPolarHBondContact CB-NE2 3.41Å; H197-S199 PolarHBondContact O-N 3.36Å; H197-C200 HydrophobicContact CB-CB 4.11Å; H197-C200 PolarHBondContact O-N 2.93Å; H197-C201 PolarHBondContact O-N 2.91Å; H197-C201 VanDerWaalsContact O-N 3.11Å
198	A	87.1	Confident	90.3	Very high	20 Å²	20	39.5 Å²	39.5	17%	0.165	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-30.5	172.4	0	0	0	0	0	113	A81 L187 C200 C201	A81-A198 HydrophobicContact CB-CB 4.47Å; L187-A198 HydrophobicContact CD1-CB 4.14Å; L187-A198 HydrophobicContact CG-CB 4.36Å; A198-C200 VanDerWaalsContact C-N 3.34Å; A198-C201 PolarHBondContact O-SG 2.79Å
199	S	86.7	Confident	90.3	Very high	37 Å²	37	41.7 Å²	41.7	26%	0.259	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-12.2	174.8	57.6	0	0	0	0	114.2	H197 H202	H197-S199 PolarHBondContact O-N 3.36Å; S199-H202 PolarHBondContact O-NE2 3.46Å
200	C	90	Very high	90.2	Very high	4 Å²	4	42.7 Å²	42.7	3%	0.027	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-17.2	-177.4	-69.1	0	0	0	0	113.5	F173 S196 H197 A198 H202 R203	F173-C200 HydrophobicContact CB-CB 4.1Å; F173-C200 HydrophobicContact CD1-CB 4.26Å; F173-C200 HydrophobicContact CG-CB 4.45Å; S196-C200 WeakPolarHBondContact OG-CB 3.34Å; H197-C200 HydrophobicContact CB-CB 4.11Å; H197-C200 PolarHBondContact O-N 2.93Å; A198-C200 VanDerWaalsContact C-N 3.34Å; C200-H202 VanDerWaalsContact C-N 3.29Å; C200-H202 PolarHBondContact O-N 3.36Å; C200-R203 WeakPolarHBondContact O-CB 3.27Å; C200-R203 PolarHBondContact O-N 2.89Å; C200-R203 PolarHBondContact SG-NH2 2.84Å; C200-R203 VanDerWaalsContact SG-NH2 3.41Å
201	C	89	Confident	90.2	Very high	28 Å²	28	43.5 Å²	43.5	19%	0.189	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-61.2	-35.5	-171.3	61.1	0	0	0	0	113.2	W161 L187 S196 H197 A198 R203 L204	W161-C201 HydrophobicContact CD2-CB 4.43Å; W161-C201 HydrophobicContact CZ2-CB 4.29Å; L187-C201 HydrophobicContact CD1-CB 3.85Å; S196-C201 WeakPolarHBondContact OG-CA 3.37Å; S196-C201 PolarHBondContact OG-N 2.93Å; H197-C201 PolarHBondContact O-N 2.91Å; H197-C201 VanDerWaalsContact O-N 3.11Å; A198-C201 PolarHBondContact O-SG 2.79Å; C201-R203 PolarHBondContact O-N 3.01Å; C201-R203 VanDerWaalsContact O-N 3.17Å; C201-L204 WeakPolarHBondContact O-CB 3.42Å; C201-L204 PolarHBondContact O-N 2.89Å; C201-L204 VanDerWaalsContact O-N 3.12Å
202	H	87.6	Confident	90.1	Very high	113 Å²	113	49.4 Å²	49.4	52%	0.523	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-69.4	-9.7	178.6	74	68.7	0	0	0	113.9	S199 C200	S199-H202 PolarHBondContact O-NE2 3.46Å; C200-H202 VanDerWaalsContact C-N 3.29Å; C200-H202 PolarHBondContact O-N 3.36Å
203	R	92.3	Very high	90.2	Very high	130 Å²	130	48.9 Å²	48.9	49%	0.491	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-92	-6.4	175.3	-62.6	-162.5	-80.2	-139.1	-2.3	112.6	F173 C200 C201	F173-R203 HydrophobicContact CD2-CB 3.56Å; F173-R203 HydrophobicContact CE2-CB 3.61Å; F173-R203 HydrophobicContact CE2-CG 4.29Å; F173-R203 HydrophobicContact CG-CB 4.11Å; F173-R203 HydrophobicContact CZ-CB 4.22Å; F173-R203 VanDerWaalsContact CZ-CD 3.45Å; F173-R203 HydrophobicContact CZ-CG 4.44Å; C200-R203 WeakPolarHBondContact O-CB 3.27Å; C200-R203 PolarHBondContact O-N 2.89Å; C200-R203 PolarHBondContact SG-NH2 2.84Å; C200-R203 VanDerWaalsContact SG-NH2 3.41Å; C201-R203 PolarHBondContact O-N 3.01Å; C201-R203 VanDerWaalsContact O-N 3.17Å
204	L	91.1	Very high	90.3	Very high	26 Å²	26	55.5 Å²	55.5	14%	0.136	30%	0.298	C	S	.	.	S	Bend	trans	-84.9	155.5	171.7	-59.9	174.1	0	0	0	109.3	W161 E172 F173 V194 C201	W161-L204 HydrophobicContact CH2-CD1 3.46Å; W161-L204 VanDerWaalsContact CH2-CD1 3.46Å; W161-L204 HydrophobicContact CZ2-CD1 3.74Å; E172-L204 HydrophobicContact CB-CD1 4.49Å; E172-L204 HydrophobicContact CB-CD2 4.12Å; E172-L204 HydrophobicContact CG-CD2 4.04Å; F173-L204 HydrophobicContact CB-CD2 4.11Å; V194-L204 HydrophobicContact CG1-CD1 4.06Å; C201-L204 WeakPolarHBondContact O-CB 3.42Å; C201-L204 PolarHBondContact O-N 2.89Å; C201-L204 VanDerWaalsContact O-N 3.12Å
205	P	91.9	Very high	90.3	Very high	97 Å²	97	55 Å²	55	63%	0.63	30%	0.296	S	S	*	.			trans	-52.1	144.9	170.6	-25	34.7	0	0	0	111.3	H159 E207	H159-P205 PolarHBondContact CD2-O 2.9Å; H159-P205 PolarHBondContact NE2-O 3.03Å; P205-E207 VanDerWaalsContact C-N 3.31Å
206	A	87.1	Confident	90.4	Very high	69 Å²	69	54.3 Å²	54.3	57%	0.57	29%	0.291	S	S	*	.	S	Bend	trans	-70.1	-31.9	178.6	0	0	0	0	0	112.1	Q158 H159	Q158-A206 WeakPolarHBondContact CA-O 3.39Å; H159-A206 PolarHBondContact CD2-O 2.96Å; H159-A206 PolarHBondContact N-O 3.09Å; H159-A206 VanDerWaalsContact N-O 3.16Å
207	E	90.4	Very high	90.5	Very high	119 Å²	119	54.3 Å²	54.3	56%	0.556	29%	0.291	S	S	*	.	B	Isolated β-bridge	trans	-84.4	132.7	-177.8	-60.2	-168.1	158.1	0	0	112.5	S156 H159 P205	S156-E207 WeakPolarHBondContact CB-OE1 3.18Å; S156-E207 PolarHBondContact OG-OE1 3.06Å; H159-E207 PolarHBondContact NE2-O 3.09Å; P205-E207 VanDerWaalsContact C-N 3.31Å
208	C	90.9	Very high	90.7	Very high	11 Å²	11	53.4 Å²	53.4	7%	0.074	29%	0.287	C	S	.	.			trans	-91.8	116.5	-179.8	178.8	0	0	0	0	110.8	L157 L210	L157-C208 HydrophobicContact CG-CB 4.36Å; L157-C208 PolarHBondContact O-N 3.49Å; C208-L210 PolarHBondContact O-N 2.94Å; C208-L210 VanDerWaalsContact O-N 3.17Å
209	A	89.8	Confident	90.9	Very high	74 Å²	74	53.3 Å²	53.3	61%	0.612	29%	0.285	S	S	*	.			trans	-80.3	16.2	177.5	0	0	0	0	0	114.8	G211	A209-G211 PolarHBondContact O-N 3.37Å
210	L	89.9	Confident	91	Very high	21 Å²	21	51.6 Å²	51.6	11%	0.11	27%	0.273	C	S	.	.			trans	58.9	0.3	-179.4	-63.2	172.5	0	0	0	116.6	L157 W191 C208 R214 L217 P219	L157-L210 HydrophobicContact CD2-CD1 4.39Å; L157-L210 HydrophobicContact CD2-CD2 3.18Å; L157-L210 HydrophobicContact CD2-CG 3.82Å; W191-L210 HydrophobicContact CB-CD2 3.99Å; W191-L210 HydrophobicContact CD2-CD2 4.38Å; W191-L210 HydrophobicContact CE3-CD2 4.01Å; W191-L210 HydrophobicContact CG-CD2 4.38Å; C208-L210 PolarHBondContact O-N 2.94Å; C208-L210 VanDerWaalsContact O-N 3.17Å; L210-R214 HydrophobicContact CB-CB 3.7Å; L210-L217 HydrophobicContact CD1-CD2 4.15Å; L210-L217 HydrophobicContact CD2-CD2 3.77Å; L210-L217 HydrophobicContact CG-CD2 4.48Å; L210-P219 HydrophobicContact CD1-CB 4.23Å; L210-P219 HydrophobicContact CD1-CG 4.04Å
211	G	90.9	Very high	90.9	Very high	26 Å²	26	52.5 Å²	52.5	27%	0.268	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	69.2	-156.7	176.1	0	0	0	0	0	113.3	C192 A209 L213 R214	C192-G211 VanDerWaalsContact CB-N 3.34Å; A209-G211 PolarHBondContact O-N 3.37Å; G211-L213 VanDerWaalsContact C-N 3.29Å; G211-L213 PolarHBondContact O-N 3.04Å; G211-R214 WeakPolarHBondContact O-CB 3.41Å; G211-R214 PolarHBondContact O-N 2.79Å
212	R	90.1	Very high	91	Very high	137 Å²	137	51.3 Å²	51.3	52%	0.517	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-66.9	-28	-175.9	-167.3	177.7	175.6	176.4	-3.3	113.4	R214 Y652 E660	R212-R214 PolarHBondContact O-N 2.7Å; R212-Y652 WeakPolarHBondContact CB-OH 3.34Å; R212-E660 IonicContact CZ-OE1 2.84Å; R212-E660 IonicContact NH2-OE1 3.97Å; R212-E660 PolarHBondContact NH2-OE1 3.04Å
213	L	91.9	Very high	91.2	Very high	11 Å²	11	46 Å²	46	6%	0.058	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-84.9	6.9	-177.6	-56.1	-180	0	0	0	112.9	G211 S215 M216 L217 L566 Y652 L655	G211-L213 VanDerWaalsContact C-N 3.29Å; G211-L213 PolarHBondContact O-N 3.04Å; L213-S215 PolarHBondContact O-N 2.79Å; L213-S215 VanDerWaalsContact O-N 3.12Å; L213-M216 HydrophobicContact CB-CG 4.11Å; L213-M216 HydrophobicContact CB-SD 4.49Å; L213-M216 HydrophobicContact CD2-CE 4.42Å; L213-M216 HydrophobicContact CD2-SD 3.93Å; L213-M216 VanDerWaalsContact O-CG 3.22Å; L213-M216 WeakPolarHBondContact O-CG 3.49Å; L213-M216 PolarHBondContact O-N 3.12Å; L213-L217 VanDerWaalsContact O-CB 3.31Å; L213-L217 WeakPolarHBondContact O-CB 3.28Å; L213-L217 PolarHBondContact O-N 2.8Å; L213-L566 HydrophobicContact CD1-CB 4.49Å; L213-Y652 HydrophobicContact CD1-CD2 3.97Å; L213-Y652 HydrophobicContact CD1-CE2 3.87Å; L213-Y652 HydrophobicContact CD2-CE2 4.25Å; L213-Y652 HydrophobicContact CG-CD2 4.42Å; L213-Y652 HydrophobicContact CG-CE2 3.89Å; L213-L655 HydrophobicContact CD1-CD1 3.76Å; L213-L655 HydrophobicContact CD2-CB 3.87Å
214	R	92.3	Very high	91.1	Very high	163 Å²	163	44.2 Å²	44.2	62%	0.615	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-53.9	-33	-175.5	70.6	-177.7	-174.9	-164.4	-0	114.3	L210 G211 R212 M216	L210-R214 HydrophobicContact CB-CB 3.7Å; G211-R214 WeakPolarHBondContact O-CB 3.41Å; G211-R214 PolarHBondContact O-N 2.79Å; R212-R214 PolarHBondContact O-N 2.7Å; R214-M216 VanDerWaalsContact C-N 3.29Å; R214-M216 PolarHBondContact O-N 3.09Å
215	S	92	Very high	91	Very high	28 Å²	28	43.4 Å²	43.4	20%	0.196	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-66	-33.9	-179.6	47.7	0	0	0	0	111.7	L213 V540 C541 D659	L213-S215 PolarHBondContact O-N 2.79Å; L213-S215 VanDerWaalsContact O-N 3.12Å; S215-V540 WeakPolarHBondContact O-CG1 3.43Å; S215-C541 CarbonylContact O-C 3.53Å; S215-C541 VanDerWaalsContact O-C 3.27Å; S215-C541 PolarHBondContact O-N 3.09Å; S215-D659 PolarHBondContact OG-OD1 2.77Å
216	M	95.1	Very high	90.6	Very high	6 Å²	6	39.4 Å²	39.4	3%	0.03	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.2	-10.3	-173	66.3	173.6	64.7	0	0	114.6	L213 R214 C541 P542 L543 L567 Q571 L655 D659	L213-M216 HydrophobicContact CB-CG 4.11Å; L213-M216 HydrophobicContact CB-SD 4.49Å; L213-M216 HydrophobicContact CD2-CE 4.42Å; L213-M216 HydrophobicContact CD2-SD 3.93Å; L213-M216 VanDerWaalsContact O-CG 3.22Å; L213-M216 WeakPolarHBondContact O-CG 3.49Å; L213-M216 PolarHBondContact O-N 3.12Å; R214-M216 VanDerWaalsContact C-N 3.29Å; R214-M216 PolarHBondContact O-N 3.09Å; M216-C541 WeakPolarHBondContact CA-O 3.47Å; M216-P542 CarbonylContact O-C 3.54Å; M216-P542 WeakPolarHBondContact O-CA 3.35Å; M216-L543 HydrophobicContact CB-CB 4Å; M216-L543 PolarHBondContact O-N 3.06Å; M216-L543 HydrophobicContact SD-CD2 4.25Å; M216-L567 HydrophobicContact CG-CD2 4.36Å; M216-L567 HydrophobicContact SD-CD2 4.38Å; M216-Q571 PolarHBondContact O-NE2 2.87Å; M216-L655 WeakPolarHBondContact CE-O 3.49Å; M216-L655 HydrophobicContact SD-CB 3.97Å; M216-L655 HydrophobicContact SD-CD2 4.28Å; M216-D659 HydrophobicContact CE-CB 3.38Å
217	L	94.3	Very high	90.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.184	C	C	.	.	S	Bend	trans	-84.6	131.8	-178.2	-172.3	151.9	0	0	0	109.6	W191 L210 L213 P219	W191-L217 HydrophobicContact CE3-CD1 3.97Å; W191-L217 HydrophobicContact CE3-CD2 3.79Å; W191-L217 HydrophobicContact CE3-CG 4.43Å; W191-L217 HydrophobicContact CZ3-CD1 4.24Å; W191-L217 HydrophobicContact CZ3-CD2 3.76Å; W191-L217 HydrophobicContact CZ3-CG 4.35Å; L210-L217 HydrophobicContact CD1-CD2 4.15Å; L210-L217 HydrophobicContact CD2-CD2 3.77Å; L210-L217 HydrophobicContact CG-CD2 4.48Å; L213-L217 VanDerWaalsContact O-CB 3.31Å; L213-L217 WeakPolarHBondContact O-CB 3.28Å; L213-L217 PolarHBondContact O-N 2.8Å; L217-P219 WeakPolarHBondContact O-CD 3.29Å
218	L	93.9	Very high	89.5	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.005	18%	0.183	C	C	.	.			trans	-79.2	106.6	173.7	-179.9	60.3	0	0	0	109	C222 V223 I531 L536 N568 H570 Q571	L218-C222 HydrophobicContact CD1-CB 4.24Å; L218-V223 HydrophobicContact CD1-CG2 4.11Å; L218-V223 HydrophobicContact CD2-CG2 3.44Å; L218-V223 VanDerWaalsContact CD2-CG2 3.44Å; L218-V223 HydrophobicContact CG-CG2 3.44Å; L218-V223 VanDerWaalsContact CG-CG2 3.44Å; L218-I531 HydrophobicContact CD1-CG2 3.96Å; L218-I531 HydrophobicContact CD2-CD1 3.96Å; L218-I531 HydrophobicContact CD2-CG1 4.25Å; L218-L536 HydrophobicContact CD1-CD2 3.93Å; L218-N568 HydrophobicContact CB-CB 4.22Å; L218-N568 WeakPolarHBondContact O-CB 3.34Å; L218-N568 PolarHBondContact O-ND2 3.05Å; L218-H570 HydrophobicContact CD2-CB 4.39Å; L218-Q571 HydrophobicContact CB-CG 3.44Å; L218-Q571 VanDerWaalsContact CB-CG 3.44Å; L218-Q571 HydrophobicContact CD2-CG 3.91Å; L218-Q571 HydrophobicContact CG-CG 4.34Å
219	P	91	Very high	89	Confident	19 Å²	19	39.2 Å²	39.2	12%	0.123	19%	0.191	C	C	.	.			trans	-66	141	-173	-20.6	35.1	0	0	0	110.7	L210 L217 P221 C222	L210-P219 HydrophobicContact CD1-CB 4.23Å; L210-P219 HydrophobicContact CD1-CG 4.04Å; L217-P219 WeakPolarHBondContact O-CD 3.29Å; P219-P221 VanDerWaalsContact C-CD 3.41Å; P219-P221 VanDerWaalsContact C-N 3.3Å; P219-C222 WeakPolarHBondContact O-CB 3.32Å; P219-C222 PolarHBondContact O-N 3.02Å
220	P	90.1	Very high	88.9	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.006	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-51.9	-39.4	177.8	-26.8	34.4	0	0	0	115	C145 L157 W191 C222 V223	C145-P220 VanDerWaalsContact O-CB 3.3Å; C145-P220 WeakPolarHBondContact O-CB 3.45Å; C145-P220 VanDerWaalsContact O-CG 3.23Å; C145-P220 WeakPolarHBondContact O-CG 3.42Å; L157-P220 HydrophobicContact CD1-CG 4.22Å; W191-P220 HydrophobicContact CD2-CG 4.27Å; W191-P220 HydrophobicContact CE3-CG 4.27Å; W191-P220 HydrophobicContact CH2-CG 3.31Å; W191-P220 HydrophobicContact CZ2-CB 4.43Å; W191-P220 HydrophobicContact CZ2-CG 3.19Å; W191-P220 HydrophobicContact CZ3-CG 3.83Å; P220-C222 PolarHBondContact O-N 2.81Å; P220-C222 VanDerWaalsContact O-N 3.11Å; P220-V223 PolarHBondContact O-N 3.36Å
221	P	87.4	Confident	88.9	Confident	22 Å²	22	36.8 Å²	36.8	14%	0.143	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-63.1	-16.3	177.1	-25	36.6	0	0	0	115	L148 P219 K535	L148-P221 HydrophobicContact CD1-CB 4.35Å; L148-P221 WeakPolarHBondContact CD1-O 3.44Å; P219-P221 VanDerWaalsContact C-CD 3.41Å; P219-P221 VanDerWaalsContact C-N 3.3Å; P221-K535 WeakPolarHBondContact O-CD 3.39Å
222	C	90.6	Very high	88.8	Confident	4 Å²	4	37 Å²	37	3%	0.027	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-92.8	-2.7	177.9	-59.4	0	0	0	0	112.7	L218 P219 P220 I531 Q532 K535 L536	L218-C222 HydrophobicContact CD1-CB 4.24Å; P219-C222 WeakPolarHBondContact O-CB 3.32Å; P219-C222 PolarHBondContact O-N 3.02Å; P220-C222 PolarHBondContact O-N 2.81Å; P220-C222 VanDerWaalsContact O-N 3.11Å; C222-I531 CarbonylContact O-C 3.55Å; C222-I531 WeakPolarHBondContact O-CA 3.31Å; C222-Q532 PolarHBondContact O-N 2.94Å; C222-K535 PolarHBondContact SG-O 2.87Å; C222-K535 VanDerWaalsContact SG-O 3.39Å; C222-L536 HydrophobicContact CB-CD2 3.91Å; C222-L536 HydrophobicContact CB-CG 4.39Å
223	V	92.5	Very high	88.8	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	124.4	-179.5	-169.5	0	0	0	0	108.9	H147 L148 L218 P220 P529 H570	H147-V223 CarbonylContact C-O 3.58Å; H147-V223 WeakPolarHBondContact CA-O 3.4Å; H147-V223 HydrophobicContact CB-CB 3.86Å; H147-V223 HydrophobicContact CB-CG1 3.78Å; H147-V223 WeakPolarHBondContact CB-O 3.39Å; L148-V223 PolarHBondContact N-O 3.48Å; L218-V223 HydrophobicContact CD1-CG2 4.11Å; L218-V223 HydrophobicContact CD2-CG2 3.44Å; L218-V223 VanDerWaalsContact CD2-CG2 3.44Å; L218-V223 HydrophobicContact CG-CG2 3.44Å; L218-V223 VanDerWaalsContact CG-CG2 3.44Å; P220-V223 PolarHBondContact O-N 3.36Å; V223-P529 HydrophobicContact CG1-CB 3.67Å; V223-P529 HydrophobicContact CG1-CG 4.37Å; V223-H570 HydrophobicContact CG1-CB 4.29Å
224	R	89.9	Confident	88.8	Confident	94 Å²	94	32.8 Å²	32.8	36%	0.355	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	130.2	173.3	-173	-171.4	-70.4	147	-17.8	109	E530 Q532	R224-E530 HydrophobicContact CB-CB 4.34Å; R224-E530 WeakPolarHBondContact CD-OE2 3.18Å; R224-E530 IonicContact CZ-OE2 2.61Å; R224-E530 PolarHBondContact N-O 2.93Å; R224-E530 IonicContact NE-OE2 2.81Å; R224-E530 VanDerWaalsContact NH1-CD 3.29Å; R224-E530 IonicContact NH1-OE1 3.7Å; R224-E530 PolarHBondContact NH1-OE1 3.39Å; R224-E530 VanDerWaalsContact NH1-OE1 3.09Å; R224-E530 IonicContact NH1-OE2 3.22Å; R224-E530 PolarHBondContact NH1-OE2 2.97Å; R224-E530 PolarHBondContact O-N 3.46Å; R224-Q532 HydrophobicContact CB-CG 4.44Å
225	L	89.2	Confident	88.8	Confident	8 Å²	8	25 Å²	25	4%	0.042	12%	0.12	C	C	.	.			trans	-147.3	126.5	171.7	-174.8	75.5	0	0	0	109.8	H147 L148 S227 C235 I527 P529	H147-L225 HydrophobicContact CB-CB 4.34Å; L148-L225 PolarHBondContact O-N 2.93Å; L225-S227 PolarHBondContact O-N 2.8Å; L225-C235 HydrophobicContact CD2-CB 3.56Å; L225-I527 HydrophobicContact CD1-CG2 3.52Å; L225-I527 HydrophobicContact CD2-CG2 4.36Å; L225-I527 HydrophobicContact CG-CG2 4.44Å; L225-P529 HydrophobicContact CB-CB 4.45Å; L225-P529 HydrophobicContact CD1-CB 4.22Å
226	Q	83.6	Confident	88.9	Confident	14 Å²	14	23.7 Å²	23.7	7%	0.065	11%	0.111	C	C	.	.			trans	-91.9	101.6	175.6	-56.9	-173.4	-3.7	0	0	109.3	Q150 Q452 F503	Q150-Q226 HydrophobicContact CG-CG 4.02Å; Q226-Q452 PolarHBondContact OE1-O 3.34Å; Q226-F503 HydrophobicContact CB-CE1 3.76Å; Q226-F503 HydrophobicContact CB-CZ 3.98Å
227	S	76.9	Confident	88.7	Confident	10 Å²	10	24 Å²	24	7%	0.07	11%	0.112	C	C	.	.			trans	-107.2	16.3	-169.2	61.7	0	0	0	0	115.2	L225 N229 F230 C235	L225-S227 PolarHBondContact O-N 2.8Å; S227-N229 VanDerWaalsContact C-N 3.28Å; S227-N229 PolarHBondContact O-N 2.84Å; S227-N229 VanDerWaalsContact O-N 3.08Å; S227-F230 PolarHBondContact O-N 2.83Å; S227-F230 VanDerWaalsContact O-O 3.14Å; S227-C235 WeakPolarHBondContact CB-SG 3.49Å
228	R	78.1	Confident	88.5	Confident	138 Å²	138	24.3 Å²	24.3	52%	0.521	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.5	-45.1	-167.3	-173.2	179.9	177.8	177	-1.4	114.1	F503	R228-F503 HydrophobicContact CB-CD1 3.9Å; R228-F503 HydrophobicContact CB-CD2 4.2Å; R228-F503 HydrophobicContact CB-CE1 3.77Å; R228-F503 HydrophobicContact CB-CE2 4.07Å; R228-F503 HydrophobicContact CB-CG 4.12Å; R228-F503 HydrophobicContact CB-CZ 3.86Å
229	N	80.4	Confident	87.9	Confident	47 Å²	47	26.5 Å²	26.5	25%	0.251	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	1	-178.2	-71.2	21	0	0	0	113.8	S227 E507	S227-N229 VanDerWaalsContact C-N 3.28Å; S227-N229 PolarHBondContact O-N 2.84Å; S227-N229 VanDerWaalsContact O-N 3.08Å; N229-E507 HydrophobicContact CB-CB 4.27Å; N229-E507 WeakPolarHBondContact CB-OE2 3.42Å; N229-E507 PolarHBondContact ND2-OE2 3.33Å
230	F	87.7	Confident	86.7	Confident	13 Å²	13	30 Å²	30	6%	0.057	15%	0.151	C	C	.	.	S	Bend	trans	-109.4	135.7	-173.8	-64.3	-75.1	0	0	0	111.6	S227 V453 A506 E507 Y510 I527	S227-F230 PolarHBondContact O-N 2.83Å; S227-F230 VanDerWaalsContact O-O 3.14Å; F230-V453 HydrophobicContact CE2-CG1 3.76Å; F230-V453 HydrophobicContact CE2-CG2 4.42Å; F230-V453 HydrophobicContact CZ-CG1 4.28Å; F230-A506 HydrophobicContact CE2-CB 4.16Å; F230-A506 HydrophobicContact CZ-CB 3.99Å; F230-E507 HydrophobicContact CE1-CB 4.44Å; F230-E507 HydrophobicContact CZ-CB 4.38Å; F230-Y510 HydrophobicContact CD1-CD1 4.38Å; F230-Y510 AromaticContact CE1-CD1 3.95Å; F230-Y510 HydrophobicContact CE1-CD1 3.95Å; F230-Y510 HydrophobicContact CE1-CD2 4.33Å; F230-Y510 AromaticContact CE1-CG 3.77Å; F230-Y510 HydrophobicContact CE1-CG 3.77Å; F230-I527 HydrophobicContact CB-CD1 3.62Å; F230-I527 HydrophobicContact CD1-CD1 3.36Å; F230-I527 HydrophobicContact CD1-CG1 4.27Å; F230-I527 HydrophobicContact CD2-CD1 3.98Å; F230-I527 HydrophobicContact CE1-CD1 3.92Å; F230-I527 HydrophobicContact CE1-CG1 4.37Å; F230-I527 HydrophobicContact CE2-CD1 4.49Å; F230-I527 HydrophobicContact CG-CD1 3.36Å; F230-I527 HydrophobicContact CG-CG1 4.45Å; F230-I527 HydrophobicContact CZ-CD1 4.45Å
231	S	88.9	Confident	84.9	Confident	31 Å²	31	33.1 Å²	33.1	22%	0.217	17%	0.173	C	C	.	.			trans	-64.8	155	173.9	88.8	0	0	0	0	110.5	M233 Q234 C235	S231-M233 PolarHBondContact O-N 3.36Å; S231-M233 PolarHBondContact OG-N 3.12Å; S231-Q234 WeakPolarHBondContact O-CB 3.24Å; S231-Q234 PolarHBondContact O-N 3.29Å; S231-Q234 VanDerWaalsContact O-N 3.12Å; S231-Q234 VanDerWaalsContact OG-CG 3.3Å; S231-Q234 WeakPolarHBondContact OG-CG 3.34Å; S231-Q234 PolarHBondContact OG-N 2.8Å; S231-C235 PolarHBondContact O-N 3.26Å; S231-C235 PolarHBondContact O-SG 2.91Å
232	K	89.1	Confident	82.4	Confident	31 Å²	31	36.1 Å²	36.1	14%	0.135	21%	0.208	C	C	.	.	H	α-helix	trans	-63.4	-29.6	177.3	-73.8	-65	-176.1	-170	0	112.4	A96 H147 C235 Y236	A96-K232 HydrophobicContact CB-CG 4.1Å; H147-K232 PolarHBondContact CE1-NZ 2.96Å; H147-K232 VanDerWaalsContact CE1-NZ 3.25Å; H147-K232 PolarHBondContact NE2-NZ 3.04Å; K232-C235 PolarHBondContact O-N 3.39Å; K232-Y236 HydrophobicContact CB-CD2 4.46Å; K232-Y236 HydrophobicContact CB-CE2 4.19Å; K232-Y236 HydrophobicContact CD-CE2 4.18Å; K232-Y236 VanDerWaalsContact O-CD2 3.23Å; K232-Y236 WeakPolarHBondContact O-CD2 3.22Å; K232-Y236 PolarHBondContact O-N 3.09Å
233	M	91.1	Very high	79.5	Confident	27 Å²	27	38.7 Å²	38.7	13%	0.133	23%	0.226	C	C	.	.	H	α-helix	trans	-59.4	-48.9	172.3	-65.5	-70.2	-77.8	0	0	110.7	C98 S231 Y236 R237 I238	C98-M233 VanDerWaalsContact CA-SD 3.53Å; C98-M233 HydrophobicContact CB-CG 4.41Å; C98-M233 HydrophobicContact CB-SD 3.35Å; C98-M233 WeakPolarHBondContact CB-SD 3.47Å; S231-M233 PolarHBondContact O-N 3.36Å; S231-M233 PolarHBondContact OG-N 3.12Å; M233-Y236 CarbonylContact O-C 3.55Å; M233-Y236 PolarHBondContact O-N 2.92Å; M233-R237 PolarHBondContact O-N 3.08Å; M233-I238 HydrophobicContact CB-CB 4.49Å; M233-I238 HydrophobicContact CE-CB 3.83Å; M233-I238 HydrophobicContact CE-CG2 3.28Å; M233-I238 PolarHBondContact O-N 3.21Å; M233-I238 HydrophobicContact SD-CB 3.89Å; M233-I238 HydrophobicContact SD-CD1 4.1Å; M233-I238 HydrophobicContact SD-CG2 3.78Å
234	Q	92	Very high	76.6	Confident	32 Å²	32	48.1 Å²	48.1	15%	0.15	27%	0.27	C	S	.	.	H	α-helix	trans	-62.5	-45.7	177.4	-60.5	168.7	-20.1	0	0	111.2	S231 Y236 R237 Y510 I527	S231-Q234 WeakPolarHBondContact O-CB 3.24Å; S231-Q234 PolarHBondContact O-N 3.29Å; S231-Q234 VanDerWaalsContact O-N 3.12Å; S231-Q234 VanDerWaalsContact OG-CG 3.3Å; S231-Q234 WeakPolarHBondContact OG-CG 3.34Å; S231-Q234 PolarHBondContact OG-N 2.8Å; Q234-Y236 VanDerWaalsContact C-N 3.26Å; Q234-Y236 PolarHBondContact O-N 3.24Å; Q234-R237 PolarHBondContact O-N 2.67Å; Q234-Y510 WeakPolarHBondContact CB-OH 3.41Å; Q234-Y510 HydrophobicContact CG-CE1 4.11Å; Q234-Y510 VanDerWaalsContact CG-OH 3.31Å; Q234-Y510 WeakPolarHBondContact CG-OH 3.23Å; Q234-I527 HydrophobicContact CB-CD1 3.85Å
235	C	91.9	Very high	73.8	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-60.4	-31.8	179.4	-67.2	0	0	0	0	114	L225 S227 S231 K232 R237 H570	L225-C235 HydrophobicContact CD2-CB 3.56Å; S227-C235 WeakPolarHBondContact CB-SG 3.49Å; S231-C235 PolarHBondContact O-N 3.26Å; S231-C235 PolarHBondContact O-SG 2.91Å; K232-C235 PolarHBondContact O-N 3.39Å; C235-R237 PolarHBondContact O-NH1 3.41Å; C235-R237 PolarHBondContact O-NH2 2.88Å; C235-H570 PolarHBondContact O-CE1 2.89Å
236	Y	92.5	Very high	71	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	6.9	177.6	-58	-36	0	0	0	112.9	V126 C146 H147 K232 M233 Q234 I238 P569 H570	V126-Y236 HydrophobicContact CG2-CD2 3.69Å; V126-Y236 HydrophobicContact CG2-CE2 3.88Å; C146-Y236 HydrophobicContact CB-CE1 3.9Å; C146-Y236 WeakPolarHBondContact CB-OH 3.44Å; H147-Y236 AromaticContact CE1-CE1 3.88Å; H147-Y236 AromaticContact ND1-CE1 3.83Å; K232-Y236 HydrophobicContact CB-CD2 4.46Å; K232-Y236 HydrophobicContact CB-CE2 4.19Å; K232-Y236 HydrophobicContact CD-CE2 4.18Å; K232-Y236 VanDerWaalsContact O-CD2 3.23Å; K232-Y236 WeakPolarHBondContact O-CD2 3.22Å; K232-Y236 PolarHBondContact O-N 3.09Å; M233-Y236 CarbonylContact O-C 3.55Å; M233-Y236 PolarHBondContact O-N 2.92Å; Q234-Y236 VanDerWaalsContact C-N 3.26Å; Q234-Y236 PolarHBondContact O-N 3.24Å; Y236-I238 HydrophobicContact CD2-CD1 4.34Å; Y236-I238 PolarHBondContact O-N 3.31Å; Y236-P569 HydrophobicContact CD1-CB 3.95Å; Y236-P569 HydrophobicContact CD2-CB 4.49Å; Y236-P569 HydrophobicContact CG-CB 3.96Å; Y236-H570 AromaticContact CD1-CE1 3.65Å; Y236-H570 AromaticContact CD1-NE2 3.62Å; Y236-H570 AromaticContact CE1-CE1 3.8Å; Y236-H570 AromaticContact CE1-NE2 3.31Å; Y236-H570 VanDerWaalsContact CE1-NE2 3.31Å; Y236-H570 WeakPolarHBondContact CE1-NE2 3.43Å
237	R	92.8	Very high	68.3	Low	11 Å²	11	60 Å²	60	4%	0.042	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.5	36.5	-179.5	-60.1	151.1	-69.5	-64.9	-15.8	111.8	M233 Q234 C235 L526 I527 H570 N577	M233-R237 PolarHBondContact O-N 3.08Å; Q234-R237 PolarHBondContact O-N 2.67Å; C235-R237 PolarHBondContact O-NH1 3.41Å; C235-R237 PolarHBondContact O-NH2 2.88Å; R237-L526 HydrophobicContact CG-CB 4.44Å; R237-L526 HydrophobicContact CG-CD2 4.17Å; R237-I527 PolarHBondContact NH1-O 2.95Å; R237-H570 PolarHBondContact NH2-ND1 3.39Å; R237-N577 PolarHBondContact O-ND2 2.96Å
238	I	90	Very high	66	Low	7 Å²	7	63 Å²	63	4%	0.036	35%	0.345	C	S	.	.			trans	-86.4	121.2	175.4	-55.4	174.4	0	0	0	106.9	C98 E125 V126 M233 Y236 E240	C98-I238 HydrophobicContact CB-CD1 3.81Å; E125-I238 HydrophobicContact CB-CD1 4.13Å; E125-I238 VanDerWaalsContact CD-CG2 3.45Å; E125-I238 WeakPolarHBondContact OE1-CG2 3.26Å; E125-I238 WeakPolarHBondContact OE2-CG2 3.5Å; V126-I238 HydrophobicContact CG2-CD1 4.15Å; M233-I238 HydrophobicContact CB-CB 4.49Å; M233-I238 HydrophobicContact CE-CB 3.83Å; M233-I238 HydrophobicContact CE-CG2 3.28Å; M233-I238 PolarHBondContact O-N 3.21Å; M233-I238 HydrophobicContact SD-CB 3.89Å; M233-I238 HydrophobicContact SD-CD1 4.1Å; M233-I238 HydrophobicContact SD-CG2 3.78Å; Y236-I238 HydrophobicContact CD2-CD1 4.34Å; Y236-I238 PolarHBondContact O-N 3.31Å; I238-E240 PolarHBondContact O-N 2.85Å
239	G	80.4	Confident	63.8	Low	48 Å²	48	63.2 Å²	63.2	50%	0.495	35%	0.346	S	S	.	.			trans	-60.9	127.3	177.3	0	0	0	0	0	110.5	S241	G239-S241 PolarHBondContact O-N 2.71Å; G239-S241 VanDerWaalsContact O-N 3.14Å
240	E	66.3	Low	61.8	Low	93 Å²	93	67.1 Å²	67.1	44%	0.435	37%	0.366	S	S	.	.			trans	-68.1	108	163.7	-69.8	169.9	-176.3	0	0	105.5	I238 G242	I238-E240 PolarHBondContact O-N 2.85Å; E240-G242 PolarHBondContact O-N 2.78Å
241	S	51.4	Low	59.3	Low	65 Å²	65	71.7 Å²	71.7	46%	0.455	39%	0.388	S	S	.	.			trans	-53.1	120.5	176.3	36.6	0	0	0	0	108.1	G239 S243	G239-S241 PolarHBondContact O-N 2.71Å; G239-S241 VanDerWaalsContact O-N 3.14Å; S241-S243 PolarHBondContact O-N 2.99Å
242	G	35	Very low	56.6	Low	85 Å²	85	72.1 Å²	72.1	88%	0.876	39%	0.393	S	S	*	.			trans	-63.6	78.7	174.8	0	0	0	0	0	110.6	E240	E240-G242 PolarHBondContact O-N 2.78Å
243	S	30.7	Very low	53.9	Low	59 Å²	59	79.1 Å²	79.1	41%	0.413	43%	0.427	S	S	.	.			trans	-86.9	139.2	144.6	53.8	0	0	0	0	106.9	S241 D245	S241-S243 PolarHBondContact O-N 2.99Å; S243-D245 PolarHBondContact O-N 3.11Å
244	Q	30.7	Very low	51.1	Low	197 Å²	197	81.3 Å²	81.3	92%	0.921	44%	0.443	S	S	*	.	S	Bend	trans	-63.6	38.6	-177.4	-111.4	172.1	-27.6	0	0	114.8
245	D	31	Very low	48.1	Very low	60 Å²	60	83.6 Å²	83.6	32%	0.321	47%	0.467	S	S	.	.			trans	-136.6	48.8	175.9	-15	-98.8	0	0	0	111.8	S243 N247 N248 W249	S243-D245 PolarHBondContact O-N 3.11Å; D245-N247 PolarHBondContact O-N 3.38Å; D245-N248 HydrophobicContact CB-CB 3.97Å; D245-N248 PolarHBondContact O-N 3.19Å; D245-N248 VanDerWaalsContact O-N 3.07Å; D245-W249 WeakPolarHBondContact OD2-CZ2 3.41Å; D245-W249 PolarHBondContact OD2-NE1 3.11Å
246	R	30.1	Very low	45.3	Very low	154 Å²	154	88 Å²	88	58%	0.581	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	4	177.5	-103.5	-178.3	87.6	-165.6	0.5	115.7
247	N	27.4	Very low	42.4	Very low	152 Å²	152	91.9 Å²	91.9	81%	0.813	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.1	3.3	167.6	-78.9	-26.2	0	0	0	114.2	D245	D245-N247 PolarHBondContact O-N 3.38Å
248	N	28.4	Very low	39.4	Very low	73 Å²	73	94.4 Å²	94.4	39%	0.39	56%	0.559	S	S	.	*			trans	-125.2	23	-167.4	-115.3	54.1	0	0	0	113.9	D245 E251 A252	D245-N248 HydrophobicContact CB-CB 3.97Å; D245-N248 PolarHBondContact O-N 3.19Å; D245-N248 VanDerWaalsContact O-N 3.07Å; N248-E251 HydrophobicContact CB-CB 4.41Å; N248-E251 PolarHBondContact ND2-O 3.35Å; N248-E251 CarbonylContact O-C 3.52Å; N248-E251 PolarHBondContact O-N 3.34Å; N248-E251 PolarHBondContact OD1-OE2 3.39Å; N248-A252 WeakPolarHBondContact O-CA 3.49Å; N248-A252 WeakPolarHBondContact O-CB 3.44Å; N248-A252 PolarHBondContact O-N 2.97Å
249	W	32.4	Very low	36.5	Very low	142 Å²	142	99.1 Å²	99.1	54%	0.538	59%	0.59	S	S	.	*	S	Bend	trans	-102.9	-6.6	174.2	-69	100.8	0	0	0	114.7	D245 A252	D245-W249 WeakPolarHBondContact OD2-CZ2 3.41Å; D245-W249 PolarHBondContact OD2-NE1 3.11Å; W249-A252 HydrophobicContact CD2-CB 3.91Å; W249-A252 HydrophobicContact CE3-CB 3.33Å; W249-A252 HydrophobicContact CZ3-CB 3.71Å
250	D	37.7	Very low	34.2	Very low	129 Å²	129	108.7 Å²	108.7	69%	0.69	61%	0.611	S	S	*	*	S	Bend	trans	-82.8	-5.2	149.2	-73.7	-24.8	0	0	0	110.9	R285	D250-R285 PolarHBondContact O-NH1 2.65Å; D250-R285 VanDerWaalsContact O-NH1 3.1Å
251	E	36.4	Very low	32.7	Very low	110 Å²	110	110.1 Å²	110.1	51%	0.514	62%	0.618	S	S	.	*	S	Bend	trans	-136.8	29	-176.7	-55.1	-166.8	145.6	0	0	113.4	N248 E253	N248-E251 HydrophobicContact CB-CB 4.41Å; N248-E251 PolarHBondContact ND2-O 3.35Å; N248-E251 CarbonylContact O-C 3.52Å; N248-E251 PolarHBondContact O-N 3.34Å; N248-E251 PolarHBondContact OD1-OE2 3.39Å; E251-E253 PolarHBondContact O-N 2.95Å
252	A	30.3	Very low	31.6	Very low	39 Å²	39	114.5 Å²	114.5	32%	0.322	64%	0.635	S	S	.	*			trans	-92.5	102.2	-178.1	0	0	0	0	0	105.8	N248 W249 P254	N248-A252 WeakPolarHBondContact O-CA 3.49Å; N248-A252 WeakPolarHBondContact O-CB 3.44Å; N248-A252 PolarHBondContact O-N 2.97Å; W249-A252 HydrophobicContact CD2-CB 3.91Å; W249-A252 HydrophobicContact CE3-CB 3.33Å; W249-A252 HydrophobicContact CZ3-CB 3.71Å; A252-P254 WeakPolarHBondContact O-CD 3.41Å
253	E	33.7	Very low	31.4	Very low	179 Å²	179	119.5 Å²	119.5	84%	0.836	64%	0.635	S	S	*	*			trans	-44.6	114	173.3	-69.4	-152.3	149.9	0	0	110.4	E251 A255	E251-E253 PolarHBondContact O-N 2.95Å; E253-A255 PolarHBondContact O-N 3.25Å
254	P	32.9	Very low	31.3	Very low	73 Å²	73	120.9 Å²	120.9	47%	0.474	65%	0.645	S	S	.	*			trans	-72.6	95.8	153.6	18.3	-3.8	0	0	0	104.6	A252 A256 F287	A252-P254 WeakPolarHBondContact O-CD 3.41Å; P254-A256 PolarHBondContact O-N 3.27Å; P254-A256 VanDerWaalsContact O-N 3.09Å; P254-F287 HydrophobicContact CG-CD2 4.45Å; P254-F287 HydrophobicContact CG-CE2 4.25Å
255	A	28.6	Very low	31.2	Very low	80 Å²	80	115.8 Å²	115.8	66%	0.661	64%	0.637	S	S	*	*			trans	-42.9	125.4	160.6	0	0	0	0	0	107.1	E253 A257	E253-A255 PolarHBondContact O-N 3.25Å; A255-A257 PolarHBondContact O-N 2.88Å
256	A	33.5	Very low	31.1	Very low	91 Å²	91	117 Å²	117	75%	0.752	66%	0.655	S	S	*	*			trans	-54.3	81.7	-170.9	0	0	0	0	0	112.4	P254	P254-A256 PolarHBondContact O-N 3.27Å; P254-A256 VanDerWaalsContact O-N 3.09Å
257	A	30	Very low	31.2	Very low	83 Å²	83	116.1 Å²	116.1	69%	0.686	67%	0.67	S	S	*	*			trans	-99	98.8	170.8	0	0	0	0	0	106.5	A255	A255-A257 PolarHBondContact O-N 2.88Å
258	A	30.2	Very low	31.5	Very low	63 Å²	63	116.5 Å²	116.5	52%	0.521	67%	0.666	S	S	.	*			trans	-42.2	147.2	167.9	0	0	0	0	0	110.8	R260	A258-R260 PolarHBondContact O-N 3.47Å
259	P	29.1	Very low	31.9	Very low	106 Å²	106	118.3 Å²	118.3	69%	0.688	68%	0.68	S	S	*	*			trans	-55.9	111.3	167.2	15.6	-20.5	0	0	0	108.4	E261	P259-E261 PolarHBondContact O-N 3.03Å
260	R	33.2	Very low	32.5	Very low	249 Å²	249	117.7 Å²	117.7	94%	0.94	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	69.7	168.9	-81.9	-172.2	169.2	-173.7	-1.7	108.8	A258	A258-R260 PolarHBondContact O-N 3.47Å
261	E	32.8	Very low	33.7	Very low	124 Å²	124	117.9 Å²	117.9	58%	0.579	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-164.7	26.8	173.4	-116.9	176.1	-152.6	0	0	113.9	K114 P259	K114-E261 IonicContact NZ-OE2 3.55Å; K114-E261 PolarHBondContact NZ-OE2 2.79Å; P259-E261 PolarHBondContact O-N 3.03Å
262	L	30.1	Very low	35.8	Very low	157 Å²	157	117 Å²	117	82%	0.822	69%	0.688	S	S	*	*	S	Bend	trans	-86.5	11.5	158.2	-126.5	89.3	0	0	0	113.1
263	Q	29.3	Very low	38.6	Very low	189 Å²	189	118.5 Å²	118.5	88%	0.883	69%	0.693	S	S	*	*			trans	-125.2	65.7	-178.9	-67.9	-177.5	3.1	0	0	111.6
264	S	30.3	Very low	41.2	Very low	89 Å²	89	110.2 Å²	110.2	62%	0.622	65%	0.654	S	S	*	*	S	Bend	trans	-152.7	54.1	147	66.8	0	0	0	0	111.4
265	A	28.3	Very low	44	Very low	90 Å²	90	111 Å²	111	74%	0.744	65%	0.65	S	S	*	*	S	Bend	trans	-150.9	149.2	154.8	0	0	0	0	0	107
266	A	29.1	Very low	47.1	Very low	84 Å²	84	107.1 Å²	107.1	69%	0.694	62%	0.619	S	S	*	*			trans	-47.2	156.2	179.8	0	0	0	0	0	112.9	E268	A266-E268 PolarHBondContact O-N 3.12Å
267	P	30.7	Very low	50	Low	137 Å²	137	103.5 Å²	103.5	89%	0.89	59%	0.586	S	S	*	*			trans	-72.4	92	-165.1	31.3	-34.7	0	0	0	111.3
268	E	33.6	Very low	53	Low	159 Å²	159	99.6 Å²	99.6	74%	0.743	55%	0.553	S	S	*	*			trans	-87.7	113.6	163.3	-73	-172.9	169.4	0	0	108.8	A266	A266-E268 PolarHBondContact O-N 3.12Å
269	T	38.1	Very low	55.9	Low	112 Å²	112	96.6 Å²	96.6	69%	0.687	53%	0.529	S	S	*	.			trans	28.8	120	157.8	57.7	0	0	0	0	117.2	K271	T269-K271 PolarHBondContact O-N 2.98Å
270	S	44.7	Very low	58.9	Low	129 Å²	129	93.5 Å²	93.5	90%	0.902	51%	0.506	S	S	*	.			trans	-42	91	170.2	43.2	0	0	0	0	113.3	Q272	S270-Q272 PolarHBondContact O-N 2.99Å
271	K	62	Low	61.5	Low	133 Å²	133	82.8 Å²	82.8	58%	0.578	47%	0.468	S	S	*	.			trans	-70.6	112.9	175.8	-72.6	-179.9	-176	168.7	0	107.5	T269	T269-K271 PolarHBondContact O-N 2.98Å
272	Q	81.6	Confident	64.1	Low	90 Å²	90	77 Å²	77	42%	0.421	44%	0.442	S	S	.	.			trans	-58.8	135.8	173.6	-169.2	168.1	3.5	0	0	108.8	S270 S293	S270-Q272 PolarHBondContact O-N 2.99Å; Q272-S293 WeakPolarHBondContact O-CB 3.49Å; Q272-S293 PolarHBondContact O-N 3.33Å
273	V	87.9	Confident	66.9	Low	72 Å²	72	71.8 Å²	71.8	44%	0.436	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	149	179.2	-69	0	0	0	0	109.3	A291	V273-A291 CarbonylContact C-O 3.56Å; V273-A291 VanDerWaalsContact CA-O 3.29Å; V273-A291 WeakPolarHBondContact CA-O 3.33Å
274	F	89.3	Confident	69.7	Low	4 Å²	4	71 Å²	71	2%	0.018	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	155.8	177.2	70.2	-85.8	0	0	0	110.8	V276 L290 A291 E301 L320 D341 R343	F274-V276 HydrophobicContact CD2-CB 4.29Å; F274-V276 HydrophobicContact CE2-CB 3.85Å; F274-V276 HydrophobicContact CE2-CG2 4.37Å; F274-L290 WeakPolarHBondContact O-CA 3.42Å; F274-A291 HydrophobicContact CD1-CB 4.21Å; F274-A291 VanDerWaalsContact CD1-O 3.28Å; F274-A291 WeakPolarHBondContact CD1-O 3.48Å; F274-A291 HydrophobicContact CE1-CB 3.65Å; F274-A291 HydrophobicContact CE2-CB 4.14Å; F274-A291 HydrophobicContact CZ-CB 3.61Å; F274-A291 PolarHBondContact N-O 3.08Å; F274-A291 PolarHBondContact O-N 3.21Å; F274-E301 HydrophobicContact CE1-CB 4.2Å; F274-E301 HydrophobicContact CE1-CG 4.45Å; F274-E301 HydrophobicContact CZ-CB 4.23Å; F274-L320 HydrophobicContact CE2-CD1 4.25Å; F274-L320 HydrophobicContact CE2-CD2 4.43Å; F274-L320 HydrophobicContact CZ-CD1 4.04Å; F274-D341 HydrophobicContact CB-CB 4.38Å; F274-D341 WeakPolarHBondContact CB-O 3.45Å; F274-R343 HydrophobicContact CD2-CB 4.2Å; F274-R343 HydrophobicContact CD2-CG 4.12Å; F274-R343 HydrophobicContact CE2-CB 4.25Å; F274-R343 HydrophobicContact CE2-CG 4.45Å
275	K	91.9	Very high	72.2	Confident	89 Å²	89	73 Å²	73	39%	0.387	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	127.6	174.5	-61.6	-177	-180	176.3	0	108.8	F277 F288 L290 D341 A342 R343	K275-F277 HydrophobicContact CB-CE2 4.46Å; K275-F288 HydrophobicContact CB-CB 4.2Å; K275-F288 HydrophobicContact CB-CD2 3.8Å; K275-F288 HydrophobicContact CB-CE2 4.43Å; K275-F288 HydrophobicContact CB-CG 4.02Å; K275-F288 HydrophobicContact CD-CD1 4.11Å; K275-F288 HydrophobicContact CD-CD2 3.88Å; K275-F288 HydrophobicContact CD-CE1 4.03Å; K275-F288 HydrophobicContact CD-CE2 3.8Å; K275-F288 HydrophobicContact CD-CG 4.05Å; K275-F288 HydrophobicContact CD-CZ 3.88Å; K275-F288 HydrophobicContact CG-CD2 3.57Å; K275-F288 HydrophobicContact CG-CE2 3.7Å; K275-F288 HydrophobicContact CG-CG 4.1Å; K275-F288 HydrophobicContact CG-CZ 4.31Å; K275-L290 HydrophobicContact CG-CD2 4.14Å; K275-D341 PolarHBondContact N-O 3.16Å; K275-A342 HydrophobicContact CB-CB 4.48Å; K275-A342 WeakPolarHBondContact O-CA 3.47Å; K275-R343 PolarHBondContact O-N 3.07Å
276	V	93.1	Very high	74.9	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	133.6	176.5	58.9	0	0	0	0	111.4	F274 F288 R289 A291 A305 A308 F309 L320 R343 L345	F274-V276 HydrophobicContact CD2-CB 4.29Å; F274-V276 HydrophobicContact CE2-CB 3.85Å; F274-V276 HydrophobicContact CE2-CG2 4.37Å; V276-F288 WeakPolarHBondContact O-CA 3.38Å; V276-F288 WeakPolarHBondContact O-CB 3.43Å; V276-R289 HydrophobicContact CG1-CB 4.1Å; V276-R289 VanDerWaalsContact CG1-O 3.28Å; V276-R289 WeakPolarHBondContact CG1-O 3.31Å; V276-R289 PolarHBondContact N-O 3.24Å; V276-R289 PolarHBondContact O-N 2.92Å; V276-A291 HydrophobicContact CG1-CB 3.95Å; V276-A305 HydrophobicContact CG2-CB 3.8Å; V276-A308 HydrophobicContact CG1-CB 4.31Å; V276-F309 HydrophobicContact CB-CE2 4.35Å; V276-F309 HydrophobicContact CG1-CD2 4.43Å; V276-F309 HydrophobicContact CG1-CE2 3.75Å; V276-F309 HydrophobicContact CG2-CE2 4.09Å; V276-F309 WeakPolarHBondContact O-CE2 3.35Å; V276-F309 WeakPolarHBondContact O-CZ 3.24Å; V276-L320 HydrophobicContact CG2-CD2 4.07Å; V276-R343 CarbonylContact C-O 3.56Å; V276-R343 VanDerWaalsContact CA-O 3.29Å; V276-R343 WeakPolarHBondContact CA-O 3.46Å; V276-L345 HydrophobicContact CG2-CB 4.27Å
277	F	94	Very high	77.5	Confident	14 Å²	14	69.3 Å²	69.3	6%	0.061	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	146	173.3	-58.5	-93.9	0	0	0	109	K275 A282 L283 F287 F288 V323 A342 R343 V344 L345	K275-F277 HydrophobicContact CB-CE2 4.46Å; F277-A282 HydrophobicContact CB-CB 4.43Å; F277-A282 HydrophobicContact CD1-CB 4.36Å; F277-L283 HydrophobicContact CD1-CB 4.25Å; F277-L283 HydrophobicContact CD1-CD1 4.12Å; F277-L283 HydrophobicContact CD2-CD1 3.96Å; F277-L283 HydrophobicContact CE1-CD1 4.05Å; F277-L283 HydrophobicContact CE2-CD1 3.93Å; F277-L283 HydrophobicContact CG-CB 4.43Å; F277-L283 HydrophobicContact CG-CD1 4.07Å; F277-L283 HydrophobicContact CZ-CD1 3.96Å; F277-F287 WeakPolarHBondContact CD1-O 3.22Å; F277-F288 HydrophobicContact CD1-CB 4.02Å; F277-F288 HydrophobicContact CD2-CB 4.47Å; F277-F288 HydrophobicContact CE1-CB 3.73Å; F277-F288 HydrophobicContact CE1-CD1 4.41Å; F277-F288 HydrophobicContact CE2-CB 4.18Å; F277-F288 HydrophobicContact CG-CB 4.4Å; F277-F288 HydrophobicContact CZ-CB 3.81Å; F277-F288 HydrophobicContact CZ-CD1 4.28Å; F277-F288 HydrophobicContact CZ-CG 4.4Å; F277-V323 HydrophobicContact CD2-CG2 4.35Å; F277-V323 HydrophobicContact CE2-CG2 4.36Å; F277-A342 HydrophobicContact CE2-CB 4.15Å; F277-R343 WeakPolarHBondContact CD2-O 2.9Å; F277-R343 PolarHBondContact N-O 2.65Å; F277-V344 HydrophobicContact CB-CG1 4.42Å; F277-V344 HydrophobicContact CB-CG2 4.29Å; F277-L345 PolarHBondContact O-N 3.03Å
278	D	92.7	Very high	80.4	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.005	33%	0.331	C	S	.	.	S	Bend	trans	-95.2	4.6	179.3	70.2	-49.4	0	0	0	113.9	A282 F309 S432 L433 R434	D278-A282 WeakPolarHBondContact OD1-CB 3.48Å; D278-F309 HydrophobicContact CB-CD1 3.83Å; D278-F309 HydrophobicContact CB-CD2 4.1Å; D278-F309 HydrophobicContact CB-CE1 3.8Å; D278-F309 HydrophobicContact CB-CE2 4.05Å; D278-F309 HydrophobicContact CB-CG 3.99Å; D278-F309 HydrophobicContact CB-CZ 3.91Å; D278-S432 WeakPolarHBondContact O-CA 3.22Å; D278-S432 PolarHBondContact OD2-OG 2.96Å; D278-L433 WeakPolarHBondContact O-CG 3.39Å; D278-L433 PolarHBondContact O-N 3.4Å; D278-R434 WeakPolarHBondContact OD2-CB 3.41Å; D278-R434 PolarHBondContact OD2-N 2.91Å
279	G	92.8	Very high	83	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.306	C	S	.	.	S	Bend	trans	163.7	-173.5	177.4	0	0	0	0	0	113.3	A282 L283 L431	G279-A282 PolarHBondContact O-N 3.26Å; G279-L283 PolarHBondContact O-N 3Å; G279-L283 VanDerWaalsContact O-N 3.1Å; G279-L431 CarbonylContact C-O 3.57Å; G279-L431 WeakPolarHBondContact CA-O 3.45Å
280	D	90.8	Very high	85.5	Confident	41 Å²	41	59.5 Å²	59.5	22%	0.219	29%	0.294	C	S	.	.	H	α-helix	trans	-67.7	-36.3	-175.5	-66.8	-15.3	0	0	0	112.8	L283 R284 R346 K430 L431	D280-L283 PolarHBondContact O-N 3.11Å; D280-R284 WeakPolarHBondContact O-CG 3.38Å; D280-R284 PolarHBondContact O-N 2.82Å; D280-R346 IonicContact OD1-CZ 3.85Å; D280-R346 IonicContact OD1-NH1 3.57Å; D280-R346 PolarHBondContact OD1-NH1 3.34Å; D280-R346 IonicContact OD1-NH2 2.92Å; D280-R346 PolarHBondContact OD1-NH2 3.22Å; D280-R346 IonicContact OD2-NH1 3.68Å; D280-K430 PolarHBondContact N-O 2.62Å; D280-L431 PolarHBondContact N-O 2.87Å; D280-L431 VanDerWaalsContact N-O 3.15Å
281	D	88	Confident	87.6	Confident	25 Å²	25	53.4 Å²	53.4	13%	0.134	25%	0.252	C	S	.	.	H	α-helix	trans	-64	-46.2	178.7	-178.7	64.4	0	0	0	110.9	L283 R284 R285 L431	D281-L283 VanDerWaalsContact C-N 3.31Å; D281-L283 PolarHBondContact O-N 2.98Å; D281-R284 PolarHBondContact O-N 3.08Å; D281-R285 WeakPolarHBondContact O-CB 3.47Å; D281-R285 VanDerWaalsContact O-CG 3.31Å; D281-R285 WeakPolarHBondContact O-CG 3.31Å; D281-R285 PolarHBondContact O-N 3.31Å; D281-R285 IonicContact OD1-CZ 2.76Å; D281-R285 IonicContact OD1-NE 2.98Å; D281-R285 PolarHBondContact OD1-NE 2.82Å; D281-R285 IonicContact OD1-NH2 3.94Å; D281-R285 IonicContact OD2-CZ 3.84Å; D281-R285 IonicContact OD2-NE 2.97Å; D281-R285 PolarHBondContact OD2-NE 3.35Å; D281-L431 WeakPolarHBondContact CB-O 3.36Å; D281-L431 PolarHBondContact N-O 2.9Å; D281-L431 VanDerWaalsContact N-O 3.08Å
282	A	87.3	Confident	88.8	Confident	3 Å²	3	49.8 Å²	49.8	3%	0.025	24%	0.241	C	C	.	.	H	α-helix	trans	-62.8	-38.9	176.2	0	0	0	0	0	111.9	F277 D278 G279 G286 F287	F277-A282 HydrophobicContact CB-CB 4.43Å; F277-A282 HydrophobicContact CD1-CB 4.36Å; D278-A282 WeakPolarHBondContact OD1-CB 3.48Å; G279-A282 PolarHBondContact O-N 3.26Å; A282-G286 CarbonylContact O-C 3.6Å; A282-G286 PolarHBondContact O-N 3.36Å; A282-F287 HydrophobicContact CB-CB 4.43Å; A282-F287 HydrophobicContact CB-CD1 4.47Å; A282-F287 WeakPolarHBondContact CB-O 3.37Å; A282-F287 PolarHBondContact O-N 3.19Å
283	L	88.4	Confident	88.8	Confident	47 Å²	47	46.6 Å²	46.6	25%	0.246	23%	0.229	C	C	.	.	H	α-helix	trans	-63.8	-48.2	175.7	-174.9	65	0	0	0	111.8	F277 G279 D280 D281 R285 G286 V323 V344	F277-L283 HydrophobicContact CD1-CB 4.25Å; F277-L283 HydrophobicContact CD1-CD1 4.12Å; F277-L283 HydrophobicContact CD2-CD1 3.96Å; F277-L283 HydrophobicContact CE1-CD1 4.05Å; F277-L283 HydrophobicContact CE2-CD1 3.93Å; F277-L283 HydrophobicContact CG-CB 4.43Å; F277-L283 HydrophobicContact CG-CD1 4.07Å; F277-L283 HydrophobicContact CZ-CD1 3.96Å; G279-L283 PolarHBondContact O-N 3Å; G279-L283 VanDerWaalsContact O-N 3.1Å; D280-L283 PolarHBondContact O-N 3.11Å; D281-L283 VanDerWaalsContact C-N 3.31Å; D281-L283 PolarHBondContact O-N 2.98Å; L283-R285 VanDerWaalsContact C-N 3.32Å; L283-R285 PolarHBondContact O-N 3.29Å; L283-G286 PolarHBondContact O-N 2.86Å; L283-G286 VanDerWaalsContact O-N 3.15Å; L283-V323 HydrophobicContact CD1-CG1 3.98Å; L283-V323 HydrophobicContact CD1-CG2 3.85Å; L283-V323 HydrophobicContact CD2-CG1 4.49Å; L283-V344 HydrophobicContact CD1-CG2 4.48Å; L283-V344 HydrophobicContact CD2-CG2 4.15Å
284	R	88.3	Confident	88	Confident	172 Å²	172	45.3 Å²	45.3	65%	0.649	22%	0.223	S	C	*	.	H	α-helix	trans	-61	-39.3	177.7	-74.6	-172.3	-62.8	-127.6	1.7	112.6	D280 D281 G286	D280-R284 WeakPolarHBondContact O-CG 3.38Å; D280-R284 PolarHBondContact O-N 2.82Å; D281-R284 PolarHBondContact O-N 3.08Å; R284-G286 VanDerWaalsContact C-N 3.3Å
285	R	84	Confident	86.7	Confident	131 Å²	131	56.1 Å²	56.1	49%	0.494	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-3.4	178.7	-64.6	176.4	-173.5	-112.5	-3.9	113.6	D250 D281 L283 F287	D250-R285 PolarHBondContact O-NH1 2.65Å; D250-R285 VanDerWaalsContact O-NH1 3.1Å; D281-R285 WeakPolarHBondContact O-CB 3.47Å; D281-R285 VanDerWaalsContact O-CG 3.31Å; D281-R285 WeakPolarHBondContact O-CG 3.31Å; D281-R285 PolarHBondContact O-N 3.31Å; D281-R285 IonicContact OD1-CZ 2.76Å; D281-R285 IonicContact OD1-NE 2.98Å; D281-R285 PolarHBondContact OD1-NE 2.82Å; D281-R285 IonicContact OD1-NH2 3.94Å; D281-R285 IonicContact OD2-CZ 3.84Å; D281-R285 IonicContact OD2-NE 2.97Å; D281-R285 PolarHBondContact OD2-NE 3.35Å; L283-R285 VanDerWaalsContact C-N 3.32Å; L283-R285 PolarHBondContact O-N 3.29Å; R285-F287 PolarHBondContact O-N 2.84Å
286	G	84.4	Confident	85.2	Confident	43 Å²	43	55.8 Å²	55.8	44%	0.443	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	66	18.4	-175.1	0	0	0	0	0	114.6	A282 L283 R284 F288	A282-G286 CarbonylContact O-C 3.6Å; A282-G286 PolarHBondContact O-N 3.36Å; L283-G286 PolarHBondContact O-N 2.86Å; L283-G286 VanDerWaalsContact O-N 3.15Å; R284-G286 VanDerWaalsContact C-N 3.3Å; G286-F288 WeakPolarHBondContact O-CD1 3.42Å; G286-F288 PolarHBondContact O-N 3.42Å
287	F	85	Confident	84	Confident	54 Å²	54	58.8 Å²	58.8	24%	0.237	30%	0.304	C	S	.	.			trans	-85.2	108.7	-178.8	-176.6	-97.4	0	0	0	111.1	P254 F277 A282 R285 F309	P254-F287 HydrophobicContact CG-CD2 4.45Å; P254-F287 HydrophobicContact CG-CE2 4.25Å; F277-F287 WeakPolarHBondContact CD1-O 3.22Å; A282-F287 HydrophobicContact CB-CB 4.43Å; A282-F287 HydrophobicContact CB-CD1 4.47Å; A282-F287 WeakPolarHBondContact CB-O 3.37Å; A282-F287 PolarHBondContact O-N 3.19Å; R285-F287 PolarHBondContact O-N 2.84Å; F287-F309 HydrophobicContact CE1-CE1 4.16Å
288	F	89.7	Confident	82.9	Confident	61 Å²	61	66.8 Å²	66.8	27%	0.268	34%	0.338	S	S	.	.			trans	-127	160.6	179.5	64.3	-89.2	0	0	0	112.9	K275 V276 F277 G286 L290	K275-F288 HydrophobicContact CB-CB 4.2Å; K275-F288 HydrophobicContact CB-CD2 3.8Å; K275-F288 HydrophobicContact CB-CE2 4.43Å; K275-F288 HydrophobicContact CB-CG 4.02Å; K275-F288 HydrophobicContact CD-CD1 4.11Å; K275-F288 HydrophobicContact CD-CD2 3.88Å; K275-F288 HydrophobicContact CD-CE1 4.03Å; K275-F288 HydrophobicContact CD-CE2 3.8Å; K275-F288 HydrophobicContact CD-CG 4.05Å; K275-F288 HydrophobicContact CD-CZ 3.88Å; K275-F288 HydrophobicContact CG-CD2 3.57Å; K275-F288 HydrophobicContact CG-CE2 3.7Å; K275-F288 HydrophobicContact CG-CG 4.1Å; K275-F288 HydrophobicContact CG-CZ 4.31Å; V276-F288 WeakPolarHBondContact O-CA 3.38Å; V276-F288 WeakPolarHBondContact O-CB 3.43Å; F277-F288 HydrophobicContact CD1-CB 4.02Å; F277-F288 HydrophobicContact CD2-CB 4.47Å; F277-F288 HydrophobicContact CE1-CB 3.73Å; F277-F288 HydrophobicContact CE1-CD1 4.41Å; F277-F288 HydrophobicContact CE2-CB 4.18Å; F277-F288 HydrophobicContact CG-CB 4.4Å; F277-F288 HydrophobicContact CZ-CB 3.81Å; F277-F288 HydrophobicContact CZ-CD1 4.28Å; F277-F288 HydrophobicContact CZ-CG 4.4Å; G286-F288 WeakPolarHBondContact O-CD1 3.42Å; G286-F288 PolarHBondContact O-N 3.42Å; F288-L290 HydrophobicContact CD2-CD2 4.3Å; F288-L290 HydrophobicContact CE2-CD2 3.99Å; F288-L290 HydrophobicContact CE2-CG 4.39Å
289	R	89.4	Confident	82.3	Confident	56 Å²	56	70 Å²	70	21%	0.211	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	155.6	164.8	-70.7	-77.8	178.4	-174.2	-7.9	109.9	D134 V276 A308 F309	D134-R289 PolarHBondContact O-NH2 2.95Å; D134-R289 IonicContact OD2-NH1 2.72Å; V276-R289 HydrophobicContact CG1-CB 4.1Å; V276-R289 VanDerWaalsContact CG1-O 3.28Å; V276-R289 WeakPolarHBondContact CG1-O 3.31Å; V276-R289 PolarHBondContact N-O 3.24Å; V276-R289 PolarHBondContact O-N 2.92Å; R289-A308 HydrophobicContact CB-CB 3.93Å; R289-F309 HydrophobicContact CB-CE2 4.02Å; R289-F309 HydrophobicContact CB-CZ 3.96Å; R289-F309 HydrophobicContact CG-CD1 4.24Å; R289-F309 HydrophobicContact CG-CE1 3.8Å; R289-F309 HydrophobicContact CG-CE2 4.16Å; R289-F309 HydrophobicContact CG-CZ 3.76Å
290	L	90.4	Very high	81.9	Confident	85 Å²	85	72.8 Å²	72.8	45%	0.445	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	129.7	172	-65.2	175.2	0	0	0	109.4	F274 K275 F288	F274-L290 WeakPolarHBondContact O-CA 3.42Å; K275-L290 HydrophobicContact CG-CD2 4.14Å; F288-L290 HydrophobicContact CD2-CD2 4.3Å; F288-L290 HydrophobicContact CE2-CD2 3.99Å; F288-L290 HydrophobicContact CE2-CG 4.39Å
291	A	88.6	Confident	81.8	Confident	1 Å²	1	71.9 Å²	71.9	1%	0.008	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	142.2	174.1	0	0	0	0	0	110.3	V273 F274 V276 S293 A304	V273-A291 CarbonylContact C-O 3.56Å; V273-A291 VanDerWaalsContact CA-O 3.29Å; V273-A291 WeakPolarHBondContact CA-O 3.33Å; F274-A291 HydrophobicContact CD1-CB 4.21Å; F274-A291 VanDerWaalsContact CD1-O 3.28Å; F274-A291 WeakPolarHBondContact CD1-O 3.48Å; F274-A291 HydrophobicContact CE1-CB 3.65Å; F274-A291 HydrophobicContact CE2-CB 4.14Å; F274-A291 HydrophobicContact CZ-CB 3.61Å; F274-A291 PolarHBondContact N-O 3.08Å; F274-A291 PolarHBondContact O-N 3.21Å; V276-A291 HydrophobicContact CG1-CB 3.95Å; A291-S293 PolarHBondContact O-N 2.81Å; A291-A304 HydrophobicContact CB-CB 4.21Å
292	P	87.1	Confident	81.9	Confident	56 Å²	56	71.1 Å²	71.1	36%	0.364	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	132.8	173.2	26.6	-34.4	0	0	0	110.7	A304	P292-A304 HydrophobicContact CG-CB 3.94Å
293	S	81.8	Confident	82	Confident	23 Å²	23	73.5 Å²	73.5	16%	0.161	37%	0.37	C	S	.	.			trans	-87.9	132.1	168.7	-178.6	0	0	0	0	109.6	Q272 A291 E301	Q272-S293 WeakPolarHBondContact O-CB 3.49Å; Q272-S293 PolarHBondContact O-N 3.33Å; A291-S293 PolarHBondContact O-N 2.81Å; S293-E301 WeakPolarHBondContact CB-OE1 3.46Å; S293-E301 PolarHBondContact OG-OE1 3.3Å
294	C	70.6	Confident	82	Confident	46 Å²	46	71.4 Å²	71.4	31%	0.311	36%	0.36	S	S	.	.			trans	-112.8	115.5	173.5	-65.8	0	0	0	0	108	G296 E300	C294-G296 PolarHBondContact O-N 2.87Å; C294-E300 HydrophobicContact CB-CB 4.25Å
295	R	62.6	Low	82.1	Confident	230 Å²	230	63.2 Å²	63.2	87%	0.868	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	111.8	-175.9	-71.8	-172.8	-179.2	-171.3	1.3	110.7
296	G	60.2	Low	82.4	Confident	82 Å²	82	57.4 Å²	57.4	85%	0.845	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.5	-0.3	162.8	0	0	0	0	0	117.7	C294	C294-G296 PolarHBondContact O-N 2.87Å
297	V	67.2	Low	82.6	Confident	64 Å²	64	58.9 Å²	58.9	39%	0.388	30%	0.3	S	S	.	.			trans	-126.2	93.9	179.1	-169.3	0	0	0	0	110.9	N299 E300	V297-N299 HydrophobicContact CG1-CB 4.25Å; V297-N299 PolarHBondContact O-N 2.8Å; V297-E300 HydrophobicContact CB-CB 4.3Å; V297-E300 HydrophobicContact CB-CG 4.06Å; V297-E300 HydrophobicContact CG1-CB 4.38Å; V297-E300 HydrophobicContact CG1-CG 3.84Å; V297-E300 PolarHBondContact O-N 2.88Å
298	K	71.1	Confident	82.8	Confident	181 Å²	181	57.3 Å²	57.3	79%	0.787	30%	0.297	S	S	*	.	H	α-helix	trans	-48.4	-37.2	179	-71.9	-174.5	176.3	-176	0	112.8	E300 E301 V302	K298-E300 PolarHBondContact O-N 3.39Å; K298-E301 PolarHBondContact O-N 3.46Å; K298-V302 WeakPolarHBondContact O-CG2 3.48Å; K298-V302 PolarHBondContact O-N 3.3Å
299	N	81.1	Confident	82.8	Confident	68 Å²	68	54.5 Å²	54.5	36%	0.364	29%	0.285	S	S	.	.	H	α-helix	trans	-66.4	-35	-178.3	-147.2	25.2	0	0	0	113.5	V297 V302 E303 P315	V297-N299 HydrophobicContact CG1-CB 4.25Å; V297-N299 PolarHBondContact O-N 2.8Å; N299-V302 PolarHBondContact O-N 3.37Å; N299-E303 WeakPolarHBondContact O-CG 3.42Å; N299-E303 PolarHBondContact O-N 3.45Å; N299-P315 WeakPolarHBondContact OD1-CB 3.23Å
300	E	84.3	Confident	82.9	Confident	60 Å²	60	53.5 Å²	53.5	28%	0.28	28%	0.281	S	S	.	.	H	α-helix	trans	-73.7	-32.2	179.5	-69.6	-174.3	164.5	0	0	112	R28 C294 V297 K298 E303 A304	R28-E300 IonicContact CZ-OE1 3.68Å; R28-E300 IonicContact NH2-OE1 2.76Å; R28-E300 PolarHBondContact NH2-OE1 3.27Å; C294-E300 HydrophobicContact CB-CB 4.25Å; V297-E300 HydrophobicContact CB-CB 4.3Å; V297-E300 HydrophobicContact CB-CG 4.06Å; V297-E300 HydrophobicContact CG1-CB 4.38Å; V297-E300 HydrophobicContact CG1-CG 3.84Å; V297-E300 PolarHBondContact O-N 2.88Å; K298-E300 PolarHBondContact O-N 3.39Å; E300-E303 WeakPolarHBondContact O-CB 3.47Å; E300-E303 PolarHBondContact O-N 3.4Å; E300-A304 WeakPolarHBondContact O-CB 3.16Å; E300-A304 PolarHBondContact O-N 3.03Å
301	E	88.3	Confident	82.8	Confident	22 Å²	22	50 Å²	50	10%	0.103	26%	0.263	C	S	.	.	H	α-helix	trans	-70.1	-37.5	175.1	-61.7	-172.1	123.5	0	0	111.4	F274 S293 K298 A304 A305 L320 R343	F274-E301 HydrophobicContact CE1-CB 4.2Å; F274-E301 HydrophobicContact CE1-CG 4.45Å; F274-E301 HydrophobicContact CZ-CB 4.23Å; S293-E301 WeakPolarHBondContact CB-OE1 3.46Å; S293-E301 PolarHBondContact OG-OE1 3.3Å; K298-E301 PolarHBondContact O-N 3.46Å; E301-A304 WeakPolarHBondContact O-CB 3.36Å; E301-A304 PolarHBondContact O-N 3.3Å; E301-A305 WeakPolarHBondContact O-CB 3.31Å; E301-A305 PolarHBondContact O-N 3.34Å; E301-L320 HydrophobicContact CB-CD1 3.87Å; E301-R343 IonicContact OE1-CZ 3.22Å; E301-R343 IonicContact OE1-NH1 3.99Å; E301-R343 PolarHBondContact OE1-NH1 3.23Å; E301-R343 IonicContact OE1-NH2 2.85Å; E301-R343 IonicContact OE2-CZ 2.97Å; E301-R343 IonicContact OE2-NH1 3.62Å; E301-R343 PolarHBondContact OE2-NH1 3.1Å; E301-R343 IonicContact OE2-NH2 3.77Å
302	V	89.8	Confident	82.7	Confident	8 Å²	8	51.5 Å²	51.5	5%	0.048	27%	0.273	C	S	.	.	H	α-helix	trans	-64.3	-45.4	171.8	177	0	0	0	0	110.8	K298 N299 A304 A305 L306 P315 F318 L320 L345	K298-V302 WeakPolarHBondContact O-CG2 3.48Å; K298-V302 PolarHBondContact O-N 3.3Å; N299-V302 PolarHBondContact O-N 3.37Å; V302-A304 VanDerWaalsContact C-N 3.26Å; V302-A304 PolarHBondContact O-N 3.49Å; V302-A305 WeakPolarHBondContact O-CB 3.35Å; V302-A305 PolarHBondContact O-N 3.36Å; V302-A305 VanDerWaalsContact O-N 3.15Å; V302-L306 HydrophobicContact CG1-CD1 4.1Å; V302-L306 HydrophobicContact CG1-CG 4.42Å; V302-L306 WeakPolarHBondContact O-CG 3.5Å; V302-L306 PolarHBondContact O-N 3.23Å; V302-P315 HydrophobicContact CB-CB 4.49Å; V302-P315 HydrophobicContact CG1-CB 4.2Å; V302-P315 WeakPolarHBondContact CG1-O 3.33Å; V302-F318 HydrophobicContact CG1-CB 3.77Å; V302-L320 HydrophobicContact CG2-CD1 3.91Å; V302-L320 HydrophobicContact CG2-CG 3.96Å; V302-L345 HydrophobicContact CG1-CD1 4.21Å
303	E	88.9	Confident	82.4	Confident	53 Å²	53	50.6 Å²	50.6	25%	0.248	27%	0.273	C	S	.	.	H	α-helix	trans	-56.5	-40.8	173.4	-77.5	173.9	-162	0	0	112.2	R28 N299 E300 R307 P315	R28-E303 IonicContact NH1-OE1 3.65Å; N299-E303 WeakPolarHBondContact O-CG 3.42Å; N299-E303 PolarHBondContact O-N 3.45Å; E300-E303 WeakPolarHBondContact O-CB 3.47Å; E300-E303 PolarHBondContact O-N 3.4Å; E303-R307 WeakPolarHBondContact O-CB 3.36Å; E303-R307 VanDerWaalsContact O-CG 3.31Å; E303-R307 WeakPolarHBondContact O-CG 3.18Å; E303-R307 PolarHBondContact O-N 3.11Å; E303-R307 VanDerWaalsContact O-N 3.16Å; E303-R307 PolarHBondContact O-NE 2.83Å; E303-P315 HydrophobicContact CB-CG 4.34Å; E303-P315 HydrophobicContact CG-CB 3.86Å; E303-P315 HydrophobicContact CG-CG 3.1Å
304	A	88.8	Confident	82.5	Confident	4 Å²	4	52.7 Å²	52.7	3%	0.033	28%	0.28	C	S	.	.	H	α-helix	trans	-67.2	-40.8	177.3	0	0	0	0	0	111.9	A291 P292 E300 E301 V302 R307 A308	A291-A304 HydrophobicContact CB-CB 4.21Å; P292-A304 HydrophobicContact CG-CB 3.94Å; E300-A304 WeakPolarHBondContact O-CB 3.16Å; E300-A304 PolarHBondContact O-N 3.03Å; E301-A304 WeakPolarHBondContact O-CB 3.36Å; E301-A304 PolarHBondContact O-N 3.3Å; V302-A304 VanDerWaalsContact C-N 3.26Å; V302-A304 PolarHBondContact O-N 3.49Å; A304-R307 PolarHBondContact O-N 2.93Å; A304-A308 PolarHBondContact O-N 3.41Å
305	A	90.8	Very high	83.2	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62.8	-48.2	175.3	0	0	0	0	0	112.6	V276 E301 V302 R307 A308 F309 L320 L345	V276-A305 HydrophobicContact CG2-CB 3.8Å; E301-A305 WeakPolarHBondContact O-CB 3.31Å; E301-A305 PolarHBondContact O-N 3.34Å; V302-A305 WeakPolarHBondContact O-CB 3.35Å; V302-A305 PolarHBondContact O-N 3.36Å; V302-A305 VanDerWaalsContact O-N 3.15Å; A305-R307 VanDerWaalsContact C-N 3.3Å; A305-R307 PolarHBondContact O-N 2.83Å; A305-A308 WeakPolarHBondContact O-CB 3.38Å; A305-A308 PolarHBondContact O-N 3.31Å; A305-A308 VanDerWaalsContact O-N 3.14Å; A305-F309 PolarHBondContact O-N 2.85Å; A305-L320 HydrophobicContact CB-CD1 4.43Å; A305-L320 HydrophobicContact CB-CD2 4.03Å; A305-L345 HydrophobicContact CB-CD1 4.06Å; A305-L345 HydrophobicContact CB-CD2 4.25Å
306	L	90.8	Very high	84.3	Confident	9 Å²	9	45.6 Å²	45.6	5%	0.047	25%	0.254	C	S	.	.	H	α-helix	trans	-58.3	-42.9	176.6	-71	168.3	0	0	0	111.4	V302 F309 Y310 L311 F318 L345	V302-L306 HydrophobicContact CG1-CD1 4.1Å; V302-L306 HydrophobicContact CG1-CG 4.42Å; V302-L306 WeakPolarHBondContact O-CG 3.5Å; V302-L306 PolarHBondContact O-N 3.23Å; L306-F309 PolarHBondContact O-N 3.48Å; L306-Y310 PolarHBondContact O-N 3.31Å; L306-Y310 VanDerWaalsContact O-N 3.11Å; L306-L311 HydrophobicContact CD2-CB 3.72Å; L306-L311 HydrophobicContact CD2-CD1 4.21Å; L306-L311 PolarHBondContact O-N 3Å; L306-F318 HydrophobicContact CD1-CD2 3.9Å; L306-F318 HydrophobicContact CD1-CE2 4.16Å; L306-F318 HydrophobicContact CD2-CD1 4.15Å; L306-F318 HydrophobicContact CD2-CD2 3.88Å; L306-F318 HydrophobicContact CD2-CE1 4.06Å; L306-F318 HydrophobicContact CD2-CE2 3.78Å; L306-F318 HydrophobicContact CD2-CG 4.07Å; L306-F318 HydrophobicContact CD2-CZ 3.87Å; L306-F318 HydrophobicContact CG-CD2 4.42Å; L306-L345 HydrophobicContact CD2-CD2 3.85Å; L306-L345 HydrophobicContact CG-CD2 4.32Å
307	R	89.2	Confident	85.6	Confident	73 Å²	73	43.4 Å²	43.4	28%	0.275	22%	0.222	S	C	.	.	H	α-helix	trans	-62.6	-40.9	175.5	-78.2	178.8	-75	165.7	-7.5	112.7	E65 V66 E303 A304 A305 F309 Y310	E65-R307 IonicContact OE1-NH1 3.77Å; V66-R307 HydrophobicContact CG2-CG 4.06Å; E303-R307 WeakPolarHBondContact O-CB 3.36Å; E303-R307 VanDerWaalsContact O-CG 3.31Å; E303-R307 WeakPolarHBondContact O-CG 3.18Å; E303-R307 PolarHBondContact O-N 3.11Å; E303-R307 VanDerWaalsContact O-N 3.16Å; E303-R307 PolarHBondContact O-NE 2.83Å; A304-R307 PolarHBondContact O-N 2.93Å; A305-R307 VanDerWaalsContact C-N 3.3Å; A305-R307 PolarHBondContact O-N 2.83Å; R307-F309 PolarHBondContact O-N 3.07Å; R307-Y310 PolarHBondContact O-N 2.88Å
308	A	89.1	Confident	86.8	Confident	22 Å²	22	41.1 Å²	41.1	18%	0.182	21%	0.207	C	C	.	.	H	α-helix	trans	-61.1	-27.6	-179.4	0	0	0	0	0	113.2	V276 R289 A304 A305	V276-A308 HydrophobicContact CG1-CB 4.31Å; R289-A308 HydrophobicContact CB-CB 3.93Å; A304-A308 PolarHBondContact O-N 3.41Å; A305-A308 WeakPolarHBondContact O-CB 3.38Å; A305-A308 PolarHBondContact O-N 3.31Å; A305-A308 VanDerWaalsContact O-N 3.14Å
309	F	89.6	Confident	87.7	Confident	2 Å²	2	36 Å²	36	1%	0.009	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	7.9	178.5	-72.8	-81.5	0	0	0	114.5	F138 V276 D278 F287 R289 A305 L306 R307 L311	F138-F309 VanDerWaalsContact CD1-O 3.3Å; F138-F309 WeakPolarHBondContact CD1-O 3.47Å; F138-F309 HydrophobicContact CE1-CB 4.24Å; F138-F309 AromaticContact CE1-CD1 3.96Å; F138-F309 HydrophobicContact CE1-CD1 3.96Å; F138-F309 VanDerWaalsContact CE1-O 3.25Å; F138-F309 WeakPolarHBondContact CE1-O 3.36Å; F138-F309 HydrophobicContact CZ-CD1 4.04Å; V276-F309 HydrophobicContact CB-CE2 4.35Å; V276-F309 HydrophobicContact CG1-CD2 4.43Å; V276-F309 HydrophobicContact CG1-CE2 3.75Å; V276-F309 HydrophobicContact CG2-CE2 4.09Å; V276-F309 WeakPolarHBondContact O-CE2 3.35Å; V276-F309 WeakPolarHBondContact O-CZ 3.24Å; D278-F309 HydrophobicContact CB-CD1 3.83Å; D278-F309 HydrophobicContact CB-CD2 4.1Å; D278-F309 HydrophobicContact CB-CE1 3.8Å; D278-F309 HydrophobicContact CB-CE2 4.05Å; D278-F309 HydrophobicContact CB-CG 3.99Å; D278-F309 HydrophobicContact CB-CZ 3.91Å; F287-F309 HydrophobicContact CE1-CE1 4.16Å; R289-F309 HydrophobicContact CB-CE2 4.02Å; R289-F309 HydrophobicContact CB-CZ 3.96Å; R289-F309 HydrophobicContact CG-CD1 4.24Å; R289-F309 HydrophobicContact CG-CE1 3.8Å; R289-F309 HydrophobicContact CG-CE2 4.16Å; R289-F309 HydrophobicContact CG-CZ 3.76Å; A305-F309 PolarHBondContact O-N 2.85Å; L306-F309 PolarHBondContact O-N 3.48Å; R307-F309 PolarHBondContact O-N 3.07Å; F309-L311 HydrophobicContact CB-CD1 3.87Å; F309-L311 HydrophobicContact CB-CG 3.81Å; F309-L311 PolarHBondContact O-N 2.86Å
310	Y	90.1	Very high	88.1	Confident	34 Å²	34	34.5 Å²	34.5	13%	0.133	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	39.9	-175.5	-54.5	-95.8	0	0	0	112.6	V66 T84 C85 V111 C112 F138 L306 R307	V66-Y310 HydrophobicContact CG1-CD1 3.83Å; V66-Y310 WeakPolarHBondContact O-CE1 3.45Å; T84-Y310 HydrophobicContact CG2-CD1 4.08Å; T84-Y310 HydrophobicContact CG2-CG 4.45Å; C85-Y310 WeakPolarHBondContact CA-O 3.45Å; C85-Y310 WeakPolarHBondContact CB-O 3.33Å; V111-Y310 HydrophobicContact CG1-CD1 4.3Å; V111-Y310 HydrophobicContact CG1-CD2 4.29Å; V111-Y310 HydrophobicContact CG1-CE1 3.98Å; V111-Y310 HydrophobicContact CG1-CE2 3.99Å; V111-Y310 HydrophobicContact CG1-CG 4.45Å; C112-Y310 VanDerWaalsContact CB-OH 3.26Å; C112-Y310 WeakPolarHBondContact CB-OH 3.41Å; F138-Y310 HydrophobicContact CB-CD2 4.19Å; F138-Y310 AromaticContact CD1-CD2 3.81Å; F138-Y310 HydrophobicContact CD1-CD2 3.81Å; F138-Y310 HydrophobicContact CD2-CD2 4.17Å; F138-Y310 HydrophobicContact CD2-CE2 4.28Å; F138-Y310 HydrophobicContact CE1-CD2 4.22Å; F138-Y310 AromaticContact CG-CD2 3.78Å; F138-Y310 HydrophobicContact CG-CD2 3.78Å; F138-Y310 HydrophobicContact CG-CE2 4.31Å; L306-Y310 PolarHBondContact O-N 3.31Å; L306-Y310 VanDerWaalsContact O-N 3.11Å; R307-Y310 PolarHBondContact O-N 2.88Å
311	L	88.6	Confident	88.4	Confident	12 Å²	12	35.5 Å²	35.5	6%	0.063	19%	0.185	C	C	.	.			trans	-88.7	139.5	179.8	-66.6	172.2	0	0	0	110.8	L306 F309 L345 L433 R434 N437	L306-L311 HydrophobicContact CD2-CB 3.72Å; L306-L311 HydrophobicContact CD2-CD1 4.21Å; L306-L311 PolarHBondContact O-N 3Å; F309-L311 HydrophobicContact CB-CD1 3.87Å; F309-L311 HydrophobicContact CB-CG 3.81Å; F309-L311 PolarHBondContact O-N 2.86Å; L311-L345 HydrophobicContact CD1-CD2 3.81Å; L311-L433 HydrophobicContact CD1-CB 3.73Å; L311-L433 HydrophobicContact CD1-CD1 4.29Å; L311-L433 HydrophobicContact CD2-CB 4.37Å; L311-L433 WeakPolarHBondContact CD2-O 3.44Å; L311-R434 HydrophobicContact CD2-CB 4.48Å; L311-N437 HydrophobicContact CD2-CB 4.32Å
312	P	85.9	Confident	88.3	Confident	33 Å²	33	38.8 Å²	38.8	21%	0.214	20%	0.203	C	C	.	.			trans	-80.9	164.7	170.4	35.8	-34.5	0	0	0	110.7	C85 M86 N437	C85-P312 HydrophobicContact CB-CB 4.43Å; M86-P312 HydrophobicContact CG-CB 4.46Å; M86-P312 HydrophobicContact SD-CB 3.43Å; M86-P312 WeakPolarHBondContact SD-CB 3.36Å; M86-P312 HydrophobicContact SD-CG 4.16Å; P312-N437 WeakPolarHBondContact CD-ND2 3.4Å
313	G	82	Confident	87.8	Confident	36 Å²	36	39.5 Å²	39.5	37%	0.371	21%	0.208	S	C	.	.	S	Bend	trans	119.9	164.9	171.7	0	0	0	0	0	113.2
314	E	83.6	Confident	86.5	Confident	68 Å²	68	40.1 Å²	40.1	32%	0.318	23%	0.228	S	C	.	.			trans	-86.7	141.2	-179.9	-64.7	-57.7	129.3	0	0	110.4	Q31 H316 D317 F318	Q31-E314 VanDerWaalsContact CD-OE1 3.23Å; Q31-E314 PolarHBondContact NE2-OE1 3.05Å; Q31-E314 PolarHBondContact OE1-OE1 3.47Å; E314-H316 WeakPolarHBondContact CB-CE1 3.35Å; E314-H316 WeakPolarHBondContact CB-ND1 3.44Å; E314-H316 PolarHBondContact O-N 3.29Å; E314-D317 WeakPolarHBondContact O-CB 3.16Å; E314-D317 PolarHBondContact O-N 3.18Å; E314-F318 WeakPolarHBondContact O-CD2 3.48Å
315	P	85.8	Confident	84.6	Confident	15 Å²	15	43.7 Å²	43.7	10%	0.097	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-55.4	-27.8	-177.8	-30.7	39.3	0	0	0	115	N299 V302 E303 D317 F318	N299-P315 WeakPolarHBondContact OD1-CB 3.23Å; V302-P315 HydrophobicContact CB-CB 4.49Å; V302-P315 HydrophobicContact CG1-CB 4.2Å; V302-P315 WeakPolarHBondContact CG1-O 3.33Å; E303-P315 HydrophobicContact CB-CG 4.34Å; E303-P315 HydrophobicContact CG-CB 3.86Å; E303-P315 HydrophobicContact CG-CG 3.1Å; P315-D317 PolarHBondContact O-N 3.4Å; P315-F318 PolarHBondContact O-N 3.2Å
316	H	86.3	Confident	82.6	Confident	112 Å²	112	46.6 Å²	46.6	52%	0.519	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-71.3	-15.6	179.3	60.5	-97.7	0	0	0	113.6	E314 F318 K348	E314-H316 WeakPolarHBondContact CB-CE1 3.35Å; E314-H316 WeakPolarHBondContact CB-ND1 3.44Å; E314-H316 PolarHBondContact O-N 3.29Å; H316-F318 VanDerWaalsContact C-N 3.28Å; H316-K348 VanDerWaalsContact O-CD 3.3Å; H316-K348 WeakPolarHBondContact O-CD 3.19Å; H316-K348 WeakPolarHBondContact O-CE 3.5Å; H316-K348 PolarHBondContact O-NZ 3.27Å
317	D	87.4	Confident	80.4	Confident	35 Å²	35	54.1 Å²	54.1	19%	0.187	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-82.4	-4.1	177.3	-67.3	-42.4	0	0	0	113.5	E314 P315 K348 R350	E314-D317 WeakPolarHBondContact O-CB 3.16Å; E314-D317 PolarHBondContact O-N 3.18Å; P315-D317 PolarHBondContact O-N 3.4Å; D317-K348 WeakPolarHBondContact O-CB 3.2Å; D317-K348 PolarHBondContact O-N 3.46Å; D317-R350 IonicContact OD1-CZ 3.36Å; D317-R350 IonicContact OD1-NE 3.95Å; D317-R350 IonicContact OD1-NH2 2.78Å; D317-R350 PolarHBondContact OD1-NH2 3.46Å; D317-R350 IonicContact OD2-NH2 3.27Å; D317-R350 PolarHBondContact OD2-NH2 2.92Å
318	F	91	Very high	78	Confident	16 Å²	16	58.9 Å²	58.9	7%	0.07	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	156.3	-174	-58	-94.1	0	0	0	111.6	V302 L306 E314 P315 H316 L345 R346 A347 L433	V302-F318 HydrophobicContact CG1-CB 3.77Å; L306-F318 HydrophobicContact CD1-CD2 3.9Å; L306-F318 HydrophobicContact CD1-CE2 4.16Å; L306-F318 HydrophobicContact CD2-CD1 4.15Å; L306-F318 HydrophobicContact CD2-CD2 3.88Å; L306-F318 HydrophobicContact CD2-CE1 4.06Å; L306-F318 HydrophobicContact CD2-CE2 3.78Å; L306-F318 HydrophobicContact CD2-CG 4.07Å; L306-F318 HydrophobicContact CD2-CZ 3.87Å; L306-F318 HydrophobicContact CG-CD2 4.42Å; E314-F318 WeakPolarHBondContact O-CD2 3.48Å; P315-F318 PolarHBondContact O-N 3.2Å; H316-F318 VanDerWaalsContact C-N 3.28Å; F318-L345 HydrophobicContact CB-CD1 3.96Å; F318-L345 HydrophobicContact CD1-CG 4.46Å; F318-R346 CarbonylContact C-O 3.44Å; F318-R346 WeakPolarHBondContact CA-O 3.46Å; F318-R346 WeakPolarHBondContact CB-O 3.4Å; F318-A347 HydrophobicContact CD1-CB 4.09Å; F318-A347 HydrophobicContact CE1-CB 4Å; F318-L433 HydrophobicContact CD1-CD1 3.92Å; F318-L433 HydrophobicContact CE1-CD1 3.99Å; F318-L433 HydrophobicContact CE1-CD2 4.43Å
319	D	90.6	Very high	75.7	Confident	74 Å²	74	65.8 Å²	65.8	40%	0.396	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	154.6	172.4	-69.3	-46.6	0	0	0	110.6	R346 K348	D319-R346 PolarHBondContact N-O 2.99Å; D319-R346 PolarHBondContact O-N 2.92Å; D319-K348 WeakPolarHBondContact OD1-CE 3.33Å; D319-K348 IonicContact OD1-NZ 2.64Å; D319-K348 PolarHBondContact OD1-NZ 3.17Å; D319-K348 WeakPolarHBondContact OD2-CE 3.4Å; D319-K348 WeakPolarHBondContact OD2-CG 3.37Å
320	L	89.9	Confident	73.1	Confident	37 Å²	37	74.4 Å²	74.4	19%	0.194	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	114.4	172	-79.4	170.6	0	0	0	109.1	F274 V276 E301 V302 A305 R343 V344 L345	F274-L320 HydrophobicContact CE2-CD1 4.25Å; F274-L320 HydrophobicContact CE2-CD2 4.43Å; F274-L320 HydrophobicContact CZ-CD1 4.04Å; V276-L320 HydrophobicContact CG2-CD2 4.07Å; E301-L320 HydrophobicContact CB-CD1 3.87Å; V302-L320 HydrophobicContact CG2-CD1 3.91Å; V302-L320 HydrophobicContact CG2-CG 3.96Å; A305-L320 HydrophobicContact CB-CD1 4.43Å; A305-L320 HydrophobicContact CB-CD2 4.03Å; L320-R343 HydrophobicContact CD2-CB 4.12Å; L320-V344 WeakPolarHBondContact CA-O 3.37Å; L320-L345 HydrophobicContact CD2-CB 4.14Å; L320-L345 HydrophobicContact CD2-CD1 3.89Å; L320-L345 HydrophobicContact CG-CD1 4.21Å
321	E	89.8	Confident	70.4	Confident	81 Å²	81	78.4 Å²	78.4	38%	0.379	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	135.1	179	-65.4	175.2	170.7	0	0	110.2	R343 V344 R346	E321-R343 CarbonylContact O-C 3.57Å; E321-R343 WeakPolarHBondContact O-CA 3.26Å; E321-V344 PolarHBondContact N-O 2.78Å; E321-V344 PolarHBondContact O-N 3.12Å; E321-R346 HydrophobicContact CG-CG 4.16Å; E321-R346 WeakPolarHBondContact OE2-CG 3.43Å; E321-R346 IonicContact OE2-NE 3.35Å; E321-R346 PolarHBondContact OE2-NE 3.06Å
322	N	86.2	Confident	68.1	Low	90 Å²	90	85.2 Å²	85.2	48%	0.481	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	133.4	174.3	-68.9	-35.8	0	0	0	109.8	G324 A325	N322-G324 PolarHBondContact O-N 2.91Å; N322-G324 VanDerWaalsContact O-N 3.15Å; N322-A325 WeakPolarHBondContact O-CB 3.25Å; N322-A325 PolarHBondContact O-N 2.99Å
323	V	79.9	Confident	65.7	Low	24 Å²	24	90.8 Å²	90.8	15%	0.145	50%	0.501	C	S	.	.	G	3₁₀ helix	trans	-59.4	-30.9	-177.3	174	0	0	0	0	112.3	F277 L283 A325 V326 A342 V344	F277-V323 HydrophobicContact CD2-CG2 4.35Å; F277-V323 HydrophobicContact CE2-CG2 4.36Å; L283-V323 HydrophobicContact CD1-CG1 3.98Å; L283-V323 HydrophobicContact CD1-CG2 3.85Å; L283-V323 HydrophobicContact CD2-CG1 4.49Å; V323-A325 PolarHBondContact O-N 3.05Å; V323-A325 VanDerWaalsContact O-N 3.13Å; V323-V326 PolarHBondContact O-N 3.43Å; V323-V326 VanDerWaalsContact O-N 3.1Å; V323-A342 HydrophobicContact CB-CB 4.18Å; V323-A342 HydrophobicContact CG2-CB 3.86Å; V323-A342 PolarHBondContact N-O 3.47Å; V323-A342 VanDerWaalsContact N-O 3.07Å; V323-V344 HydrophobicContact CG2-CG2 3.78Å
324	G	62	Low	63.5	Low	65 Å²	65	99 Å²	99	67%	0.67	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-63.7	-13.3	176.1	0	0	0	0	0	115.4	N322	N322-G324 PolarHBondContact O-N 2.91Å; N322-G324 VanDerWaalsContact O-N 3.15Å
325	A	49.2	Very low	61.4	Low	79 Å²	79	105 Å²	105	65%	0.653	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-90.4	-10.3	175.5	0	0	0	0	0	113.5	N322 V323	N322-A325 WeakPolarHBondContact O-CB 3.25Å; N322-A325 PolarHBondContact O-N 2.99Å; V323-A325 PolarHBondContact O-N 3.05Å; V323-A325 VanDerWaalsContact O-N 3.13Å
326	V	48.8	Very low	58.9	Low	61 Å²	61	110.7 Å²	110.7	37%	0.37	58%	0.584	S	S	.	*	S	Bend	trans	-94	-13.1	-171.5	-170.5	0	0	0	0	112.5	V323 H328	V323-V326 PolarHBondContact O-N 3.43Å; V323-V326 VanDerWaalsContact O-N 3.1Å; V326-H328 VanDerWaalsContact C-N 3.34Å; V326-H328 PolarHBondContact O-N 2.89Å
327	Q	43	Very low	56.7	Low	167 Å²	167	113.3 Å²	113.3	78%	0.78	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	25.6	-174.6	-81.2	-175.7	-24.6	0	0	116.2
328	H	40.4	Very low	54.4	Low	173 Å²	173	119 Å²	119	80%	0.801	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	1.8	175.1	-95.3	-51.7	0	0	0	116.2	V326	V326-H328 VanDerWaalsContact C-N 3.34Å; V326-H328 PolarHBondContact O-N 2.89Å
329	H	39	Very low	52.3	Low	167 Å²	167	123.6 Å²	123.6	77%	0.773	66%	0.656	S	S	*	*	S	Bend	trans	-138.6	111.2	169.9	-68.8	-61.4	0	0	0	110.8
330	H	36.5	Very low	50.6	Low	184 Å²	184	124.6 Å²	124.6	85%	0.852	67%	0.669	S	S	*	*	S	Bend	trans	106.2	97.8	172	-60.2	-69.3	0	0	0	117.7
331	S	32.8	Very low	49.9	Very low	118 Å²	118	125.9 Å²	125.9	83%	0.825	68%	0.676	S	S	*	*			trans	41	129.5	154.6	72.8	0	0	0	0	122.1
332	D	39.3	Very low	49.9	Very low	155 Å²	155	122.7 Å²	122.7	83%	0.829	66%	0.664	S	S	*	*			trans	-49.5	121.3	167.7	-60.9	-54.1	0	0	0	114
333	D	36.9	Very low	50.1	Low	150 Å²	150	120.4 Å²	120.4	80%	0.802	65%	0.648	S	S	*	*				176.6	153.5	119.3	-96.5	-29.1	0	0	0	110
334	F	35.5	Very low	50.7	Low	209 Å²	209	119.3 Å²	119.3	92%	0.917	64%	0.641	S	S	*	*			trans	94.4	75.3	-175.2	-62.5	-82	0	0	0	117.1
335	Q	39.2	Very low	52.2	Low	194 Å²	194	116.2 Å²	116.2	91%	0.907	61%	0.609	S	S	*	*			trans	-78.8	110.5	150	-82.3	174.3	-20.8	0	0	110.3
336	N	33.9	Very low	54.2	Low	134 Å²	134	114 Å²	114	72%	0.717	58%	0.584	S	S	*	*			trans	-163.4	122.8	139.9	-114.6	-18.6	0	0	0	115
337	Q	38.6	Very low	56.1	Low	167 Å²	167	112.3 Å²	112.3	78%	0.78	58%	0.577	S	S	*	*	S	Bend	trans	56.5	119.9	145.7	-67.3	172.7	10.4	0	0	121.7
338	N	39.7	Very low	58.1	Low	154 Å²	154	108.3 Å²	108.3	82%	0.824	56%	0.557	S	S	*	*			trans	70.9	52.4	168.7	-70.8	-8.8	0	0	0	118.3
339	T	47.8	Very low	59.6	Low	112 Å²	112	106 Å²	106	69%	0.687	55%	0.55	S	S	*	.			trans	-90.4	2.2	174.9	45.5	0	0	0	0	115.5	D341	T339-D341 VanDerWaalsContact C-N 3.3Å; T339-D341 PolarHBondContact O-N 3.13Å
340	S	54.2	Low	61	Low	96 Å²	96	104.3 Å²	104.3	67%	0.671	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-16.7	-172.8	65.9	0	0	0	0	115.4
341	D	76.1	Confident	62.1	Low	64 Å²	64	103.4 Å²	103.4	34%	0.342	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.7	26.5	-172.7	-70.3	-8	0	0	0	112.9	F274 K275 T339	F274-D341 HydrophobicContact CB-CB 4.38Å; F274-D341 WeakPolarHBondContact CB-O 3.45Å; K275-D341 PolarHBondContact N-O 3.16Å; T339-D341 VanDerWaalsContact C-N 3.3Å; T339-D341 PolarHBondContact O-N 3.13Å
342	A	87.9	Confident	63.6	Low	13 Å²	13	103.3 Å²	103.3	11%	0.107	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	127.6	178.5	0	0	0	0	0	112.3	K275 F277 V323	K275-A342 HydrophobicContact CB-CB 4.48Å; K275-A342 WeakPolarHBondContact O-CA 3.47Å; F277-A342 HydrophobicContact CE2-CB 4.15Å; V323-A342 HydrophobicContact CB-CB 4.18Å; V323-A342 HydrophobicContact CG2-CB 3.86Å; V323-A342 PolarHBondContact N-O 3.47Å; V323-A342 VanDerWaalsContact N-O 3.07Å
343	R	91.5	Very high	65.6	Low	43 Å²	43	96.7 Å²	96.7	16%	0.162	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	146.5	-177.1	-57.8	-177.9	-173.5	159.9	-0.8	112.8	F274 K275 V276 F277 E301 L320 E321	F274-R343 HydrophobicContact CD2-CB 4.2Å; F274-R343 HydrophobicContact CD2-CG 4.12Å; F274-R343 HydrophobicContact CE2-CB 4.25Å; F274-R343 HydrophobicContact CE2-CG 4.45Å; K275-R343 PolarHBondContact O-N 3.07Å; V276-R343 CarbonylContact C-O 3.56Å; V276-R343 VanDerWaalsContact CA-O 3.29Å; V276-R343 WeakPolarHBondContact CA-O 3.46Å; F277-R343 WeakPolarHBondContact CD2-O 2.9Å; F277-R343 PolarHBondContact N-O 2.65Å; E301-R343 IonicContact OE1-CZ 3.22Å; E301-R343 IonicContact OE1-NH1 3.99Å; E301-R343 PolarHBondContact OE1-NH1 3.23Å; E301-R343 IonicContact OE1-NH2 2.85Å; E301-R343 IonicContact OE2-CZ 2.97Å; E301-R343 IonicContact OE2-NH1 3.62Å; E301-R343 PolarHBondContact OE2-NH1 3.1Å; E301-R343 IonicContact OE2-NH2 3.77Å; L320-R343 HydrophobicContact CD2-CB 4.12Å; E321-R343 CarbonylContact O-C 3.57Å; E321-R343 WeakPolarHBondContact O-CA 3.26Å
344	V	92.8	Very high	68	Low	0 Å²	0	93.7 Å²	93.7	0%	0	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	130.1	174	-170.2	0	0	0	0	109	F277 L283 L320 E321 V323	F277-V344 HydrophobicContact CB-CG1 4.42Å; F277-V344 HydrophobicContact CB-CG2 4.29Å; L283-V344 HydrophobicContact CD1-CG2 4.48Å; L283-V344 HydrophobicContact CD2-CG2 4.15Å; L320-V344 WeakPolarHBondContact CA-O 3.37Å; E321-V344 PolarHBondContact N-O 2.78Å; E321-V344 PolarHBondContact O-N 3.12Å; V323-V344 HydrophobicContact CG2-CG2 3.78Å
345	L	92.7	Very high	70.6	Confident	0 Å²	0	84.2 Å²	84.2	0%	0	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	126.3	173.8	-174.1	68.3	0	0	0	109.5	V276 F277 V302 A305 L306 L311 F318 L320 L433	V276-L345 HydrophobicContact CG2-CB 4.27Å; F277-L345 PolarHBondContact O-N 3.03Å; V302-L345 HydrophobicContact CG1-CD1 4.21Å; A305-L345 HydrophobicContact CB-CD1 4.06Å; A305-L345 HydrophobicContact CB-CD2 4.25Å; L306-L345 HydrophobicContact CD2-CD2 3.85Å; L306-L345 HydrophobicContact CG-CD2 4.32Å; L311-L345 HydrophobicContact CD1-CD2 3.81Å; F318-L345 HydrophobicContact CB-CD1 3.96Å; F318-L345 HydrophobicContact CD1-CG 4.46Å; L320-L345 HydrophobicContact CD2-CB 4.14Å; L320-L345 HydrophobicContact CD2-CD1 3.89Å; L320-L345 HydrophobicContact CG-CD1 4.21Å; L345-L433 HydrophobicContact CB-CD1 4.03Å; L345-L433 HydrophobicContact CD2-CD1 3.72Å; L345-L433 HydrophobicContact CG-CD1 3.55Å; L345-L433 WeakPolarHBondContact O-CD1 3.3Å
346	R	91.9	Very high	73.1	Confident	33 Å²	33	80.9 Å²	80.9	13%	0.125	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	143.1	178.5	-61.3	-59.5	-168	-176.7	-0.6	111.1	D280 F318 D319 E321 K430	D280-R346 IonicContact OD1-CZ 3.85Å; D280-R346 IonicContact OD1-NH1 3.57Å; D280-R346 PolarHBondContact OD1-NH1 3.34Å; D280-R346 IonicContact OD1-NH2 2.92Å; D280-R346 PolarHBondContact OD1-NH2 3.22Å; D280-R346 IonicContact OD2-NH1 3.68Å; F318-R346 CarbonylContact C-O 3.44Å; F318-R346 WeakPolarHBondContact CA-O 3.46Å; F318-R346 WeakPolarHBondContact CB-O 3.4Å; D319-R346 PolarHBondContact N-O 2.99Å; D319-R346 PolarHBondContact O-N 2.92Å; E321-R346 HydrophobicContact CG-CG 4.16Å; E321-R346 WeakPolarHBondContact OE2-CG 3.43Å; E321-R346 IonicContact OE2-NE 3.35Å; E321-R346 PolarHBondContact OE2-NE 3.06Å; R346-K430 PolarHBondContact NH1-O 2.84Å; R346-K430 VanDerWaalsContact NH1-O 3.08Å
347	A	88.6	Confident	75.9	Confident	26 Å²	26	74.5 Å²	74.5	22%	0.215	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	137.1	166.6	0	0	0	0	0	109.6	F318 L433	F318-A347 HydrophobicContact CD1-CB 4.09Å; F318-A347 HydrophobicContact CE1-CB 4Å; A347-L433 HydrophobicContact CB-CD2 3.72Å
348	K	85.3	Confident	78.4	Confident	82 Å²	82	67.3 Å²	67.3	36%	0.357	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-67.6	143.6	173.8	-71.2	177.7	-177.3	166.8	0	110.7	H316 D317 D319 R350	H316-K348 VanDerWaalsContact O-CD 3.3Å; H316-K348 WeakPolarHBondContact O-CD 3.19Å; H316-K348 WeakPolarHBondContact O-CE 3.5Å; H316-K348 PolarHBondContact O-NZ 3.27Å; D317-K348 WeakPolarHBondContact O-CB 3.2Å; D317-K348 PolarHBondContact O-N 3.46Å; D319-K348 WeakPolarHBondContact OD1-CE 3.33Å; D319-K348 IonicContact OD1-NZ 2.64Å; D319-K348 PolarHBondContact OD1-NZ 3.17Å; D319-K348 WeakPolarHBondContact OD2-CE 3.4Å; D319-K348 WeakPolarHBondContact OD2-CG 3.37Å; K348-R350 PolarHBondContact O-N 3.28Å
349	L	70.7	Confident	80.6	Confident	125 Å²	125	60.1 Å²	60.1	65%	0.654	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-65	131.2	173.1	-81.5	136.5	0	0	0	110.2	Q426	L349-Q426 HydrophobicContact CD2-CG 4.16Å; L349-Q426 VanDerWaalsContact CD2-NE2 3.34Å
350	R	69.7	Low	82.3	Confident	132 Å²	132	55.4 Å²	55.4	50%	0.498	28%	0.282	S	S	.	.			trans	-109.2	138.7	168.5	-64.6	-178.4	175.7	-177.8	-2.7	107.6	D317 K348 D352	D317-R350 IonicContact OD1-CZ 3.36Å; D317-R350 IonicContact OD1-NE 3.95Å; D317-R350 IonicContact OD1-NH2 2.78Å; D317-R350 PolarHBondContact OD1-NH2 3.46Å; D317-R350 IonicContact OD2-NH2 3.27Å; D317-R350 PolarHBondContact OD2-NH2 2.92Å; K348-R350 PolarHBondContact O-N 3.28Å; R350-D352 VanDerWaalsContact C-N 3.33Å
351	H	58.7	Low	83.4	Confident	165 Å²	165	53.6 Å²	53.6	76%	0.764	26%	0.26	S	S	*	.	S	Bend	trans	-73.6	-31.3	-178.8	-71.8	63.9	0	0	0	111.3
352	D	65.5	Low	83.4	Confident	116 Å²	116	52 Å²	52	62%	0.62	25%	0.254	S	S	*	.	S	Bend	trans	-121.3	115.6	174.2	-53.4	-46.8	0	0	0	108.9	R350	R350-D352 VanDerWaalsContact C-N 3.33Å
353	D	80.2	Confident	82.5	Confident	16 Å²	16	54.3 Å²	54.3	9%	0.086	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	139	175.8	-90.2	-43.7	0	0	0	110.9	E370 V371 L425 R429	D353-E370 CarbonylContact O-C 3.58Å; D353-E370 WeakPolarHBondContact O-CA 3.45Å; D353-V371 PolarHBondContact N-O 3.15Å; D353-V371 WeakPolarHBondContact O-CB 3.27Å; D353-V371 PolarHBondContact O-N 3.06Å; D353-L425 HydrophobicContact CB-CD1 4.06Å; D353-R429 IonicContact OD1-CZ 3.59Å; D353-R429 IonicContact OD1-NH1 3.25Å; D353-R429 IonicContact OD1-NH2 3.61Å; D353-R429 PolarHBondContact OD1-NH2 3.02Å; D353-R429 IonicContact OD2-CZ 2.81Å; D353-R429 IonicContact OD2-NH1 3.82Å; D353-R429 PolarHBondContact OD2-NH1 2.89Å; D353-R429 IonicContact OD2-NH2 3.64Å; D353-R429 PolarHBondContact OD2-NH2 3.21Å
354	V	87.3	Confident	81.6	Confident	86 Å²	86	57 Å²	57	52%	0.521	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	116.5	173.2	-175.7	0	0	0	0	109.1	V369 E370	V354-V369 CarbonylContact C-O 3.59Å; V354-V369 WeakPolarHBondContact CA-O 3.35Å; V354-E370 HydrophobicContact CG2-CG 3.95Å
355	I	90.6	Very high	81.1	Confident	10 Å²	10	58.8 Å²	58.8	5%	0.051	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	149.7	172.1	65.6	174.5	0	0	0	110.8	V357 S368 V369 V371 V380 M421 L425 F441	I355-V357 HydrophobicContact CD1-CG2 4.09Å; I355-V357 HydrophobicContact CG1-CG2 4.24Å; I355-S368 WeakPolarHBondContact O-CA 3.28Å; I355-V369 HydrophobicContact CG1-CB 4.19Å; I355-V369 PolarHBondContact N-O 2.82Å; I355-V369 PolarHBondContact O-N 3.5Å; I355-V371 HydrophobicContact CB-CG2 4.33Å; I355-V371 HydrophobicContact CD1-CG2 3.73Å; I355-V371 HydrophobicContact CG1-CG2 3.66Å; I355-V371 HydrophobicContact CG2-CG2 3.89Å; I355-V380 HydrophobicContact CD1-CG1 3.87Å; I355-V380 HydrophobicContact CD1-CG2 4.36Å; I355-M421 HydrophobicContact CD1-CE 3.99Å; I355-L425 HydrophobicContact CG2-CD1 3.71Å; I355-L425 HydrophobicContact CG2-CD2 3.94Å; I355-L425 HydrophobicContact CG2-CG 4.38Å; I355-F441 HydrophobicContact CB-CD2 4.37Å; I355-F441 HydrophobicContact CG2-CE2 4.39Å
356	K	91.3	Very high	80.9	Confident	124 Å²	124	61.6 Å²	61.6	54%	0.539	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	124	171.2	-68.2	-177	-178.7	179.7	0	109.6	V366 V367	K356-V366 HydrophobicContact CB-CG1 4Å; K356-V366 HydrophobicContact CD-CG1 4.47Å; K356-V366 HydrophobicContact CG-CG1 4.47Å; K356-V367 CarbonylContact C-O 3.57Å; K356-V367 WeakPolarHBondContact CA-O 3.47Å
357	V	92.9	Very high	80.8	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.006	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	123.4	177.5	-172.8	0	0	0	0	109.4	I355 V366 V367 V369 V380 V384 L400 F441 I443	I355-V357 HydrophobicContact CD1-CG2 4.09Å; I355-V357 HydrophobicContact CG1-CG2 4.24Å; V357-V366 WeakPolarHBondContact O-CA 3.49Å; V357-V367 PolarHBondContact N-O 3.24Å; V357-V367 PolarHBondContact O-N 3.17Å; V357-V369 HydrophobicContact CG2-CG2 4.48Å; V357-V380 HydrophobicContact CG2-CG1 4.11Å; V357-V384 HydrophobicContact CB-CG1 4.43Å; V357-V384 HydrophobicContact CB-CG2 3.71Å; V357-V384 HydrophobicContact CG1-CG1 4.11Å; V357-V384 HydrophobicContact CG1-CG2 3.92Å; V357-V384 HydrophobicContact CG2-CG2 3.81Å; V357-L400 HydrophobicContact CG1-CD1 3.75Å; V357-L400 HydrophobicContact CG2-CD1 4.3Å; V357-F441 WeakPolarHBondContact CA-O 3.18Å; V357-F441 HydrophobicContact CG2-CB 4.22Å; V357-I443 HydrophobicContact CG1-CB 4.1Å; V357-I443 HydrophobicContact CG1-CG2 4.28Å
358	H	90.4	Very high	81	Confident	16 Å²	16	62.3 Å²	62.3	7%	0.074	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	137.4	-177.8	-67.5	-106.8	0	0	0	110.7	A360 V366 F441 Y442 I443	H358-A360 PolarHBondContact O-N 3.38Å; H358-V366 VanDerWaalsContact ND1-CG2 3.28Å; H358-V366 WeakPolarHBondContact ND1-CG2 3.42Å; H358-F441 PolarHBondContact N-O 3.48Å; H358-Y442 HydrophobicContact CB-CD1 3.45Å; H358-Y442 VanDerWaalsContact CB-CD1 3.45Å; H358-Y442 HydrophobicContact CB-CE1 3.43Å; H358-Y442 VanDerWaalsContact CB-CE1 3.43Å; H358-Y442 HydrophobicContact CB-CG 4.06Å; H358-Y442 CarbonylContact O-C 3.57Å; H358-Y442 WeakPolarHBondContact O-CA 3.34Å; H358-I443 PolarHBondContact O-N 3.35Å
359	A	87.7	Confident	81.4	Confident	3 Å²	3	58.5 Å²	58.5	3%	0.025	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	121.7	173.2	0	0	0	0	0	110.8	W361 S362 S365 L388 I443	A359-W361 HydrophobicContact CB-CD2 4.13Å; A359-W361 HydrophobicContact CB-CH2 4.27Å; A359-W361 HydrophobicContact CB-CZ2 3.77Å; A359-W361 PolarHBondContact O-N 3.49Å; A359-S362 CarbonylContact O-C 3.41Å; A359-S362 PolarHBondContact O-N 2.85Å; A359-S362 VanDerWaalsContact O-N 3.11Å; A359-S365 PolarHBondContact N-O 3.16Å; A359-L388 HydrophobicContact CB-CD1 4.28Å; A359-I443 HydrophobicContact CB-CG2 4.21Å
360	A	82.2	Confident	82.4	Confident	12 Å²	12	59.6 Å²	59.6	10%	0.099	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-25.7	-174.9	0	0	0	0	0	114.2	N151 L152 H358 I443 V444	N151-A360 HydrophobicContact CB-CB 3.96Å; N151-A360 CarbonylContact O-C 3.6Å; N151-A360 VanDerWaalsContact O-O 3.13Å; L152-A360 WeakPolarHBondContact CD2-O 3.28Å; H358-A360 PolarHBondContact O-N 3.38Å; A360-I443 WeakPolarHBondContact CB-O 3.32Å; A360-I443 PolarHBondContact N-O 2.97Å; A360-V444 HydrophobicContact CB-CB 4.43Å; A360-V444 HydrophobicContact CB-CG1 3.7Å
361	W	77.8	Confident	83.3	Confident	58 Å²	58	53.4 Å²	53.4	22%	0.22	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-7.2	178.1	57.8	87.7	0	0	0	113.9	N151 A359 L388 F398 I443	N151-W361 WeakPolarHBondContact O-CA 3.16Å; A359-W361 HydrophobicContact CB-CD2 4.13Å; A359-W361 HydrophobicContact CB-CH2 4.27Å; A359-W361 HydrophobicContact CB-CZ2 3.77Å; A359-W361 PolarHBondContact O-N 3.49Å; W361-L388 HydrophobicContact CH2-CD1 4.37Å; W361-L388 HydrophobicContact CZ2-CD1 3.95Å; W361-F398 HydrophobicContact CH2-CD1 4.15Å; W361-F398 AromaticContact CH2-CE1 3.82Å; W361-F398 HydrophobicContact CH2-CE1 3.82Å; W361-F398 HydrophobicContact CZ3-CD1 4.02Å; W361-F398 AromaticContact CZ3-CE1 3.8Å; W361-F398 HydrophobicContact CZ3-CE1 3.8Å; W361-I443 HydrophobicContact CH2-CD1 4.35Å; W361-I443 HydrophobicContact CH2-CG1 4.16Å; W361-I443 HydrophobicContact CH2-CG2 3.73Å; W361-I443 HydrophobicContact CZ2-CG2 4.5Å; W361-I443 HydrophobicContact CZ3-CG1 4.35Å; W361-I443 HydrophobicContact CZ3-CG2 4.13Å
362	S	75.5	Confident	84.8	Confident	30 Å²	30	47.5 Å²	47.5	21%	0.21	26%	0.263	C	S	.	.			trans	-138.5	129.5	-175.4	171	0	0	0	0	111.8	A359 S364 S365	A359-S362 CarbonylContact O-C 3.41Å; A359-S362 PolarHBondContact O-N 2.85Å; A359-S362 VanDerWaalsContact O-N 3.11Å; S362-S364 VanDerWaalsContact C-N 3.31Å; S362-S364 PolarHBondContact O-N 2.9Å; S362-S364 PolarHBondContact OG-N 2.82Å; S362-S364 PolarHBondContact OG-OG 2.88Å; S362-S365 WeakPolarHBondContact CB-OG 3.36Å; S362-S365 WeakPolarHBondContact OG-CB 3.41Å; S362-S365 PolarHBondContact OG-N 2.88Å; S362-S365 PolarHBondContact OG-OG 3.01Å
363	R	70.3	Confident	85.7	Confident	62 Å²	62	49.2 Å²	49.2	23%	0.234	27%	0.267	C	S	.	.	S	Bend	trans	-71.3	-25.7	176.9	-67.7	-171.7	176.9	-168.2	-1.1	113.2	Q92 V93	Q92-R363 PolarHBondContact NE2-O 2.85Å; Q92-R363 PolarHBondContact OE1-O 3.03Å; Q92-R363 VanDerWaalsContact OE1-O 3.13Å; V93-R363 HydrophobicContact CG2-CG 3.92Å
364	S	71.1	Confident	86.1	Confident	99 Å²	99	54.1 Å²	54.1	69%	0.692	30%	0.297	S	S	*	.	S	Bend	trans	-99	-18.8	-172.7	48.9	0	0	0	0	114.4	S362 V366	S362-S364 VanDerWaalsContact C-N 3.31Å; S362-S364 PolarHBondContact O-N 2.9Å; S362-S364 PolarHBondContact OG-N 2.82Å; S362-S364 PolarHBondContact OG-OG 2.88Å; S364-V366 PolarHBondContact O-N 2.76Å
365	S	82.4	Confident	86.3	Confident	38 Å²	38	50.5 Å²	50.5	27%	0.266	28%	0.276	S	S	.	.			trans	-85.1	107.5	-173.8	-55.7	0	0	0	0	110.7	A359 S362	A359-S365 PolarHBondContact N-O 3.16Å; S362-S365 WeakPolarHBondContact CB-OG 3.36Å; S362-S365 WeakPolarHBondContact OG-CB 3.41Å; S362-S365 PolarHBondContact OG-N 2.88Å; S362-S365 PolarHBondContact OG-OG 3.01Å
366	V	87.9	Confident	86.6	Confident	60 Å²	60	52 Å²	52	36%	0.364	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	131.8	176.4	-174.8	0	0	0	0	108.6	K356 V357 H358 S364	K356-V366 HydrophobicContact CB-CG1 4Å; K356-V366 HydrophobicContact CD-CG1 4.47Å; K356-V366 HydrophobicContact CG-CG1 4.47Å; V357-V366 WeakPolarHBondContact O-CA 3.49Å; H358-V366 VanDerWaalsContact ND1-CG2 3.28Å; H358-V366 WeakPolarHBondContact ND1-CG2 3.42Å; S364-V366 PolarHBondContact O-N 2.76Å
367	V	91.4	Very high	86.7	Confident	10 Å²	10	46.3 Å²	46.3	6%	0.061	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	141	-178	-179.5	0	0	0	0	109.2	K356 V357 V369 V384 Q387 L388	K356-V367 CarbonylContact C-O 3.57Å; K356-V367 WeakPolarHBondContact CA-O 3.47Å; V357-V367 PolarHBondContact N-O 3.24Å; V357-V367 PolarHBondContact O-N 3.17Å; V367-V369 HydrophobicContact CG1-CG2 4.03Å; V367-V384 HydrophobicContact CB-CG1 4.47Å; V367-V384 HydrophobicContact CG1-CG2 4.44Å; V367-V384 HydrophobicContact CG2-CG1 4.38Å; V367-Q387 HydrophobicContact CG1-CB 3.59Å; V367-Q387 HydrophobicContact CG1-CG 3.99Å; V367-Q387 HydrophobicContact CG2-CB 4.14Å; V367-L388 HydrophobicContact CG2-CD2 3.6Å; V367-L388 HydrophobicContact CG2-CG 3.82Å
368	S	93.1	Very high	86.7	Confident	63 Å²	63	48 Å²	48	44%	0.441	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	131.1	171.5	-61.9	0	0	0	0	109.1	I355 Q387	I355-S368 WeakPolarHBondContact O-CA 3.28Å; S368-Q387 PolarHBondContact O-NE2 2.85Å
369	V	92.5	Very high	86.9	Confident	3 Å²	3	49 Å²	49	2%	0.018	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	130.4	-178.8	-175.2	0	0	0	0	109	V354 I355 V357 V367 V380 D383 V384	V354-V369 CarbonylContact C-O 3.59Å; V354-V369 WeakPolarHBondContact CA-O 3.35Å; I355-V369 HydrophobicContact CG1-CB 4.19Å; I355-V369 PolarHBondContact N-O 2.82Å; I355-V369 PolarHBondContact O-N 3.5Å; V357-V369 HydrophobicContact CG2-CG2 4.48Å; V367-V369 HydrophobicContact CG1-CG2 4.03Å; V369-V380 HydrophobicContact CG1-CG1 4.32Å; V369-V380 HydrophobicContact CG1-CG2 4.28Å; V369-D383 HydrophobicContact CG1-CB 4.2Å; V369-V384 HydrophobicContact CG2-CG2 3.57Å
370	E	91.2	Very high	87.1	Confident	147 Å²	147	48.9 Å²	48.9	69%	0.687	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.3	133.9	171.6	-76.3	175.4	-172.6	0	0	109.9	D353 V354	D353-E370 CarbonylContact O-C 3.58Å; D353-E370 WeakPolarHBondContact O-CA 3.45Å; V354-E370 HydrophobicContact CG2-CG 3.95Å
371	V	90.1	Very high	87.6	Confident	3 Å²	3	49 Å²	49	2%	0.018	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	119.8	-176	-176.8	0	0	0	0	108.2	D353 I355 M421 V422 L425	D353-V371 PolarHBondContact N-O 3.15Å; D353-V371 WeakPolarHBondContact O-CB 3.27Å; D353-V371 PolarHBondContact O-N 3.06Å; I355-V371 HydrophobicContact CB-CG2 4.33Å; I355-V371 HydrophobicContact CD1-CG2 3.73Å; I355-V371 HydrophobicContact CG1-CG2 3.66Å; I355-V371 HydrophobicContact CG2-CG2 3.89Å; V371-M421 HydrophobicContact CG1-CB 3.5Å; V371-M421 VanDerWaalsContact CG1-CB 3.5Å; V371-V422 HydrophobicContact CG1-CG2 3.83Å; V371-L425 HydrophobicContact CG1-CD1 4.44Å
372	S	88.4	Confident	88.3	Confident	41 Å²	41	48.9 Å²	48.9	29%	0.287	29%	0.291	S	S	.	.			trans	-108.6	173	174.7	69.1	0	0	0	0	111.7	T374 S375 V422	S372-T374 PolarHBondContact O-N 3.21Å; S372-T374 PolarHBondContact OG-OG1 3.09Å; S372-S375 PolarHBondContact N-OG 2.88Å; S372-S375 WeakPolarHBondContact O-CB 3.18Å; S372-S375 PolarHBondContact O-N 3.44Å; S372-S375 PolarHBondContact O-OG 2.87Å; S372-S375 PolarHBondContact OG-OG 3.36Å; S372-S375 VanDerWaalsContact OG-OG 3.1Å; S372-V422 VanDerWaalsContact O-CG2 3.24Å; S372-V422 WeakPolarHBondContact O-CG2 3.4Å
373	E	85.6	Confident	89	Confident	152 Å²	152	50.9 Å²	50.9	71%	0.71	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-22.5	179	-63.3	-169	164.2	0	0	114.8
374	T	88.1	Confident	90.1	Very high	118 Å²	118	48 Å²	48	72%	0.724	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-7.2	177.7	57.6	0	0	0	0	113.3	S372 T376	S372-T374 PolarHBondContact O-N 3.21Å; S372-T374 PolarHBondContact OG-OG1 3.09Å; T374-T376 PolarHBondContact O-N 2.88Å
375	S	92.8	Very high	91	Very high	11 Å²	11	43.5 Å²	43.5	8%	0.077	26%	0.256	C	S	.	.			trans	-72.5	117.9	-174.8	-62.4	0	0	0	0	111.4	S372 M421	S372-S375 PolarHBondContact N-OG 2.88Å; S372-S375 WeakPolarHBondContact O-CB 3.18Å; S372-S375 PolarHBondContact O-N 3.44Å; S372-S375 PolarHBondContact O-OG 2.87Å; S372-S375 PolarHBondContact OG-OG 3.36Å; S372-S375 VanDerWaalsContact OG-OG 3.1Å; S375-M421 PolarHBondContact O-N 3.41Å
376	T	95.2	Very high	91.4	Very high	40 Å²	40	46.2 Å²	46.2	25%	0.245	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-101.3	162.5	171.5	64.7	0	0	0	0	111.3	T374 A378 S379 V380 E419	T374-T376 PolarHBondContact O-N 2.88Å; T376-A378 PolarHBondContact O-N 3.27Å; T376-S379 PolarHBondContact N-OG 3.44Å; T376-S379 PolarHBondContact O-N 2.86Å; T376-S379 PolarHBondContact O-OG 2.89Å; T376-S379 PolarHBondContact OG1-N 3.49Å; T376-S379 PolarHBondContact OG1-OG 3.29Å; T376-V380 PolarHBondContact O-N 3.29Å; T376-E419 CarbonylContact C-O 2.88Å; T376-E419 VanDerWaalsContact CA-O 3.24Å; T376-E419 WeakPolarHBondContact CA-O 3.42Å
377	A	93.9	Very high	91.5	Very high	5 Å²	5	48.1 Å²	48.1	4%	0.041	27%	0.272	C	S	.	.	H	α-helix	trans	-53.7	-37.9	174.1	0	0	0	0	0	112.6	L381 L400 L415 S416 E419 M421	A377-L381 VanDerWaalsContact O-CB 3.31Å; A377-L381 WeakPolarHBondContact O-CB 3.48Å; A377-L381 PolarHBondContact O-N 2.85Å; A377-L400 HydrophobicContact CB-CD2 4.15Å; A377-L415 HydrophobicContact CB-CB 4.13Å; A377-S416 WeakPolarHBondContact CB-O 3.35Å; A377-E419 HydrophobicContact CB-CB 4.48Å; A377-E419 PolarHBondContact N-O 2.93Å; A377-M421 HydrophobicContact CB-SD 4.05Å
378	A	93.1	Very high	91.4	Very high	37 Å²	37	49.4 Å²	49.4	31%	0.306	28%	0.279	S	S	.	.	H	α-helix	trans	-67.1	-39.3	175.9	0	0	0	0	0	113.5	T376 L381 S382 P417	T376-A378 PolarHBondContact O-N 3.27Å; A378-L381 WeakPolarHBondContact O-CB 3.12Å; A378-L381 PolarHBondContact O-N 3.36Å; A378-S382 PolarHBondContact O-N 2.77Å; A378-S382 VanDerWaalsContact O-N 3.08Å; A378-S382 PolarHBondContact O-OG 3.16Å; A378-P417 HydrophobicContact CB-CB 4.13Å; A378-P417 VanDerWaalsContact CB-O 3.3Å; A378-P417 WeakPolarHBondContact CB-O 3.49Å; A378-P417 PolarHBondContact N-O 3.37Å
379	S	93.7	Very high	91.1	Very high	37 Å²	37	53.7 Å²	53.7	26%	0.259	30%	0.297	S	S	.	.	H	α-helix	trans	-65.3	-45.5	175.6	63.8	0	0	0	0	111.5	T376 L381 S382 D383	T376-S379 PolarHBondContact N-OG 3.44Å; T376-S379 PolarHBondContact O-N 2.86Å; T376-S379 PolarHBondContact O-OG 2.89Å; T376-S379 PolarHBondContact OG1-N 3.49Å; T376-S379 PolarHBondContact OG1-OG 3.29Å; S379-L381 VanDerWaalsContact C-N 3.33Å; S379-L381 PolarHBondContact O-N 2.98Å; S379-S382 WeakPolarHBondContact O-CB 3.42Å; S379-S382 PolarHBondContact O-N 3.17Å; S379-S382 VanDerWaalsContact O-N 3.15Å; S379-D383 PolarHBondContact O-N 3.37Å
380	V	93.4	Very high	90.6	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-60.6	-42.9	175	169.6	0	0	0	0	111.2	I355 V357 V369 T376 S382 D383 V384 L400 M421	I355-V380 HydrophobicContact CD1-CG1 3.87Å; I355-V380 HydrophobicContact CD1-CG2 4.36Å; V357-V380 HydrophobicContact CG2-CG1 4.11Å; V369-V380 HydrophobicContact CG1-CG1 4.32Å; V369-V380 HydrophobicContact CG1-CG2 4.28Å; T376-V380 PolarHBondContact O-N 3.29Å; V380-S382 VanDerWaalsContact C-N 3.28Å; V380-S382 PolarHBondContact O-N 3.03Å; V380-D383 PolarHBondContact O-N 3.24Å; V380-V384 HydrophobicContact CG1-CG2 4.26Å; V380-V384 VanDerWaalsContact O-CG2 3.23Å; V380-V384 WeakPolarHBondContact O-CG2 3.46Å; V380-V384 PolarHBondContact O-N 3.23Å; V380-L400 HydrophobicContact CB-CD2 4.3Å; V380-L400 HydrophobicContact CG1-CD2 3.94Å; V380-M421 HydrophobicContact CG2-CG 3.88Å
381	L	92.9	Very high	89.9	Confident	14 Å²	14	54.2 Å²	54.2	7%	0.073	30%	0.297	C	S	.	.	H	α-helix	trans	-56.8	-44.7	176.6	-171.1	89.5	0	0	0	111.4	A377 A378 S379 V384 L385 A395 F398 L400 I443	A377-L381 VanDerWaalsContact O-CB 3.31Å; A377-L381 WeakPolarHBondContact O-CB 3.48Å; A377-L381 PolarHBondContact O-N 2.85Å; A378-L381 WeakPolarHBondContact O-CB 3.12Å; A378-L381 PolarHBondContact O-N 3.36Å; S379-L381 VanDerWaalsContact C-N 3.33Å; S379-L381 PolarHBondContact O-N 2.98Å; L381-V384 PolarHBondContact O-N 2.89Å; L381-L385 HydrophobicContact CD2-CD1 4.5Å; L381-L385 HydrophobicContact CG-CD1 4.33Å; L381-L385 WeakPolarHBondContact O-CG 3.19Å; L381-L385 PolarHBondContact O-N 3.24Å; L381-A395 HydrophobicContact CD2-CB 4.3Å; L381-A395 WeakPolarHBondContact CD2-O 3.34Å; L381-F398 HydrophobicContact CD1-CB 3.91Å; L381-F398 HydrophobicContact CD2-CB 4.17Å; L381-F398 HydrophobicContact CG-CB 4.38Å; L381-L400 HydrophobicContact CD1-CB 4.46Å; L381-I443 HydrophobicContact CD1-CD1 3.78Å; L381-I443 HydrophobicContact CD1-CG1 3.86Å; L381-I443 HydrophobicContact CG-CD1 4.34Å
382	S	91.3	Very high	89.1	Confident	56 Å²	56	58.1 Å²	58.1	39%	0.392	34%	0.338	S	S	.	.	H	α-helix	trans	-64.1	-43.9	179.9	-55.5	0	0	0	0	111.5	A378 S379 V380 V384 L385 L386	A378-S382 PolarHBondContact O-N 2.77Å; A378-S382 VanDerWaalsContact O-N 3.08Å; A378-S382 PolarHBondContact O-OG 3.16Å; S379-S382 WeakPolarHBondContact O-CB 3.42Å; S379-S382 PolarHBondContact O-N 3.17Å; S379-S382 VanDerWaalsContact O-N 3.15Å; V380-S382 VanDerWaalsContact C-N 3.28Å; V380-S382 PolarHBondContact O-N 3.03Å; S382-V384 PolarHBondContact O-N 3.25Å; S382-L385 PolarHBondContact O-N 3.02Å; S382-L386 PolarHBondContact O-N 3.1Å
383	D	91.4	Very high	88.8	Confident	73 Å²	73	59.7 Å²	59.7	39%	0.39	34%	0.341	S	S	.	.	H	α-helix	trans	-64.4	-38.9	176.7	-67.4	-14.7	0	0	0	112.1	V369 S379 V380 L386 Q387	V369-D383 HydrophobicContact CG1-CB 4.2Å; S379-D383 PolarHBondContact O-N 3.37Å; V380-D383 PolarHBondContact O-N 3.24Å; D383-L386 WeakPolarHBondContact O-CB 3.38Å; D383-L386 PolarHBondContact O-N 3.03Å; D383-Q387 WeakPolarHBondContact O-CG 3.14Å; D383-Q387 PolarHBondContact O-N 2.79Å; D383-Q387 VanDerWaalsContact O-N 3.08Å
384	V	92.4	Very high	88.6	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-67	-44.5	176.4	172.8	0	0	0	0	111.1	V357 V367 V369 V380 L381 S382 L386 Q387 L388 I443	V357-V384 HydrophobicContact CB-CG1 4.43Å; V357-V384 HydrophobicContact CB-CG2 3.71Å; V357-V384 HydrophobicContact CG1-CG1 4.11Å; V357-V384 HydrophobicContact CG1-CG2 3.92Å; V357-V384 HydrophobicContact CG2-CG2 3.81Å; V367-V384 HydrophobicContact CB-CG1 4.47Å; V367-V384 HydrophobicContact CG1-CG2 4.44Å; V367-V384 HydrophobicContact CG2-CG1 4.38Å; V369-V384 HydrophobicContact CG2-CG2 3.57Å; V380-V384 HydrophobicContact CG1-CG2 4.26Å; V380-V384 VanDerWaalsContact O-CG2 3.23Å; V380-V384 WeakPolarHBondContact O-CG2 3.46Å; V380-V384 PolarHBondContact O-N 3.23Å; L381-V384 PolarHBondContact O-N 2.89Å; S382-V384 PolarHBondContact O-N 3.25Å; V384-L386 PolarHBondContact O-N 3.29Å; V384-Q387 PolarHBondContact O-N 3.44Å; V384-L388 HydrophobicContact CG1-CD1 3.76Å; V384-L388 HydrophobicContact CG1-CG 4.28Å; V384-L388 WeakPolarHBondContact O-CB 3.17Å; V384-L388 VanDerWaalsContact O-CG 3.3Å; V384-L388 WeakPolarHBondContact O-CG 3.3Å; V384-L388 PolarHBondContact O-N 3.06Å; V384-I443 HydrophobicContact CG1-CB 4.24Å; V384-I443 HydrophobicContact CG1-CD1 3.99Å; V384-I443 HydrophobicContact CG1-CG2 3.89Å
385	L	91.3	Very high	88.3	Confident	5 Å²	5	53.5 Å²	53.5	3%	0.026	31%	0.313	C	S	.	.	H	α-helix	trans	-62	-31.8	176.2	-72.8	171.8	0	0	0	111.7	L381 S382 D389 R390 A395 F398 I443	L381-L385 HydrophobicContact CD2-CD1 4.5Å; L381-L385 HydrophobicContact CG-CD1 4.33Å; L381-L385 WeakPolarHBondContact O-CG 3.19Å; L381-L385 PolarHBondContact O-N 3.24Å; S382-L385 PolarHBondContact O-N 3.02Å; L385-D389 PolarHBondContact O-N 2.93Å; L385-R390 HydrophobicContact CD2-CB 4.04Å; L385-R390 PolarHBondContact O-N 2.91Å; L385-A395 HydrophobicContact CD1-CB 4.17Å; L385-F398 HydrophobicContact CD1-CD2 4.04Å; L385-F398 HydrophobicContact CD2-CD1 4.39Å; L385-F398 HydrophobicContact CD2-CD2 4Å; L385-F398 HydrophobicContact CD2-CE1 4.4Å; L385-F398 HydrophobicContact CD2-CE2 4.01Å; L385-F398 HydrophobicContact CD2-CG 4.2Å; L385-F398 HydrophobicContact CD2-CZ 4.23Å; L385-I443 HydrophobicContact CD2-CD1 3.61Å; L385-I443 HydrophobicContact CG-CD1 3.79Å
386	L	89.6	Confident	87.9	Confident	95 Å²	95	57 Å²	57	50%	0.497	34%	0.338	S	S	.	.	H	α-helix	trans	-62.8	-53.1	172.6	-163.2	135.7	0	0	0	112	S382 D383 V384 L388 D389 Q391	S382-L386 PolarHBondContact O-N 3.1Å; D383-L386 WeakPolarHBondContact O-CB 3.38Å; D383-L386 PolarHBondContact O-N 3.03Å; V384-L386 PolarHBondContact O-N 3.29Å; L386-L388 PolarHBondContact O-N 3.13Å; L386-D389 PolarHBondContact O-N 2.81Å; L386-D389 VanDerWaalsContact O-N 3.13Å; L386-Q391 HydrophobicContact CB-CG 4.39Å; L386-Q391 HydrophobicContact CG-CG 4.26Å
387	Q	91	Very high	87.5	Confident	100 Å²	100	56.6 Å²	56.6	47%	0.467	34%	0.337	S	S	.	.	H	α-helix	trans	-71.2	-15.8	-177.8	-66.4	-173.1	57.5	0	0	113.6	V367 S368 D383 V384	V367-Q387 HydrophobicContact CG1-CB 3.59Å; V367-Q387 HydrophobicContact CG1-CG 3.99Å; V367-Q387 HydrophobicContact CG2-CB 4.14Å; S368-Q387 PolarHBondContact O-NE2 2.85Å; D383-Q387 WeakPolarHBondContact O-CG 3.14Å; D383-Q387 PolarHBondContact O-N 2.79Å; D383-Q387 VanDerWaalsContact O-N 3.08Å; V384-Q387 PolarHBondContact O-N 3.44Å
388	L	88.2	Confident	87.3	Confident	37 Å²	37	56.7 Å²	56.7	19%	0.194	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	5.1	173.5	-67.4	178.5	0	0	0	113.6	A359 W361 V367 V384 L386 R390 I443	A359-L388 HydrophobicContact CB-CD1 4.28Å; W361-L388 HydrophobicContact CH2-CD1 4.37Å; W361-L388 HydrophobicContact CZ2-CD1 3.95Å; V367-L388 HydrophobicContact CG2-CD2 3.6Å; V367-L388 HydrophobicContact CG2-CG 3.82Å; V384-L388 HydrophobicContact CG1-CD1 3.76Å; V384-L388 HydrophobicContact CG1-CG 4.28Å; V384-L388 WeakPolarHBondContact O-CB 3.17Å; V384-L388 VanDerWaalsContact O-CG 3.3Å; V384-L388 WeakPolarHBondContact O-CG 3.3Å; V384-L388 PolarHBondContact O-N 3.06Å; L386-L388 PolarHBondContact O-N 3.13Å; L388-R390 VanDerWaalsContact C-N 3.28Å; L388-R390 HydrophobicContact CB-CG 4.46Å; L388-R390 PolarHBondContact O-N 2.87Å; L388-I443 HydrophobicContact CD1-CG2 4.13Å
389	D	86.3	Confident	87.2	Confident	154 Å²	154	56.1 Å²	56.1	82%	0.824	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	32.7	-176.6	-61.1	-45.7	0	0	0	114	L385 L386	L385-D389 PolarHBondContact O-N 2.93Å; L386-D389 PolarHBondContact O-N 2.81Å; L386-D389 VanDerWaalsContact O-N 3.13Å
390	R	82.6	Confident	87.2	Confident	45 Å²	45	54.6 Å²	54.6	17%	0.17	32%	0.319	C	S	.	.			trans	-114.7	27	-179.1	-62.5	-175.6	75.8	179.2	6.1	113.9	L385 L388 G392 E393	L385-R390 HydrophobicContact CD2-CB 4.04Å; L385-R390 PolarHBondContact O-N 2.91Å; L388-R390 VanDerWaalsContact C-N 3.28Å; L388-R390 HydrophobicContact CB-CG 4.46Å; L388-R390 PolarHBondContact O-N 2.87Å; R390-G392 PolarHBondContact O-N 2.86Å; R390-E393 IonicContact CZ-OE1 2.92Å; R390-E393 IonicContact CZ-OE2 3.24Å; R390-E393 IonicContact NE-OE1 3.09Å; R390-E393 PolarHBondContact NE-OE1 3.05Å; R390-E393 IonicContact NE-OE2 2.71Å; R390-E393 IonicContact NH2-OE1 3.42Å; R390-E393 PolarHBondContact NH2-OE1 3.29Å; R390-E393 IonicContact NH2-OE2 2.78Å; R390-E393 PolarHBondContact NH2-OE2 3.31Å; R390-E393 PolarHBondContact O-N 2.84Å
391	Q	76.8	Confident	87.1	Confident	115 Å²	115	55.8 Å²	55.8	54%	0.537	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-28.5	-178.7	-68.3	-82.2	-71	0	0	114.7	L386 E393	L386-Q391 HydrophobicContact CB-CG 4.39Å; L386-Q391 HydrophobicContact CG-CG 4.26Å; Q391-E393 VanDerWaalsContact C-N 3.27Å; Q391-E393 PolarHBondContact O-N 2.92Å
392	G	73.1	Confident	87.2	Confident	85 Å²	85	56.2 Å²	56.2	88%	0.876	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-2.4	-178	0	0	0	0	0	114.6	R390	R390-G392 PolarHBondContact O-N 2.86Å
393	E	81.4	Confident	87.2	Confident	75 Å²	75	53.6 Å²	53.6	35%	0.35	31%	0.308	S	S	.	.	S	Bend	trans	-94.4	148.3	177.6	-62.2	-173.6	-135.2	0	0	110.9	R390 Q391 A395 F398	R390-E393 IonicContact CZ-OE1 2.92Å; R390-E393 IonicContact CZ-OE2 3.24Å; R390-E393 IonicContact NE-OE1 3.09Å; R390-E393 PolarHBondContact NE-OE1 3.05Å; R390-E393 IonicContact NE-OE2 2.71Å; R390-E393 IonicContact NH2-OE1 3.42Å; R390-E393 PolarHBondContact NH2-OE1 3.29Å; R390-E393 IonicContact NH2-OE2 2.78Å; R390-E393 PolarHBondContact NH2-OE2 3.31Å; R390-E393 PolarHBondContact O-N 2.84Å; Q391-E393 VanDerWaalsContact C-N 3.27Å; Q391-E393 PolarHBondContact O-N 2.92Å; E393-A395 PolarHBondContact O-N 3.02Å; E393-A395 VanDerWaalsContact O-N 3.16Å; E393-F398 HydrophobicContact CB-CE2 3.96Å; E393-F398 HydrophobicContact CB-CZ 4.49Å; E393-F398 WeakPolarHBondContact OE2-CZ 3.31Å
394	D	82.3	Confident	87.2	Confident	101 Å²	101	51.9 Å²	51.9	54%	0.54	30%	0.296	S	S	.	.			trans	-64.5	116.9	178.8	179.4	7.4	0	0	0	110.5	S396 S397	D394-S396 PolarHBondContact O-N 3.29Å; D394-S396 VanDerWaalsContact O-N 3.15Å; D394-S396 VanDerWaalsContact OD1-CB 3.32Å; D394-S396 WeakPolarHBondContact OD1-CB 3.23Å; D394-S396 PolarHBondContact OD1-N 2.8Å; D394-S396 PolarHBondContact OD1-OG 3.02Å; D394-S396 PolarHBondContact OD2-OG 2.81Å; D394-S397 VanDerWaalsContact O-CB 3.26Å; D394-S397 WeakPolarHBondContact O-CB 3.49Å; D394-S397 PolarHBondContact O-N 2.96Å; D394-S397 PolarHBondContact O-OG 2.89Å
395	A	81.8	Confident	87.1	Confident	38 Å²	38	52 Å²	52	31%	0.314	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-58.2	-26.5	177.6	0	0	0	0	0	112.7	L381 L385 E393 S397 F398	L381-A395 HydrophobicContact CD2-CB 4.3Å; L381-A395 WeakPolarHBondContact CD2-O 3.34Å; L385-A395 HydrophobicContact CD1-CB 4.17Å; E393-A395 PolarHBondContact O-N 3.02Å; E393-A395 VanDerWaalsContact O-N 3.16Å; A395-S397 PolarHBondContact O-N 2.8Å; A395-F398 PolarHBondContact O-N 2.99Å
396	S	83.6	Confident	86.9	Confident	85 Å²	85	52.8 Å²	52.8	59%	0.594	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-64.9	-20.3	174.8	92.6	0	0	0	0	113	D394 F398 N446	D394-S396 PolarHBondContact O-N 3.29Å; D394-S396 VanDerWaalsContact O-N 3.15Å; D394-S396 VanDerWaalsContact OD1-CB 3.32Å; D394-S396 WeakPolarHBondContact OD1-CB 3.23Å; D394-S396 PolarHBondContact OD1-N 2.8Å; D394-S396 PolarHBondContact OD1-OG 3.02Å; D394-S396 PolarHBondContact OD2-OG 2.81Å; S396-F398 PolarHBondContact O-N 3.19Å; S396-N446 PolarHBondContact O-ND2 2.85Å
397	S	86.8	Confident	86.8	Confident	32 Å²	32	48.6 Å²	48.6	22%	0.224	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-81	4.9	174.4	78.2	0	0	0	0	113.4	D394 A395 Q445 N446	D394-S397 VanDerWaalsContact O-CB 3.26Å; D394-S397 WeakPolarHBondContact O-CB 3.49Å; D394-S397 PolarHBondContact O-N 2.96Å; D394-S397 PolarHBondContact O-OG 2.89Å; A395-S397 PolarHBondContact O-N 2.8Å; S397-Q445 CarbonylContact O-C 3.59Å; S397-Q445 WeakPolarHBondContact O-CA 3.21Å; S397-Q445 WeakPolarHBondContact O-CG 3.36Å; S397-N446 WeakPolarHBondContact O-CA 3.5Å; S397-N446 WeakPolarHBondContact O-CB 3.43Å; S397-N446 PolarHBondContact O-N 3.47Å
398	F	89.9	Confident	86.6	Confident	6 Å²	6	47.9 Å²	47.9	3%	0.026	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	156.3	176	-60.4	-90.1	0	0	0	111.9	W361 L381 L385 E393 A395 S396 I443 V444 Q445 N446	W361-F398 HydrophobicContact CH2-CD1 4.15Å; W361-F398 AromaticContact CH2-CE1 3.82Å; W361-F398 HydrophobicContact CH2-CE1 3.82Å; W361-F398 HydrophobicContact CZ3-CD1 4.02Å; W361-F398 AromaticContact CZ3-CE1 3.8Å; W361-F398 HydrophobicContact CZ3-CE1 3.8Å; L381-F398 HydrophobicContact CD1-CB 3.91Å; L381-F398 HydrophobicContact CD2-CB 4.17Å; L381-F398 HydrophobicContact CG-CB 4.38Å; L385-F398 HydrophobicContact CD1-CD2 4.04Å; L385-F398 HydrophobicContact CD2-CD1 4.39Å; L385-F398 HydrophobicContact CD2-CD2 4Å; L385-F398 HydrophobicContact CD2-CE1 4.4Å; L385-F398 HydrophobicContact CD2-CE2 4.01Å; L385-F398 HydrophobicContact CD2-CG 4.2Å; L385-F398 HydrophobicContact CD2-CZ 4.23Å; E393-F398 HydrophobicContact CB-CE2 3.96Å; E393-F398 HydrophobicContact CB-CZ 4.49Å; E393-F398 WeakPolarHBondContact OE2-CZ 3.31Å; A395-F398 PolarHBondContact O-N 2.99Å; S396-F398 PolarHBondContact O-N 3.19Å; F398-I443 HydrophobicContact CB-CD1 4.26Å; F398-I443 HydrophobicContact CB-CG1 4.21Å; F398-I443 HydrophobicContact CD1-CD1 4.19Å; F398-I443 HydrophobicContact CD1-CG1 4.09Å; F398-I443 HydrophobicContact CG-CD1 4.34Å; F398-I443 HydrophobicContact CG-CG1 4.48Å; F398-V444 CarbonylContact C-O 3.56Å; F398-V444 WeakPolarHBondContact CA-O 3.25Å; F398-V444 WeakPolarHBondContact CB-O 3.39Å; F398-V444 WeakPolarHBondContact CD1-O 3.43Å; F398-Q445 HydrophobicContact CD1-CB 4.02Å; F398-Q445 HydrophobicContact CD1-CG 4.23Å; F398-Q445 HydrophobicContact CE1-CB 3.82Å; F398-Q445 HydrophobicContact CE1-CG 3.83Å; F398-Q445 HydrophobicContact CZ-CG 4.23Å; F398-N446 PolarHBondContact N-ND2 3.29Å; F398-N446 PolarHBondContact O-ND2 3.19Å
399	S	91.6	Very high	86.6	Confident	26 Å²	26	50.1 Å²	50.1	18%	0.182	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	154.1	170.8	-58.8	0	0	0	0	110.9	V444 N446	S399-V444 PolarHBondContact N-O 3.22Å; S399-V444 VanDerWaalsContact O-CG2 3.3Å; S399-V444 WeakPolarHBondContact O-CG2 3.46Å; S399-V444 PolarHBondContact O-N 3.49Å; S399-N446 WeakPolarHBondContact CB-OD1 3.41Å; S399-N446 PolarHBondContact N-OD1 2.9Å; S399-N446 VanDerWaalsContact OG-CG 3.25Å; S399-N446 PolarHBondContact OG-ND2 3.25Å; S399-N446 VanDerWaalsContact OG-ND2 3.09Å; S399-N446 PolarHBondContact OG-OD1 3.16Å
400	L	93.6	Very high	86.6	Confident	5 Å²	5	43.7 Å²	43.7	3%	0.026	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	128.1	169.8	-166.7	64.6	0	0	0	109.1	V357 A377 V380 L381 L415 M421 F441	V357-L400 HydrophobicContact CG1-CD1 3.75Å; V357-L400 HydrophobicContact CG2-CD1 4.3Å; A377-L400 HydrophobicContact CB-CD2 4.15Å; V380-L400 HydrophobicContact CB-CD2 4.3Å; V380-L400 HydrophobicContact CG1-CD2 3.94Å; L381-L400 HydrophobicContact CD1-CB 4.46Å; L400-L415 HydrophobicContact CD2-CD1 3.98Å; L400-L415 HydrophobicContact CG-CD1 4.15Å; L400-L415 PolarHBondContact O-N 3.35Å; L400-M421 HydrophobicContact CD2-CE 3.98Å; L400-M421 HydrophobicContact CD2-SD 3.89Å; L400-F441 HydrophobicContact CD1-CB 4.31Å
401	Q	92.1	Very high	86.8	Confident	25 Å²	25	46 Å²	46	12%	0.117	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	130.4	177.9	-77.1	-172.5	7.4	0	0	111.6	V403 Q413 T414 F441 Y442 V444	Q401-V403 HydrophobicContact CB-CG2 4.39Å; Q401-Q413 CarbonylContact C-O 3.54Å; Q401-Q413 VanDerWaalsContact CA-O 3.24Å; Q401-Q413 WeakPolarHBondContact CA-O 3.42Å; Q401-T414 PolarHBondContact NE2-OG1 2.93Å; Q401-F441 CarbonylContact O-C 3.58Å; Q401-F441 VanDerWaalsContact O-CA 3.29Å; Q401-F441 WeakPolarHBondContact O-CA 3.2Å; Q401-Y442 PolarHBondContact N-O 3.37Å; Q401-Y442 PolarHBondContact O-N 3.11Å; Q401-V444 HydrophobicContact CB-CG1 4.48Å; Q401-V444 HydrophobicContact CG-CG1 4.17Å; Q401-V444 HydrophobicContact CG-CG2 3.8Å
402	E	93.4	Very high	87.3	Confident	22 Å²	22	44.6 Å²	44.6	10%	0.103	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	129.9	161	-177.1	-171.4	-177.4	0	0	109.3	R412 Q413 L415 K424 I428 T439 F441	E402-R412 WeakPolarHBondContact O-CA 3.32Å; E402-Q413 HydrophobicContact CB-CB 4.49Å; E402-Q413 PolarHBondContact N-O 3.42Å; E402-Q413 PolarHBondContact O-N 2.82Å; E402-L415 HydrophobicContact CB-CD2 4.14Å; E402-K424 WeakPolarHBondContact OE2-CE 3.42Å; E402-K424 IonicContact OE2-NZ 2.65Å; E402-K424 PolarHBondContact OE2-NZ 2.68Å; E402-I428 WeakPolarHBondContact OE1-CD1 3.35Å; E402-T439 HydrophobicContact CG-CG2 3.6Å; E402-F441 HydrophobicContact CB-CD1 4.47Å; E402-F441 HydrophobicContact CB-CE1 4.21Å; E402-F441 HydrophobicContact CG-CE1 4.33Å
403	V	91.2	Very high	88.1	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.012	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	109.3	179.4	-176.9	0	0	0	0	109.7	P94 Q401 M405 V410 Q411 R412 T439 R440 Y442	P94-V403 HydrophobicContact CG-CG1 3.91Å; Q401-V403 HydrophobicContact CB-CG2 4.39Å; V403-M405 HydrophobicContact CG1-CG 4.12Å; V403-V410 HydrophobicContact CG1-CG1 3.63Å; V403-Q411 CarbonylContact C-O 3.55Å; V403-Q411 WeakPolarHBondContact CA-O 3.36Å; V403-R412 HydrophobicContact CG1-CG 4.16Å; V403-R412 HydrophobicContact CG2-CG 4.03Å; V403-T439 WeakPolarHBondContact O-CA 3.31Å; V403-R440 PolarHBondContact N-O 2.97Å; V403-R440 PolarHBondContact O-N 3Å; V403-Y442 HydrophobicContact CB-CD2 3.82Å; V403-Y442 HydrophobicContact CB-CE2 3.82Å; V403-Y442 HydrophobicContact CG1-CE2 4.23Å; V403-Y442 HydrophobicContact CG2-CD2 3.36Å; V403-Y442 HydrophobicContact CG2-CE2 3.83Å; V403-Y442 HydrophobicContact CG2-CG 4.23Å
404	Y	91.3	Very high	88.5	Confident	37 Å²	37	44.3 Å²	44.3	15%	0.145	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	117.2	172.9	172.4	-127.2	0	0	0	110.1	S406 V410 Q411 Q435 Q438	Y404-S406 PolarHBondContact O-N 3.4Å; Y404-V410 WeakPolarHBondContact O-CA 3.27Å; Y404-Q411 PolarHBondContact N-O 2.86Å; Y404-Q411 PolarHBondContact O-N 2.89Å; Y404-Q435 HydrophobicContact CD2-CB 4.46Å; Y404-Q435 HydrophobicContact CD2-CG 4.46Å; Y404-Q435 HydrophobicContact CE2-CB 4.05Å; Y404-Q435 HydrophobicContact CE2-CG 3.72Å; Y404-Q438 HydrophobicContact CD2-CB 4.11Å; Y404-Q438 HydrophobicContact CE2-CB 3.89Å
405	M	90.9	Very high	89	Confident	3 Å²	3	39.9 Å²	39.9	2%	0.015	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	60.8	-169.7	-53.3	-176.3	-56.4	0	0	112	V91 P94 A141 V403 Q438 R440	V91-M405 HydrophobicContact CB-CE 4.16Å; V91-M405 HydrophobicContact CB-SD 4.18Å; V91-M405 HydrophobicContact CG1-CE 4.43Å; V91-M405 HydrophobicContact CG1-SD 3.83Å; P94-M405 HydrophobicContact CB-CB 4.08Å; P94-M405 HydrophobicContact CB-CG 3.56Å; P94-M405 HydrophobicContact CB-SD 3.64Å; P94-M405 HydrophobicContact CG-CG 4Å; P94-M405 HydrophobicContact CG-SD 3.94Å; A141-M405 HydrophobicContact CB-CB 3.98Å; V403-M405 HydrophobicContact CG1-CG 4.12Å; M405-Q438 VanDerWaalsContact CB-O 3.3Å; M405-Q438 WeakPolarHBondContact CB-O 3.41Å; M405-Q438 WeakPolarHBondContact CE-O 3.43Å; M405-Q438 WeakPolarHBondContact CG-O 3.33Å; M405-Q438 PolarHBondContact N-O 3.43Å; M405-R440 HydrophobicContact CE-CG 3.42Å; M405-R440 VanDerWaalsContact CE-CG 3.42Å; M405-R440 HydrophobicContact SD-CB 4.39Å; M405-R440 HydrophobicContact SD-CG 3.71Å
406	S	88.3	Confident	89.6	Confident	20 Å²	20	40.5 Å²	40.5	14%	0.14	21%	0.213	C	C	.	.			trans	-66	153.7	175.7	114.9	0	0	0	0	111.3	A141 Y404 K408 Q409	A141-S406 WeakPolarHBondContact CB-O 3.17Å; Y404-S406 PolarHBondContact O-N 3.4Å; S406-K408 VanDerWaalsContact C-N 3.26Å; S406-K408 PolarHBondContact O-N 3.44Å; S406-K408 PolarHBondContact OG-N 3.36Å; S406-Q409 CarbonylContact C-O 3.42Å; S406-Q409 WeakPolarHBondContact CA-O 3.44Å; S406-Q409 WeakPolarHBondContact CB-O 3.38Å; S406-Q409 PolarHBondContact N-O 3.4Å; S406-Q409 PolarHBondContact O-N 3.21Å; S406-Q409 PolarHBondContact OG-N 2.85Å; S406-Q409 PolarHBondContact OG-O 3.22Å
407	S	86.6	Confident	90.1	Very high	7 Å²	7	40 Å²	40	5%	0.049	21%	0.208	C	C	.	.	S	Bend	trans	-66.2	-27.2	-176.9	65.3	0	0	0	0	114	H97 A136 S139	H97-S407 WeakPolarHBondContact CB-O 3.33Å; H97-S407 PolarHBondContact N-O 3.32Å; A136-S407 WeakPolarHBondContact O-CB 3.43Å; A136-S407 PolarHBondContact O-OG 3.43Å; S139-S407 WeakPolarHBondContact O-CB 3.4Å; S139-S407 WeakPolarHBondContact OG-CB 3.49Å
408	K	86.9	Confident	90.4	Very high	86 Å²	86	45.4 Å²	45.4	37%	0.374	23%	0.23	S	C	.	.	S	Bend	trans	-101.1	-21.3	179.9	-68.7	178.8	-178	176.8	0	113.3	A96 F99 S406	A96-K408 VanDerWaalsContact CB-C 3.42Å; A96-K408 WeakPolarHBondContact CB-O 3.49Å; F99-K408 HydrophobicContact CD2-CG 3.98Å; S406-K408 VanDerWaalsContact C-N 3.26Å; S406-K408 PolarHBondContact O-N 3.44Å; S406-K408 PolarHBondContact OG-N 3.36Å
409	Q	87.3	Confident	90.6	Very high	84 Å²	84	47.4 Å²	47.4	39%	0.393	24%	0.239	S	C	.	.			trans	-149.8	144	-177.1	-169	180	6.2	0	0	111.4	S406 Q411	S406-Q409 CarbonylContact C-O 3.42Å; S406-Q409 WeakPolarHBondContact CA-O 3.44Å; S406-Q409 WeakPolarHBondContact CB-O 3.38Å; S406-Q409 PolarHBondContact N-O 3.4Å; S406-Q409 PolarHBondContact O-N 3.21Å; S406-Q409 PolarHBondContact OG-N 2.85Å; S406-Q409 PolarHBondContact OG-O 3.22Å; Q409-Q411 HydrophobicContact CG-CG 4.05Å
410	V	87.5	Confident	90.7	Very high	18 Å²	18	51.3 Å²	51.3	11%	0.109	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	110.2	170.1	-178.7	0	0	0	0	107.8	P94 A96 A141 V403 Y404	P94-V410 HydrophobicContact CB-CG1 3.85Å; P94-V410 HydrophobicContact CB-CG2 3.85Å; P94-V410 HydrophobicContact CG-CG1 3.84Å; A96-V410 HydrophobicContact CB-CG2 4.2Å; A141-V410 HydrophobicContact CB-CG2 4.07Å; V403-V410 HydrophobicContact CG1-CG1 3.63Å; Y404-V410 WeakPolarHBondContact O-CA 3.27Å
411	Q	86.9	Confident	90.7	Very high	95 Å²	95	51.1 Å²	51.1	44%	0.444	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	140.2	179.5	-66.6	176.1	-16.3	0	0	109.5	V403 Y404 Q409	V403-Q411 CarbonylContact C-O 3.55Å; V403-Q411 WeakPolarHBondContact CA-O 3.36Å; Y404-Q411 PolarHBondContact N-O 2.86Å; Y404-Q411 PolarHBondContact O-N 2.89Å; Q409-Q411 HydrophobicContact CG-CG 4.05Å
412	R	86.9	Confident	90.6	Very high	84 Å²	84	51.1 Å²	51.1	32%	0.317	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	124.5	-177.6	-59.2	-178.5	177.6	71.5	-3.4	109.7	E402 V403	E402-R412 WeakPolarHBondContact O-CA 3.32Å; V403-R412 HydrophobicContact CG1-CG 4.16Å; V403-R412 HydrophobicContact CG2-CG 4.03Å
413	Q	89.1	Confident	90.5	Very high	98 Å²	98	54.3 Å²	54.3	46%	0.458	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	127.5	176.9	179.7	171.3	-11.5	0	0	109	Q401 E402	Q401-Q413 CarbonylContact C-O 3.54Å; Q401-Q413 VanDerWaalsContact CA-O 3.24Å; Q401-Q413 WeakPolarHBondContact CA-O 3.42Å; E402-Q413 HydrophobicContact CB-CB 4.49Å; E402-Q413 PolarHBondContact N-O 3.42Å; E402-Q413 PolarHBondContact O-N 2.82Å
414	T	90.7	Very high	90.5	Very high	56 Å²	56	54.8 Å²	54.8	34%	0.344	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	126.3	171.3	-56	0	0	0	0	108.2	Q401	Q401-T414 PolarHBondContact NE2-OG1 2.93Å
415	L	93.7	Very high	90.4	Very high	8 Å²	8	53.9 Å²	53.9	4%	0.042	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-78.3	144.7	-179.7	-60.3	179.8	0	0	0	110.1	A377 L400 E402 M421 K424 F441	A377-L415 HydrophobicContact CB-CB 4.13Å; L400-L415 HydrophobicContact CD2-CD1 3.98Å; L400-L415 HydrophobicContact CG-CD1 4.15Å; L400-L415 PolarHBondContact O-N 3.35Å; E402-L415 HydrophobicContact CB-CD2 4.14Å; L415-M421 HydrophobicContact CD1-CE 4.05Å; L415-M421 HydrophobicContact CD1-SD 3.9Å; L415-K424 HydrophobicContact CD2-CD 4.47Å; L415-F441 HydrophobicContact CD1-CD1 4.15Å; L415-F441 HydrophobicContact CD1-CE1 4.02Å
416	S	94	Very high	90.3	Very high	52 Å²	52	56.3 Å²	56.3	36%	0.364	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-69.3	144	173.8	64.6	0	0	0	0	110	A377 Q418 E419	A377-S416 WeakPolarHBondContact CB-O 3.35Å; S416-Q418 PolarHBondContact O-N 3.25Å; S416-Q418 VanDerWaalsContact O-N 3.09Å; S416-E419 PolarHBondContact N-OE2 2.88Å; S416-E419 WeakPolarHBondContact O-CB 3.49Å; S416-E419 PolarHBondContact O-N 2.92Å; S416-E419 WeakPolarHBondContact OG-CB 3.47Å; S416-E419 PolarHBondContact OG-N 2.69Å; S416-E419 PolarHBondContact OG-OE2 3.45Å; S416-E419 VanDerWaalsContact OG-OE2 3.13Å
417	P	92.5	Very high	90.5	Very high	74 Å²	74	59.6 Å²	59.6	48%	0.481	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-29.6	-177.2	-26.5	34.6	0	0	0	114	A378	A378-P417 HydrophobicContact CB-CB 4.13Å; A378-P417 VanDerWaalsContact CB-O 3.3Å; A378-P417 WeakPolarHBondContact CB-O 3.49Å; A378-P417 PolarHBondContact N-O 3.37Å
418	Q	94.3	Very high	90.6	Very high	146 Å²	146	59.7 Å²	59.7	68%	0.682	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-3.2	179.8	-59.7	75.7	19.6	0	0	113.4	S416 K420	S416-Q418 PolarHBondContact O-N 3.25Å; S416-Q418 VanDerWaalsContact O-N 3.09Å; Q418-K420 PolarHBondContact O-N 3.05Å
419	E	94.4	Very high	90.7	Very high	48 Å²	48	57.4 Å²	57.4	22%	0.224	28%	0.284	C	S	.	.			trans	-62.7	127.3	-178.1	-155.9	142.4	172.6	0	0	110.6	T376 A377 S416 M421	T376-E419 CarbonylContact C-O 2.88Å; T376-E419 VanDerWaalsContact CA-O 3.24Å; T376-E419 WeakPolarHBondContact CA-O 3.42Å; A377-E419 HydrophobicContact CB-CB 4.48Å; A377-E419 PolarHBondContact N-O 2.93Å; S416-E419 PolarHBondContact N-OE2 2.88Å; S416-E419 WeakPolarHBondContact O-CB 3.49Å; S416-E419 PolarHBondContact O-N 2.92Å; S416-E419 WeakPolarHBondContact OG-CB 3.47Å; S416-E419 PolarHBondContact OG-N 2.69Å; S416-E419 PolarHBondContact OG-OE2 3.45Å; S416-E419 VanDerWaalsContact OG-OE2 3.13Å; E419-M421 PolarHBondContact O-N 2.66Å
420	K	93.9	Very high	90.9	Very high	108 Å²	108	58.9 Å²	58.9	47%	0.47	29%	0.289	S	S	.	.	B	Isolated β-bridge	trans	-75.6	122.6	176.3	-74	-172.7	172.7	-169.4	0	109.9	Q418 V422 D423 K424	Q418-K420 PolarHBondContact O-N 3.05Å; K420-V422 PolarHBondContact O-N 3.48Å; K420-D423 HydrophobicContact CB-CB 4.11Å; K420-D423 WeakPolarHBondContact CB-OD2 3.36Å; K420-D423 VanDerWaalsContact CD-OD2 3.32Å; K420-D423 WeakPolarHBondContact CD-OD2 3.21Å; K420-D423 PolarHBondContact O-N 3.22Å; K420-K424 PolarHBondContact O-N 3.2Å; K420-K424 VanDerWaalsContact O-N 3.15Å
421	M	92.3	Very high	91	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-70.1	-34.4	-175	-66.7	-56.3	-55.8	0	0	112.3	I355 V371 S375 A377 V380 L400 L415 E419 K424 L425 F441	I355-M421 HydrophobicContact CD1-CE 3.99Å; V371-M421 HydrophobicContact CG1-CB 3.5Å; V371-M421 VanDerWaalsContact CG1-CB 3.5Å; S375-M421 PolarHBondContact O-N 3.41Å; A377-M421 HydrophobicContact CB-SD 4.05Å; V380-M421 HydrophobicContact CG2-CG 3.88Å; L400-M421 HydrophobicContact CD2-CE 3.98Å; L400-M421 HydrophobicContact CD2-SD 3.89Å; L415-M421 HydrophobicContact CD1-CE 4.05Å; L415-M421 HydrophobicContact CD1-SD 3.9Å; E419-M421 PolarHBondContact O-N 2.66Å; M421-K424 PolarHBondContact O-N 2.91Å; M421-L425 VanDerWaalsContact O-CG 3.26Å; M421-L425 WeakPolarHBondContact O-CG 3.32Å; M421-L425 PolarHBondContact O-N 2.82Å; M421-F441 HydrophobicContact CE-CD1 4.11Å; M421-F441 HydrophobicContact CE-CE1 3.79Å; M421-F441 HydrophobicContact CE-CZ 4.12Å
422	V	90.1	Very high	91.3	Very high	26 Å²	26	55.8 Å²	55.8	16%	0.158	28%	0.275	C	S	.	.	H	α-helix	trans	-62.7	-47.1	175.7	175.6	0	0	0	0	111.2	V371 S372 K420 K424 L425 Q426	V371-V422 HydrophobicContact CG1-CG2 3.83Å; S372-V422 VanDerWaalsContact O-CG2 3.24Å; S372-V422 WeakPolarHBondContact O-CG2 3.4Å; K420-V422 PolarHBondContact O-N 3.48Å; V422-K424 VanDerWaalsContact C-N 3.26Å; V422-K424 PolarHBondContact O-N 2.73Å; V422-L425 PolarHBondContact O-N 2.74Å; V422-Q426 HydrophobicContact CG1-CG 4.38Å; V422-Q426 WeakPolarHBondContact O-CB 3.44Å; V422-Q426 VanDerWaalsContact O-CG 3.3Å; V422-Q426 WeakPolarHBondContact O-CG 3.26Å; V422-Q426 PolarHBondContact O-N 3.16Å
423	D	91.1	Very high	91.5	Very high	88 Å²	88	51.9 Å²	51.9	47%	0.471	26%	0.26	S	S	.	.	H	α-helix	trans	-59.3	-42.4	177.8	-63.8	-15.3	0	0	0	110.4	K420 Q426 E427	K420-D423 HydrophobicContact CB-CB 4.11Å; K420-D423 WeakPolarHBondContact CB-OD2 3.36Å; K420-D423 VanDerWaalsContact CD-OD2 3.32Å; K420-D423 WeakPolarHBondContact CD-OD2 3.21Å; K420-D423 PolarHBondContact O-N 3.22Å; D423-Q426 PolarHBondContact O-N 2.76Å; D423-E427 WeakPolarHBondContact O-CB 3.42Å; D423-E427 PolarHBondContact O-N 3.23Å
424	K	91.3	Very high	91.5	Very high	12 Å²	12	48.7 Å²	48.7	5%	0.052	24%	0.244	C	C	.	.	H	α-helix	trans	-64	-45	178	-170	63.3	-174.9	172.2	0	113	E402 L415 K420 M421 V422 Q426 E427 I428	E402-K424 WeakPolarHBondContact OE2-CE 3.42Å; E402-K424 IonicContact OE2-NZ 2.65Å; E402-K424 PolarHBondContact OE2-NZ 2.68Å; L415-K424 HydrophobicContact CD2-CD 4.47Å; K420-K424 PolarHBondContact O-N 3.2Å; K420-K424 VanDerWaalsContact O-N 3.15Å; M421-K424 PolarHBondContact O-N 2.91Å; V422-K424 VanDerWaalsContact C-N 3.26Å; V422-K424 PolarHBondContact O-N 2.73Å; K424-Q426 VanDerWaalsContact C-N 3.32Å; K424-Q426 PolarHBondContact O-N 3.16Å; K424-E427 WeakPolarHBondContact CD-OE2 3.37Å; K424-E427 IonicContact NZ-OE2 3.91Å; K424-E427 PolarHBondContact NZ-OE2 3.11Å; K424-E427 WeakPolarHBondContact O-CB 3.36Å; K424-E427 PolarHBondContact O-N 3.15Å; K424-I428 HydrophobicContact CG-CD1 4.22Å; K424-I428 WeakPolarHBondContact O-CD1 3.33Å; K424-I428 VanDerWaalsContact O-CG1 3.31Å; K424-I428 WeakPolarHBondContact O-CG1 3.49Å; K424-I428 PolarHBondContact O-N 3.49Å
425	L	90.1	Very high	91.4	Very high	18 Å²	18	47.9 Å²	47.9	9%	0.094	24%	0.236	C	C	.	.	H	α-helix	trans	-64.4	-38.3	176.6	-69.2	171.5	0	0	0	111.7	D353 I355 V371 M421 V422 R429 F441	D353-L425 HydrophobicContact CB-CD1 4.06Å; I355-L425 HydrophobicContact CG2-CD1 3.71Å; I355-L425 HydrophobicContact CG2-CD2 3.94Å; I355-L425 HydrophobicContact CG2-CG 4.38Å; V371-L425 HydrophobicContact CG1-CD1 4.44Å; M421-L425 VanDerWaalsContact O-CG 3.26Å; M421-L425 WeakPolarHBondContact O-CG 3.32Å; M421-L425 PolarHBondContact O-N 2.82Å; V422-L425 PolarHBondContact O-N 2.74Å; L425-R429 WeakPolarHBondContact O-CB 3.48Å; L425-R429 VanDerWaalsContact O-CG 3.26Å; L425-R429 WeakPolarHBondContact O-CG 3.48Å; L425-R429 PolarHBondContact O-N 3.42Å; L425-F441 HydrophobicContact CD2-CE2 3.87Å; L425-F441 HydrophobicContact CD2-CZ 4.01Å
426	Q	89	Confident	91.2	Very high	55 Å²	55	50.3 Å²	50.3	26%	0.257	25%	0.248	S	C	.	.	H	α-helix	trans	-66.2	-40.8	174.8	-72	-178.8	14.7	0	0	112	L349 V422 D423 K424 R429 K430	L349-Q426 HydrophobicContact CD2-CG 4.16Å; L349-Q426 VanDerWaalsContact CD2-NE2 3.34Å; V422-Q426 HydrophobicContact CG1-CG 4.38Å; V422-Q426 WeakPolarHBondContact O-CB 3.44Å; V422-Q426 VanDerWaalsContact O-CG 3.3Å; V422-Q426 WeakPolarHBondContact O-CG 3.26Å; V422-Q426 PolarHBondContact O-N 3.16Å; D423-Q426 PolarHBondContact O-N 2.76Å; K424-Q426 VanDerWaalsContact C-N 3.32Å; K424-Q426 PolarHBondContact O-N 3.16Å; Q426-R429 PolarHBondContact O-N 2.6Å; Q426-K430 WeakPolarHBondContact O-CB 3.4Å; Q426-K430 VanDerWaalsContact O-CG 3.31Å; Q426-K430 WeakPolarHBondContact O-CG 3.3Å; Q426-K430 PolarHBondContact O-N 2.91Å
427	E	90.9	Very high	90.9	Very high	89 Å²	89	49 Å²	49	42%	0.416	24%	0.237	S	C	.	.	H	α-helix	trans	-56.2	-53.9	174	-172.8	-164.3	178.8	0	0	110.3	D423 K424 R429 K430 L431	D423-E427 WeakPolarHBondContact O-CB 3.42Å; D423-E427 PolarHBondContact O-N 3.23Å; K424-E427 WeakPolarHBondContact CD-OE2 3.37Å; K424-E427 IonicContact NZ-OE2 3.91Å; K424-E427 PolarHBondContact NZ-OE2 3.11Å; K424-E427 WeakPolarHBondContact O-CB 3.36Å; K424-E427 PolarHBondContact O-N 3.15Å; E427-R429 VanDerWaalsContact C-N 3.33Å; E427-R429 PolarHBondContact O-N 2.92Å; E427-K430 PolarHBondContact O-N 2.69Å; E427-L431 HydrophobicContact CG-CD1 3.99Å; E427-L431 WeakPolarHBondContact O-CB 3.32Å; E427-L431 VanDerWaalsContact O-CG 3.3Å; E427-L431 WeakPolarHBondContact O-CG 3.31Å; E427-L431 PolarHBondContact O-N 2.8Å
428	I	90.1	Very high	90.8	Very high	8 Å²	8	45.8 Å²	45.8	4%	0.041	22%	0.215	C	C	.	.	H	α-helix	trans	-59.6	-43.3	-179.6	-63.2	160.4	0	0	0	111.2	E402 K424 K430 L431 S432 M436 T439 F441	E402-I428 WeakPolarHBondContact OE1-CD1 3.35Å; K424-I428 HydrophobicContact CG-CD1 4.22Å; K424-I428 WeakPolarHBondContact O-CD1 3.33Å; K424-I428 VanDerWaalsContact O-CG1 3.31Å; K424-I428 WeakPolarHBondContact O-CG1 3.49Å; K424-I428 PolarHBondContact O-N 3.49Å; I428-K430 PolarHBondContact O-N 2.89Å; I428-L431 PolarHBondContact O-N 2.96Å; I428-S432 PolarHBondContact O-N 2.83Å; I428-S432 VanDerWaalsContact O-N 3.14Å; I428-M436 HydrophobicContact CG2-CB 3.85Å; I428-M436 HydrophobicContact CG2-CG 4.3Å; I428-T439 HydrophobicContact CD1-CG2 4.09Å; I428-F441 HydrophobicContact CD1-CZ 4.21Å
429	R	89.6	Confident	90.7	Very high	39 Å²	39	39.4 Å²	39.4	15%	0.147	19%	0.186	C	C	.	.	H	α-helix	trans	-62.2	-40.3	177.9	-80.9	169.5	-179.3	165.1	2.1	113.3	D353 L425 Q426 E427 M436	D353-R429 IonicContact OD1-CZ 3.59Å; D353-R429 IonicContact OD1-NH1 3.25Å; D353-R429 IonicContact OD1-NH2 3.61Å; D353-R429 PolarHBondContact OD1-NH2 3.02Å; D353-R429 IonicContact OD2-CZ 2.81Å; D353-R429 IonicContact OD2-NH1 3.82Å; D353-R429 PolarHBondContact OD2-NH1 2.89Å; D353-R429 IonicContact OD2-NH2 3.64Å; D353-R429 PolarHBondContact OD2-NH2 3.21Å; L425-R429 WeakPolarHBondContact O-CB 3.48Å; L425-R429 VanDerWaalsContact O-CG 3.26Å; L425-R429 WeakPolarHBondContact O-CG 3.48Å; L425-R429 PolarHBondContact O-N 3.42Å; Q426-R429 PolarHBondContact O-N 2.6Å; E427-R429 VanDerWaalsContact C-N 3.33Å; E427-R429 PolarHBondContact O-N 2.92Å; R429-M436 HydrophobicContact CG-CG 4.34Å; R429-M436 HydrophobicContact CG-SD 3.39Å; R429-M436 WeakPolarHBondContact CG-SD 3.41Å
430	K	89.6	Confident	90.5	Very high	115 Å²	115	38.6 Å²	38.6	50%	0.5	18%	0.181	S	C	.	.	H	α-helix	trans	-71	-40.8	178.9	-74.7	176	-178.2	176.3	0	111	D280 R346 Q426 E427 I428	D280-K430 PolarHBondContact N-O 2.62Å; R346-K430 PolarHBondContact NH1-O 2.84Å; R346-K430 VanDerWaalsContact NH1-O 3.08Å; Q426-K430 WeakPolarHBondContact O-CB 3.4Å; Q426-K430 VanDerWaalsContact O-CG 3.31Å; Q426-K430 WeakPolarHBondContact O-CG 3.3Å; Q426-K430 PolarHBondContact O-N 2.91Å; E427-K430 PolarHBondContact O-N 2.69Å; I428-K430 PolarHBondContact O-N 2.89Å
431	L	91	Very high	90.5	Very high	47 Å²	47	34 Å²	34	25%	0.246	16%	0.161	C	C	.	.	H	α-helix	trans	-62.7	-55.9	-179.8	-74.3	171.7	0	0	0	112.4	G279 D280 D281 E427 I428	G279-L431 CarbonylContact C-O 3.57Å; G279-L431 WeakPolarHBondContact CA-O 3.45Å; D280-L431 PolarHBondContact N-O 2.87Å; D280-L431 VanDerWaalsContact N-O 3.15Å; D281-L431 WeakPolarHBondContact CB-O 3.36Å; D281-L431 PolarHBondContact N-O 2.9Å; D281-L431 VanDerWaalsContact N-O 3.08Å; E427-L431 HydrophobicContact CG-CD1 3.99Å; E427-L431 WeakPolarHBondContact O-CB 3.32Å; E427-L431 VanDerWaalsContact O-CG 3.3Å; E427-L431 WeakPolarHBondContact O-CG 3.31Å; E427-L431 PolarHBondContact O-N 2.8Å; I428-L431 PolarHBondContact O-N 2.96Å
432	S	91.8	Very high	90.4	Very high	1 Å²	1	35 Å²	35	1%	0.007	17%	0.165	C	C	.	.			trans	-167.4	126.9	178.8	162	0	0	0	0	111.5	D278 I428 R434 Q435 M436	D278-S432 WeakPolarHBondContact O-CA 3.22Å; D278-S432 PolarHBondContact OD2-OG 2.96Å; I428-S432 PolarHBondContact O-N 2.83Å; I428-S432 VanDerWaalsContact O-N 3.14Å; S432-R434 PolarHBondContact O-N 2.83Å; S432-R434 WeakPolarHBondContact OG-CB 3.5Å; S432-R434 PolarHBondContact OG-N 3.23Å; S432-Q435 WeakPolarHBondContact O-CB 3.23Å; S432-Q435 PolarHBondContact O-N 3.04Å; S432-Q435 VanDerWaalsContact O-N 3.17Å; S432-Q435 PolarHBondContact OG-N 2.76Å; S432-M436 PolarHBondContact O-N 3.23Å
433	L	91.5	Very high	90.4	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-65.4	-29.2	173.3	-64.4	178.9	0	0	0	112.4	D278 L311 F318 L345 A347 M436 N437	D278-L433 WeakPolarHBondContact O-CG 3.39Å; D278-L433 PolarHBondContact O-N 3.4Å; L311-L433 HydrophobicContact CD1-CB 3.73Å; L311-L433 HydrophobicContact CD1-CD1 4.29Å; L311-L433 HydrophobicContact CD2-CB 4.37Å; L311-L433 WeakPolarHBondContact CD2-O 3.44Å; F318-L433 HydrophobicContact CD1-CD1 3.92Å; F318-L433 HydrophobicContact CE1-CD1 3.99Å; F318-L433 HydrophobicContact CE1-CD2 4.43Å; L345-L433 HydrophobicContact CB-CD1 4.03Å; L345-L433 HydrophobicContact CD2-CD1 3.72Å; L345-L433 HydrophobicContact CG-CD1 3.55Å; L345-L433 WeakPolarHBondContact O-CD1 3.3Å; A347-L433 HydrophobicContact CB-CD2 3.72Å; L433-M436 HydrophobicContact CD2-CE 4.12Å; L433-M436 HydrophobicContact CD2-SD 4.49Å; L433-M436 WeakPolarHBondContact O-CB 3.33Å; L433-N437 PolarHBondContact O-N 3.01Å; L433-N437 VanDerWaalsContact O-N 3.12Å
434	R	89.1	Confident	90.3	Very high	32 Å²	32	29.8 Å²	29.8	12%	0.121	14%	0.136	C	C	.	.	H	α-helix	trans	-65.8	-46.3	171.1	-180	-169.6	64.2	-165.5	-5.5	111	F138 D278 L311 S432 M436 N437 Q438	F138-R434 HydrophobicContact CD1-CG 4.43Å; F138-R434 HydrophobicContact CE1-CG 4.44Å; D278-R434 WeakPolarHBondContact OD2-CB 3.41Å; D278-R434 PolarHBondContact OD2-N 2.91Å; L311-R434 HydrophobicContact CD2-CB 4.48Å; S432-R434 PolarHBondContact O-N 2.83Å; S432-R434 WeakPolarHBondContact OG-CB 3.5Å; S432-R434 PolarHBondContact OG-N 3.23Å; R434-M436 VanDerWaalsContact C-N 3.31Å; R434-M436 PolarHBondContact O-N 3.21Å; R434-N437 PolarHBondContact O-N 2.84Å; R434-Q438 WeakPolarHBondContact O-CG 3.31Å; R434-Q438 PolarHBondContact O-N 3.24Å; R434-Q438 VanDerWaalsContact O-N 3.16Å
435	Q	88.6	Confident	90	Very high	39 Å²	39	31.9 Å²	31.9	18%	0.182	15%	0.147	C	C	.	.	H	α-helix	trans	-59.1	-45.7	175.3	-71.8	-178.6	-17.9	0	0	110.5	Y404 S432 N437 Q438 T439	Y404-Q435 HydrophobicContact CD2-CB 4.46Å; Y404-Q435 HydrophobicContact CD2-CG 4.46Å; Y404-Q435 HydrophobicContact CE2-CB 4.05Å; Y404-Q435 HydrophobicContact CE2-CG 3.72Å; S432-Q435 WeakPolarHBondContact O-CB 3.23Å; S432-Q435 PolarHBondContact O-N 3.04Å; S432-Q435 VanDerWaalsContact O-N 3.17Å; S432-Q435 PolarHBondContact OG-N 2.76Å; Q435-N437 VanDerWaalsContact C-N 3.3Å; Q435-N437 PolarHBondContact O-N 2.92Å; Q435-Q438 CarbonylContact O-C 3.23Å; Q435-Q438 WeakPolarHBondContact O-CA 3.33Å; Q435-Q438 PolarHBondContact O-N 3.06Å; Q435-T439 PolarHBondContact O-N 3.06Å; Q435-T439 PolarHBondContact O-OG1 2.78Å
436	M	89.2	Confident	89.6	Confident	58 Å²	58	34.3 Å²	34.3	29%	0.286	16%	0.159	S	C	.	.	H	α-helix	trans	-51.3	-47.1	174.3	-174.2	-168.8	65.3	0	0	112.5	I428 R429 S432 L433 R434 Q438 T439	I428-M436 HydrophobicContact CG2-CB 3.85Å; I428-M436 HydrophobicContact CG2-CG 4.3Å; R429-M436 HydrophobicContact CG-CG 4.34Å; R429-M436 HydrophobicContact CG-SD 3.39Å; R429-M436 WeakPolarHBondContact CG-SD 3.41Å; S432-M436 PolarHBondContact O-N 3.23Å; L433-M436 HydrophobicContact CD2-CE 4.12Å; L433-M436 HydrophobicContact CD2-SD 4.49Å; L433-M436 WeakPolarHBondContact O-CB 3.33Å; R434-M436 VanDerWaalsContact C-N 3.31Å; R434-M436 PolarHBondContact O-N 3.21Å; M436-Q438 PolarHBondContact O-N 2.9Å; M436-T439 PolarHBondContact O-N 3.08Å
437	N	89	Confident	88.5	Confident	25 Å²	25	35.9 Å²	35.9	13%	0.134	17%	0.167	C	C	.	.	H	α-helix	trans	-64.6	-28	178.2	-168	29.8	0	0	0	112.9	C85 P88 L311 P312 L433 R434 Q435 R440	C85-N437 PolarHBondContact O-ND2 3.05Å; C85-N437 VanDerWaalsContact O-ND2 3.11Å; P88-N437 WeakPolarHBondContact CB-O 3.37Å; L311-N437 HydrophobicContact CD2-CB 4.32Å; P312-N437 WeakPolarHBondContact CD-ND2 3.4Å; L433-N437 PolarHBondContact O-N 3.01Å; L433-N437 VanDerWaalsContact O-N 3.12Å; R434-N437 PolarHBondContact O-N 2.84Å; Q435-N437 VanDerWaalsContact C-N 3.3Å; Q435-N437 PolarHBondContact O-N 2.92Å; N437-R440 PolarHBondContact O-NH1 2.98Å; N437-R440 PolarHBondContact O-NH2 3.41Å; N437-R440 VanDerWaalsContact O-NH2 3.1Å
438	Q	89.9	Confident	86.9	Confident	7 Å²	7	39.3 Å²	39.3	3%	0.033	19%	0.188	C	C	.	.	H	α-helix	trans	-94.1	-3.7	-179.4	-68.7	176.8	-17.8	0	0	114.2	A137 Y404 M405 R434 Q435 M436	A137-Q438 PolarHBondContact O-NE2 3.25Å; Y404-Q438 HydrophobicContact CD2-CB 4.11Å; Y404-Q438 HydrophobicContact CE2-CB 3.89Å; M405-Q438 VanDerWaalsContact CB-O 3.3Å; M405-Q438 WeakPolarHBondContact CB-O 3.41Å; M405-Q438 WeakPolarHBondContact CE-O 3.43Å; M405-Q438 WeakPolarHBondContact CG-O 3.33Å; M405-Q438 PolarHBondContact N-O 3.43Å; R434-Q438 WeakPolarHBondContact O-CG 3.31Å; R434-Q438 PolarHBondContact O-N 3.24Å; R434-Q438 VanDerWaalsContact O-N 3.16Å; Q435-Q438 CarbonylContact O-C 3.23Å; Q435-Q438 WeakPolarHBondContact O-CA 3.33Å; Q435-Q438 PolarHBondContact O-N 3.06Å; M436-Q438 PolarHBondContact O-N 2.9Å
439	T	91.5	Very high	85.5	Confident	11 Å²	11	41.4 Å²	41.4	7%	0.067	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	137.2	178.2	-63.3	0	0	0	0	111.6	E402 V403 I428 Q435 M436	E402-T439 HydrophobicContact CG-CG2 3.6Å; V403-T439 WeakPolarHBondContact O-CA 3.31Å; I428-T439 HydrophobicContact CD1-CG2 4.09Å; Q435-T439 PolarHBondContact O-N 3.06Å; Q435-T439 PolarHBondContact O-OG1 2.78Å; M436-T439 PolarHBondContact O-N 3.08Å
440	R	91.2	Very high	84.5	Confident	32 Å²	32	43.3 Å²	43.3	12%	0.121	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	153.3	175.2	-66.9	-66.5	173.1	-88.8	-9.3	110.4	P88 S89 V403 M405 N437 Y442	P88-R440 PolarHBondContact O-NH2 3.36Å; S89-R440 VanDerWaalsContact CA-NH2 3.29Å; V403-R440 PolarHBondContact N-O 2.97Å; V403-R440 PolarHBondContact O-N 3Å; M405-R440 HydrophobicContact CE-CG 3.42Å; M405-R440 VanDerWaalsContact CE-CG 3.42Å; M405-R440 HydrophobicContact SD-CB 4.39Å; M405-R440 HydrophobicContact SD-CG 3.71Å; N437-R440 PolarHBondContact O-NH1 2.98Å; N437-R440 PolarHBondContact O-NH2 3.41Å; N437-R440 VanDerWaalsContact O-NH2 3.1Å; R440-Y442 HydrophobicContact CB-CD2 4.18Å; R440-Y442 HydrophobicContact CB-CE2 3.55Å; R440-Y442 HydrophobicContact CG-CE2 4.49Å
441	F	92.7	Very high	84.2	Confident	12 Å²	12	39.4 Å²	39.4	5%	0.053	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	134.9	172.4	-62.4	-81.2	0	0	0	109.6	I355 V357 H358 L400 Q401 E402 L415 M421 L425 I428	I355-F441 HydrophobicContact CB-CD2 4.37Å; I355-F441 HydrophobicContact CG2-CE2 4.39Å; V357-F441 WeakPolarHBondContact CA-O 3.18Å; V357-F441 HydrophobicContact CG2-CB 4.22Å; H358-F441 PolarHBondContact N-O 3.48Å; L400-F441 HydrophobicContact CD1-CB 4.31Å; Q401-F441 CarbonylContact O-C 3.58Å; Q401-F441 VanDerWaalsContact O-CA 3.29Å; Q401-F441 WeakPolarHBondContact O-CA 3.2Å; E402-F441 HydrophobicContact CB-CD1 4.47Å; E402-F441 HydrophobicContact CB-CE1 4.21Å; E402-F441 HydrophobicContact CG-CE1 4.33Å; L415-F441 HydrophobicContact CD1-CD1 4.15Å; L415-F441 HydrophobicContact CD1-CE1 4.02Å; M421-F441 HydrophobicContact CE-CD1 4.11Å; M421-F441 HydrophobicContact CE-CE1 3.79Å; M421-F441 HydrophobicContact CE-CZ 4.12Å; L425-F441 HydrophobicContact CD2-CE2 3.87Å; L425-F441 HydrophobicContact CD2-CZ 4.01Å; I428-F441 HydrophobicContact CD1-CZ 4.21Å
442	Y	91.1	Very high	84.1	Confident	20 Å²	20	41.7 Å²	41.7	8%	0.078	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	136.6	177.3	-71.8	-102.1	0	0	0	110.2	Q92 P94 H358 Q401 V403 R440	Q92-Y442 PolarHBondContact O-OH 2.87Å; P94-Y442 WeakPolarHBondContact CD-OH 3.41Å; H358-Y442 HydrophobicContact CB-CD1 3.45Å; H358-Y442 VanDerWaalsContact CB-CD1 3.45Å; H358-Y442 HydrophobicContact CB-CE1 3.43Å; H358-Y442 VanDerWaalsContact CB-CE1 3.43Å; H358-Y442 HydrophobicContact CB-CG 4.06Å; H358-Y442 CarbonylContact O-C 3.57Å; H358-Y442 WeakPolarHBondContact O-CA 3.34Å; Q401-Y442 PolarHBondContact N-O 3.37Å; Q401-Y442 PolarHBondContact O-N 3.11Å; V403-Y442 HydrophobicContact CB-CD2 3.82Å; V403-Y442 HydrophobicContact CB-CE2 3.82Å; V403-Y442 HydrophobicContact CG1-CE2 4.23Å; V403-Y442 HydrophobicContact CG2-CD2 3.36Å; V403-Y442 HydrophobicContact CG2-CE2 3.83Å; V403-Y442 HydrophobicContact CG2-CG 4.23Å; R440-Y442 HydrophobicContact CB-CD2 4.18Å; R440-Y442 HydrophobicContact CB-CE2 3.55Å; R440-Y442 HydrophobicContact CG-CE2 4.49Å
443	I	90.7	Very high	84.1	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	123.4	159.9	-174.9	167.4	0	0	0	107.8	V357 H358 A359 A360 W361 L381 V384 L385 L388 F398	V357-I443 HydrophobicContact CG1-CB 4.1Å; V357-I443 HydrophobicContact CG1-CG2 4.28Å; H358-I443 PolarHBondContact O-N 3.35Å; A359-I443 HydrophobicContact CB-CG2 4.21Å; A360-I443 WeakPolarHBondContact CB-O 3.32Å; A360-I443 PolarHBondContact N-O 2.97Å; W361-I443 HydrophobicContact CH2-CD1 4.35Å; W361-I443 HydrophobicContact CH2-CG1 4.16Å; W361-I443 HydrophobicContact CH2-CG2 3.73Å; W361-I443 HydrophobicContact CZ2-CG2 4.5Å; W361-I443 HydrophobicContact CZ3-CG1 4.35Å; W361-I443 HydrophobicContact CZ3-CG2 4.13Å; L381-I443 HydrophobicContact CD1-CD1 3.78Å; L381-I443 HydrophobicContact CD1-CG1 3.86Å; L381-I443 HydrophobicContact CG-CD1 4.34Å; V384-I443 HydrophobicContact CG1-CB 4.24Å; V384-I443 HydrophobicContact CG1-CD1 3.99Å; V384-I443 HydrophobicContact CG1-CG2 3.89Å; L385-I443 HydrophobicContact CD2-CD1 3.61Å; L385-I443 HydrophobicContact CG-CD1 3.79Å; L388-I443 HydrophobicContact CD1-CG2 4.13Å; F398-I443 HydrophobicContact CB-CD1 4.26Å; F398-I443 HydrophobicContact CB-CG1 4.21Å; F398-I443 HydrophobicContact CD1-CD1 4.19Å; F398-I443 HydrophobicContact CD1-CG1 4.09Å; F398-I443 HydrophobicContact CG-CD1 4.34Å; F398-I443 HydrophobicContact CG-CG1 4.48Å
444	V	87.6	Confident	84.3	Confident	4 Å²	4	42 Å²	42	2%	0.024	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	144.5	176.1	-65	0	0	0	0	109	A360 F398 S399 Q401	A360-V444 HydrophobicContact CB-CB 4.43Å; A360-V444 HydrophobicContact CB-CG1 3.7Å; F398-V444 CarbonylContact C-O 3.56Å; F398-V444 WeakPolarHBondContact CA-O 3.25Å; F398-V444 WeakPolarHBondContact CB-O 3.39Å; F398-V444 WeakPolarHBondContact CD1-O 3.43Å; S399-V444 PolarHBondContact N-O 3.22Å; S399-V444 VanDerWaalsContact O-CG2 3.3Å; S399-V444 WeakPolarHBondContact O-CG2 3.46Å; S399-V444 PolarHBondContact O-N 3.49Å; Q401-V444 HydrophobicContact CB-CG1 4.48Å; Q401-V444 HydrophobicContact CG-CG1 4.17Å; Q401-V444 HydrophobicContact CG-CG2 3.8Å
445	Q	85.9	Confident	84.7	Confident	57 Å²	57	40.5 Å²	40.5	27%	0.266	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	131.2	166	-165.5	175.5	10.1	0	0	108	S397 F398 Q447	S397-Q445 CarbonylContact O-C 3.59Å; S397-Q445 WeakPolarHBondContact O-CA 3.21Å; S397-Q445 WeakPolarHBondContact O-CG 3.36Å; F398-Q445 HydrophobicContact CD1-CB 4.02Å; F398-Q445 HydrophobicContact CD1-CG 4.23Å; F398-Q445 HydrophobicContact CE1-CB 3.82Å; F398-Q445 HydrophobicContact CE1-CG 3.83Å; F398-Q445 HydrophobicContact CZ-CG 4.23Å; Q445-Q447 HydrophobicContact CB-CG 4.09Å; Q445-Q447 HydrophobicContact CG-CG 3.86Å; Q445-Q447 PolarHBondContact O-N 3.21Å
446	N	81.6	Confident	85.1	Confident	68 Å²	68	38.7 Å²	38.7	36%	0.364	21%	0.211	S	C	.	.			trans	-71.1	59.7	168.9	-59.4	-21.4	0	0	0	108.6	S396 S397 F398 S399 N448	S396-N446 PolarHBondContact O-ND2 2.85Å; S397-N446 WeakPolarHBondContact O-CA 3.5Å; S397-N446 WeakPolarHBondContact O-CB 3.43Å; S397-N446 PolarHBondContact O-N 3.47Å; F398-N446 PolarHBondContact N-ND2 3.29Å; F398-N446 PolarHBondContact O-ND2 3.19Å; S399-N446 WeakPolarHBondContact CB-OD1 3.41Å; S399-N446 PolarHBondContact N-OD1 2.9Å; S399-N446 VanDerWaalsContact OG-CG 3.25Å; S399-N446 PolarHBondContact OG-ND2 3.25Å; S399-N446 VanDerWaalsContact OG-ND2 3.09Å; S399-N446 PolarHBondContact OG-OD1 3.16Å; N446-N448 PolarHBondContact O-N 2.94Å
447	Q	66.9	Low	85.5	Confident	88 Å²	88	35.9 Å²	35.9	41%	0.411	20%	0.197	S	C	.	.			trans	-69	132.5	162.8	-60.7	-175.1	9.5	0	0	105.4	Q445 P449	Q445-Q447 HydrophobicContact CB-CG 4.09Å; Q445-Q447 HydrophobicContact CG-CG 3.86Å; Q445-Q447 PolarHBondContact O-N 3.21Å; Q447-P449 WeakPolarHBondContact O-CD 3.48Å
448	N	55.7	Low	85.8	Confident	162 Å²	162	35.3 Å²	35.3	87%	0.866	20%	0.195	S	C	*	.			trans	-102.6	59.2	171.3	-149.7	9.1	0	0	0	108.4	N446 A450	N446-N448 PolarHBondContact O-N 2.94Å; N448-A450 PolarHBondContact O-N 3.16Å
449	P	61.1	Low	85.9	Confident	51 Å²	51	35.2 Å²	35.2	33%	0.331	20%	0.196	S	C	.	.	P	Polyproline II helix	trans	-62.9	137.1	169.6	31.3	-31	0	0	0	106	Q150 Q447 V451	Q150-P449 HydrophobicContact CG-CG 4.48Å; Q447-P449 WeakPolarHBondContact O-CD 3.48Å; P449-V451 PolarHBondContact O-N 2.85Å
450	A	69.7	Low	86.1	Confident	80 Å²	80	34.9 Å²	34.9	66%	0.661	19%	0.194	S	C	*	.	P	Polyproline II helix	trans	-48.8	119.5	173.6	0	0	0	0	0	108.2	N448 Q452	N448-A450 PolarHBondContact O-N 3.16Å; A450-Q452 PolarHBondContact O-N 3.08Å
451	V	82.6	Confident	86.3	Confident	32 Å²	32	34.8 Å²	34.8	19%	0.194	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-55.8	137.6	170.6	171.5	0	0	0	0	106.1	P449 V453 S501 F503	P449-V451 PolarHBondContact O-N 2.85Å; V451-V453 HydrophobicContact CG1-CG2 4.39Å; V451-S501 WeakPolarHBondContact CB-O 3.48Å; V451-S501 WeakPolarHBondContact O-CA 3.47Å; V451-S501 WeakPolarHBondContact O-CB 3.48Å; V451-F503 HydrophobicContact CB-CE2 4.37Å; V451-F503 HydrophobicContact CG1-CD1 4.18Å; V451-F503 HydrophobicContact CG1-CD2 3.96Å; V451-F503 HydrophobicContact CG1-CE1 4.05Å; V451-F503 HydrophobicContact CG1-CE2 3.83Å; V451-F503 HydrophobicContact CG1-CG 4.13Å; V451-F503 HydrophobicContact CG1-CZ 3.87Å; V451-F503 HydrophobicContact CG2-CD2 4.04Å; V451-F503 HydrophobicContact CG2-CE2 3.58Å; V451-F503 HydrophobicContact CG2-CZ 4.17Å
452	Q	88.4	Confident	86.3	Confident	95 Å²	95	37.9 Å²	37.9	44%	0.444	22%	0.218	S	C	.	.			trans	-153	96.9	-176.6	-172.9	168.4	3.8	0	0	108.3	Q226 A450 I500	Q226-Q452 PolarHBondContact OE1-O 3.34Å; A450-Q452 PolarHBondContact O-N 3.08Å; Q452-I500 WeakPolarHBondContact CA-O 3.38Å
453	V	93	Very high	86.4	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.012	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	121	173.6	-179	0	0	0	0	108.5	F230 V451 L455 I500 F503 A506	F230-V453 HydrophobicContact CE2-CG1 3.76Å; F230-V453 HydrophobicContact CE2-CG2 4.42Å; F230-V453 HydrophobicContact CZ-CG1 4.28Å; V451-V453 HydrophobicContact CG1-CG2 4.39Å; V453-L455 HydrophobicContact CG1-CD2 4.19Å; V453-L455 HydrophobicContact CG1-CG 4.4Å; V453-I500 HydrophobicContact CB-CB 4.47Å; V453-I500 PolarHBondContact N-O 2.98Å; V453-I500 PolarHBondContact O-N 3.49Å; V453-F503 HydrophobicContact CG2-CD1 3.91Å; V453-F503 HydrophobicContact CG2-CE1 3.95Å; V453-A506 HydrophobicContact CB-CB 3.83Å; V453-A506 HydrophobicContact CG1-CB 3.86Å; V453-A506 HydrophobicContact CG2-CB 4.04Å
454	G	95.1	Very high	86.6	Confident	7 Å²	7	45.6 Å²	45.6	7%	0.072	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	119.6	173.4	0	0	0	0	0	111.6	L498 I528	G454-L498 WeakPolarHBondContact CA-O 3.15Å; G454-I528 PolarHBondContact O-N 3.3Å
455	L	96.4	Very high	86.9	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	141	170.3	-63	-173.8	0	0	0	110.4	V453 A497 L498 I500 I509 Y510 L526 I527	V453-L455 HydrophobicContact CG1-CD2 4.19Å; V453-L455 HydrophobicContact CG1-CG 4.4Å; L455-A497 CarbonylContact O-C 3.56Å; L455-A497 WeakPolarHBondContact O-CA 3.16Å; L455-L498 HydrophobicContact CB-CB 4.43Å; L455-L498 PolarHBondContact N-O 3.12Å; L455-L498 PolarHBondContact O-N 3.34Å; L455-I500 HydrophobicContact CB-CD1 4.49Å; L455-I500 HydrophobicContact CD1-CD1 3.51Å; L455-I500 HydrophobicContact CG-CD1 3.91Å; L455-I509 HydrophobicContact CD1-CB 4.38Å; L455-I509 HydrophobicContact CD1-CG2 3.99Å; L455-Y510 HydrophobicContact CD2-CD2 4.25Å; L455-L526 CarbonylContact C-O 3.56Å; L455-L526 WeakPolarHBondContact CA-O 3.47Å; L455-I527 HydrophobicContact CD2-CB 4.43Å; L455-I527 HydrophobicContact CD2-CG1 3.84Å
456	L	97.4	Very high	87.4	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	113.9	167	-178.8	70.1	0	0	0	108.4	Y490 A495 A497 L526 I528 L581 A582	L456-Y490 HydrophobicContact CD1-CD2 4.46Å; L456-Y490 HydrophobicContact CD1-CE2 4.39Å; L456-A495 HydrophobicContact CD1-CB 4.4Å; L456-A497 HydrophobicContact CD1-CB 4.11Å; L456-L526 PolarHBondContact N-O 2.97Å; L456-L526 PolarHBondContact O-N 3.08Å; L456-I528 HydrophobicContact CB-CD1 4.1Å; L456-I528 HydrophobicContact CB-CG1 3.74Å; L456-L581 HydrophobicContact CD1-CD2 4.48Å; L456-L581 HydrophobicContact CD2-CD2 4.38Å; L456-L581 HydrophobicContact CD2-CG 4.2Å; L456-A582 HydrophobicContact CD2-CB 3.88Å
457	I	96.9	Very high	88	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	130.6	172.7	-53.7	-57.1	0	0	0	107.8	L460 L473 A495 V496 L498 I509 A513 L523 T524 S525	I457-L460 HydrophobicContact CG2-CD1 4.5Å; I457-L473 HydrophobicContact CB-CD2 4.49Å; I457-L473 HydrophobicContact CG2-CD2 3.98Å; I457-A495 CarbonylContact O-C 3.57Å; I457-A495 WeakPolarHBondContact O-CA 3.23Å; I457-A495 VanDerWaalsContact O-CB 3.28Å; I457-A495 WeakPolarHBondContact O-CB 3.4Å; I457-V496 PolarHBondContact N-O 3.28Å; I457-V496 PolarHBondContact O-N 3.43Å; I457-L498 HydrophobicContact CB-CD1 4.32Å; I457-L498 HydrophobicContact CG1-CD1 3.69Å; I457-L498 HydrophobicContact CG1-CD2 4.22Å; I457-I509 HydrophobicContact CD1-CG2 4.47Å; I457-A513 HydrophobicContact CD1-CB 3.94Å; I457-L523 HydrophobicContact CG2-CD1 4.22Å; I457-T524 CarbonylContact C-O 3.6Å; I457-T524 WeakPolarHBondContact CA-O 3.3Å; I457-S525 WeakPolarHBondContact CD1-OG 3.45Å
458	S	95.4	Very high	89.4	Confident	12 Å²	12	54.8 Å²	54.8	8%	0.084	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	164.6	-179	-59.6	0	0	0	0	110.1	A495 L523 T524	S458-A495 WeakPolarHBondContact OG-CB 3.14Å; S458-L523 CarbonylContact O-C 3.53Å; S458-L523 WeakPolarHBondContact O-CA 3.48Å; S458-T524 PolarHBondContact N-O 3.09Å; S458-T524 PolarHBondContact O-N 2.77Å
459	G	93.1	Very high	91.3	Very high	6 Å²	6	47 Å²	47	6%	0.062	26%	0.263	C	S	.	.			trans	93.6	9	-176	0	0	0	0	0	113.6	G494	G459-G494 PolarHBondContact N-O 3.37Å; G459-G494 VanDerWaalsContact N-O 3.16Å
460	L	95.1	Very high	92.8	Very high	3 Å²	3	46.3 Å²	46.3	2%	0.016	26%	0.258	C	S	.	.	S	Bend	trans	-71.9	160	169.5	-58.2	159.3	0	0	0	109.7	I457 Y469 L473 G494 V496 I518 L523	I457-L460 HydrophobicContact CG2-CD1 4.5Å; L460-Y469 HydrophobicContact CB-CD1 4.1Å; L460-Y469 HydrophobicContact CB-CE1 3.66Å; L460-Y469 HydrophobicContact CD1-CD1 3.79Å; L460-Y469 HydrophobicContact CD1-CE1 4.05Å; L460-Y469 HydrophobicContact CG-CD1 4.45Å; L460-Y469 HydrophobicContact CG-CE1 4.45Å; L460-L473 HydrophobicContact CD1-CD2 4.23Å; L460-L473 HydrophobicContact CD2-CD2 4.09Å; L460-G494 WeakPolarHBondContact CB-O 3.47Å; L460-G494 PolarHBondContact N-O 3.24Å; L460-G494 WeakPolarHBondContact O-CA 3.23Å; L460-V496 HydrophobicContact CD1-CB 4.49Å; L460-V496 HydrophobicContact CD1-CG2 3.81Å; L460-I518 HydrophobicContact CD2-CD1 3.93Å; L460-L523 HydrophobicContact CD2-CD1 4.47Å; L460-L523 HydrophobicContact CD2-CD2 3.83Å; L460-L523 HydrophobicContact CG-CD2 4.13Å
461	P	95.3	Very high	94	Very high	31 Å²	31	44 Å²	44	20%	0.201	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-58.4	134.8	170.8	-21	32.4	0	0	0	110.5	L464 Y469 L472 I518	P461-L464 HydrophobicContact CB-CD1 3.89Å; P461-L464 HydrophobicContact CB-CG 4.24Å; P461-L464 HydrophobicContact CG-CD1 4.19Å; P461-Y469 WeakPolarHBondContact O-CE1 3.36Å; P461-Y469 PolarHBondContact O-OH 3.34Å; P461-L472 HydrophobicContact CG-CD1 4.45Å; P461-I518 HydrophobicContact CG-CG2 4.12Å
462	P	93.7	Very high	94.5	Very high	76 Å²	76	44.2 Å²	44.2	49%	0.494	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	165.8	179	33.5	-35.8	0	0	0	111.4	L464 Y469 E491	P462-L464 PolarHBondContact O-N 2.87Å; P462-Y469 WeakPolarHBondContact CA-OH 3.34Å; P462-E491 CarbonylContact C-O 3.27Å; P462-E491 VanDerWaalsContact CA-O 3.23Å; P462-E491 WeakPolarHBondContact CA-O 3.22Å; P462-E491 WeakPolarHBondContact CB-O 3.49Å
463	L	92.9	Very high	94.8	Very high	142 Å²	142	39.7 Å²	39.7	74%	0.743	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.4	22.3	173.3	-53.2	175.2	0	0	0	115.2	E491	L463-E491 PolarHBondContact N-O 3.19Å
464	L	93.9	Very high	94.7	Very high	40 Å²	40	45 Å²	45	21%	0.209	25%	0.246	C	C	.	.			trans	-82.2	155.5	170.8	-58	-179.1	0	0	0	111.3	P461 P462 E468 Y469 L472 E491	P461-L464 HydrophobicContact CB-CD1 3.89Å; P461-L464 HydrophobicContact CB-CG 4.24Å; P461-L464 HydrophobicContact CG-CD1 4.19Å; P462-L464 PolarHBondContact O-N 2.87Å; L464-E468 HydrophobicContact CB-CB 4.03Å; L464-E468 HydrophobicContact CD1-CB 4.46Å; L464-Y469 HydrophobicContact CB-CD1 4.32Å; L464-Y469 HydrophobicContact CB-CD2 4.17Å; L464-Y469 HydrophobicContact CB-CE1 3.97Å; L464-Y469 HydrophobicContact CB-CE2 3.83Å; L464-Y469 HydrophobicContact CB-CG 4.4Å; L464-Y469 HydrophobicContact CD1-CD1 4.16Å; L464-Y469 HydrophobicContact CD1-CE1 3.89Å; L464-Y469 HydrophobicContact CG-CE1 4.24Å; L464-Y469 VanDerWaalsContact O-CE2 3.29Å; L464-Y469 WeakPolarHBondContact O-CE2 3.35Å; L464-L472 HydrophobicContact CD1-CD1 3.45Å; L464-L472 VanDerWaalsContact CD1-CD1 3.45Å; L464-E491 VanDerWaalsContact O-CG 3.3Å; L464-E491 WeakPolarHBondContact O-CG 3.33Å
465	T	95.5	Very high	94.6	Very high	70 Å²	70	51.4 Å²	51.4	43%	0.429	27%	0.274	S	S	.	.			trans	-67.8	164.6	169.4	63.3	0	0	0	0	111.2	E467 E468 Y469	T465-E467 VanDerWaalsContact C-N 3.29Å; T465-E467 PolarHBondContact O-N 2.82Å; T465-E468 WeakPolarHBondContact CB-OE2 3.4Å; T465-E468 WeakPolarHBondContact CG2-OE2 3.24Å; T465-E468 PolarHBondContact N-OE2 3.35Å; T465-E468 PolarHBondContact O-N 2.85Å; T465-E468 WeakPolarHBondContact OG1-CB 3.44Å; T465-E468 WeakPolarHBondContact OG1-CG 3.04Å; T465-E468 PolarHBondContact OG1-N 3.35Å; T465-E468 PolarHBondContact OG1-OE2 3.27Å; T465-Y469 VanDerWaalsContact O-CD2 3.26Å; T465-Y469 WeakPolarHBondContact O-CD2 3.49Å; T465-Y469 PolarHBondContact O-N 3Å; T465-Y469 VanDerWaalsContact O-N 3.08Å
466	K	94.8	Very high	94.5	Very high	103 Å²	103	54.5 Å²	54.5	45%	0.448	29%	0.288	S	S	.	.	H	α-helix	trans	-64.4	-39.2	179.4	-65.7	-177.6	-176.9	170.4	0	111.1	Y469 C470 F489	K466-Y469 PolarHBondContact O-N 2.84Å; K466-C470 PolarHBondContact O-N 3.47Å; K466-C470 PolarHBondContact O-SG 3.16Å; K466-F489 HydrophobicContact CB-CD1 4.17Å; K466-F489 HydrophobicContact CB-CE1 4.08Å; K466-F489 HydrophobicContact CB-CG 4.42Å; K466-F489 HydrophobicContact CB-CZ 4.26Å; K466-F489 HydrophobicContact CD-CD2 3.94Å; K466-F489 HydrophobicContact CD-CE2 4.19Å; K466-F489 HydrophobicContact CD-CG 4.28Å; K466-F489 HydrophobicContact CG-CB 4.28Å; K466-F489 HydrophobicContact CG-CD1 4.05Å; K466-F489 HydrophobicContact CG-CD2 4Å; K466-F489 HydrophobicContact CG-CE1 4.38Å; K466-F489 HydrophobicContact CG-CE2 4.36Å; K466-F489 HydrophobicContact CG-CG 3.84Å
467	E	95.3	Very high	94.2	Very high	141 Å²	141	54.5 Å²	54.5	66%	0.659	29%	0.288	S	S	*	.	H	α-helix	trans	-64	-43.3	179.8	-64.4	68.8	-151.3	0	0	110.8	T465 C470 G471	T465-E467 VanDerWaalsContact C-N 3.29Å; T465-E467 PolarHBondContact O-N 2.82Å; E467-C470 WeakPolarHBondContact O-CB 3.45Å; E467-C470 PolarHBondContact O-N 2.83Å; E467-G471 PolarHBondContact O-N 3.44Å
468	E	95.6	Very high	93.9	Very high	96 Å²	96	60.6 Å²	60.6	45%	0.449	32%	0.321	S	S	.	.	H	α-helix	trans	-63.5	-41.3	174.4	-73.1	165.9	141.4	0	0	112.1	L464 T465 C470 G471 L472	L464-E468 HydrophobicContact CB-CB 4.03Å; L464-E468 HydrophobicContact CD1-CB 4.46Å; T465-E468 WeakPolarHBondContact CB-OE2 3.4Å; T465-E468 WeakPolarHBondContact CG2-OE2 3.24Å; T465-E468 PolarHBondContact N-OE2 3.35Å; T465-E468 PolarHBondContact O-N 2.85Å; T465-E468 WeakPolarHBondContact OG1-CB 3.44Å; T465-E468 WeakPolarHBondContact OG1-CG 3.04Å; T465-E468 PolarHBondContact OG1-N 3.35Å; T465-E468 PolarHBondContact OG1-OE2 3.27Å; E468-C470 VanDerWaalsContact C-N 3.35Å; E468-G471 PolarHBondContact O-N 2.85Å; E468-L472 WeakPolarHBondContact O-CG 3.35Å; E468-L472 PolarHBondContact O-N 3.24Å
469	Y	95.8	Very high	93.5	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-63.1	-40.5	173.2	-79.3	-51.7	0	0	0	112.7	L460 P461 P462 L464 T465 K466 L473 F489 E491 G494 V496	L460-Y469 HydrophobicContact CB-CD1 4.1Å; L460-Y469 HydrophobicContact CB-CE1 3.66Å; L460-Y469 HydrophobicContact CD1-CD1 3.79Å; L460-Y469 HydrophobicContact CD1-CE1 4.05Å; L460-Y469 HydrophobicContact CG-CD1 4.45Å; L460-Y469 HydrophobicContact CG-CE1 4.45Å; P461-Y469 WeakPolarHBondContact O-CE1 3.36Å; P461-Y469 PolarHBondContact O-OH 3.34Å; P462-Y469 WeakPolarHBondContact CA-OH 3.34Å; L464-Y469 HydrophobicContact CB-CD1 4.32Å; L464-Y469 HydrophobicContact CB-CD2 4.17Å; L464-Y469 HydrophobicContact CB-CE1 3.97Å; L464-Y469 HydrophobicContact CB-CE2 3.83Å; L464-Y469 HydrophobicContact CB-CG 4.4Å; L464-Y469 HydrophobicContact CD1-CD1 4.16Å; L464-Y469 HydrophobicContact CD1-CE1 3.89Å; L464-Y469 HydrophobicContact CG-CE1 4.24Å; L464-Y469 VanDerWaalsContact O-CE2 3.29Å; L464-Y469 WeakPolarHBondContact O-CE2 3.35Å; T465-Y469 VanDerWaalsContact O-CD2 3.26Å; T465-Y469 WeakPolarHBondContact O-CD2 3.49Å; T465-Y469 PolarHBondContact O-N 3Å; T465-Y469 VanDerWaalsContact O-N 3.08Å; K466-Y469 PolarHBondContact O-N 2.84Å; Y469-L473 VanDerWaalsContact O-CG 3.28Å; Y469-L473 WeakPolarHBondContact O-CG 3.42Å; Y469-L473 PolarHBondContact O-N 3.33Å; Y469-L473 VanDerWaalsContact O-N 3.09Å; Y469-F489 HydrophobicContact CD2-CD1 4.05Å; Y469-F489 HydrophobicContact CG-CD1 4.4Å; Y469-E491 HydrophobicContact CE2-CB 4.34Å; Y469-E491 HydrophobicContact CE2-CG 4.15Å; Y469-E491 PolarHBondContact OH-O 3.18Å; Y469-G494 WeakPolarHBondContact OH-CA 3.17Å; Y469-V496 HydrophobicContact CD1-CG2 4.24Å; Y469-V496 HydrophobicContact CG-CG2 4.01Å
470	C	94	Very high	93.2	Very high	35 Å²	35	66.1 Å²	66.1	24%	0.236	34%	0.342	C	S	.	.	H	α-helix	trans	-61	-49.9	175.7	-63.7	0	0	0	0	110	K466 E467 E468 L472 L473 E474 L486	K466-C470 PolarHBondContact O-N 3.47Å; K466-C470 PolarHBondContact O-SG 3.16Å; E467-C470 WeakPolarHBondContact O-CB 3.45Å; E467-C470 PolarHBondContact O-N 2.83Å; E468-C470 VanDerWaalsContact C-N 3.35Å; C470-L472 PolarHBondContact O-N 3.32Å; C470-L473 PolarHBondContact O-N 2.84Å; C470-E474 WeakPolarHBondContact O-CB 3.39Å; C470-E474 WeakPolarHBondContact O-CG 3.36Å; C470-E474 PolarHBondContact O-N 3.35Å; C470-L486 HydrophobicContact CB-CD2 4.39Å; C470-L486 VanDerWaalsContact SG-CD2 3.59Å
471	G	93.8	Very high	92.7	Very high	33 Å²	33	68.5 Å²	68.5	34%	0.34	37%	0.367	S	S	.	.	H	α-helix	trans	-57.5	-46.2	178.7	0	0	0	0	0	113	E467 E468 L473 E474 E475	E467-G471 PolarHBondContact O-N 3.44Å; E468-G471 PolarHBondContact O-N 2.85Å; G471-L473 PolarHBondContact O-N 3.25Å; G471-E474 PolarHBondContact O-N 3.45Å; G471-E475 VanDerWaalsContact O-CB 3.27Å; G471-E475 WeakPolarHBondContact O-CB 3.44Å; G471-E475 PolarHBondContact O-N 3.08Å
472	L	93.8	Very high	92.4	Very high	35 Å²	35	74.3 Å²	74.3	18%	0.183	39%	0.391	C	S	.	.	H	α-helix	trans	-61.7	-42.3	177.2	-77.6	175.3	0	0	0	112.8	P461 L464 E468 C470 H476	P461-L472 HydrophobicContact CG-CD1 4.45Å; L464-L472 HydrophobicContact CD1-CD1 3.45Å; L464-L472 VanDerWaalsContact CD1-CD1 3.45Å; E468-L472 WeakPolarHBondContact O-CG 3.35Å; E468-L472 PolarHBondContact O-N 3.24Å; C470-L472 PolarHBondContact O-N 3.32Å; L472-H476 WeakPolarHBondContact O-CB 3.47Å; L472-H476 PolarHBondContact O-CD2 3.45Å; L472-H476 VanDerWaalsContact O-CD2 3.24Å; L472-H476 PolarHBondContact O-N 3.11Å
473	L	93.3	Very high	92.3	Very high	1 Å²	1	72.1 Å²	72.1	1%	0.005	38%	0.375	C	S	.	.	H	α-helix	trans	-71.8	-37.3	-179.7	-67.1	170.7	0	0	0	111.2	I457 L460 Y469 C470 G471 L477 F479 L486 V496	I457-L473 HydrophobicContact CB-CD2 4.49Å; I457-L473 HydrophobicContact CG2-CD2 3.98Å; L460-L473 HydrophobicContact CD1-CD2 4.23Å; L460-L473 HydrophobicContact CD2-CD2 4.09Å; Y469-L473 VanDerWaalsContact O-CG 3.28Å; Y469-L473 WeakPolarHBondContact O-CG 3.42Å; Y469-L473 PolarHBondContact O-N 3.33Å; Y469-L473 VanDerWaalsContact O-N 3.09Å; C470-L473 PolarHBondContact O-N 2.84Å; G471-L473 PolarHBondContact O-N 3.25Å; L473-L477 HydrophobicContact CD2-CD1 3.6Å; L473-L477 HydrophobicContact CD2-CG 4.44Å; L473-L477 WeakPolarHBondContact O-CA 3.22Å; L473-L477 VanDerWaalsContact O-CB 3.22Å; L473-L477 WeakPolarHBondContact O-CB 3.48Å; L473-L477 PolarHBondContact O-N 3.26Å; L473-F479 HydrophobicContact CB-CE1 3.66Å; L473-F479 HydrophobicContact CB-CZ 4.5Å; L473-L486 HydrophobicContact CD1-CD2 4.02Å; L473-V496 HydrophobicContact CD1-CB 3.9Å; L473-V496 HydrophobicContact CD1-CG1 4.04Å; L473-V496 HydrophobicContact CD1-CG2 3.94Å
474	E	92.1	Very high	92.4	Very high	112 Å²	112	65.6 Å²	65.6	52%	0.523	34%	0.341	S	S	.	.	H	α-helix	trans	-65.7	-45.2	175.2	-74	175.7	178.7	0	0	111.1	C470 G471 D478 F479	C470-E474 WeakPolarHBondContact O-CB 3.39Å; C470-E474 WeakPolarHBondContact O-CG 3.36Å; C470-E474 PolarHBondContact O-N 3.35Å; G471-E474 PolarHBondContact O-N 3.45Å; E474-D478 VanDerWaalsContact O-CA 3.3Å; E474-D478 WeakPolarHBondContact O-CA 3.32Å; E474-D478 PolarHBondContact O-N 3.07Å; E474-D478 VanDerWaalsContact O-N 3.08Å; E474-F479 HydrophobicContact CG-CE1 3.94Å; E474-F479 HydrophobicContact CG-CE2 4.34Å; E474-F479 HydrophobicContact CG-CZ 3.66Å
475	E	92.9	Very high	92.5	Very high	142 Å²	142	67.8 Å²	67.8	66%	0.664	36%	0.357	S	S	*	.	H	α-helix	trans	-62.1	-47.6	178.4	-178.2	-179.1	176.6	0	0	112.4	G471	G471-E475 VanDerWaalsContact O-CB 3.27Å; G471-E475 WeakPolarHBondContact O-CB 3.44Å; G471-E475 PolarHBondContact O-N 3.08Å
476	H	93.3	Very high	92.5	Very high	66 Å²	66	66.2 Å²	66.2	31%	0.306	35%	0.345	S	S	.	.	H	α-helix	trans	-92.7	-27.4	-170.9	-71	-67.2	0	0	0	114.6	L472 T516 I518	L472-H476 WeakPolarHBondContact O-CB 3.47Å; L472-H476 PolarHBondContact O-CD2 3.45Å; L472-H476 VanDerWaalsContact O-CD2 3.24Å; L472-H476 PolarHBondContact O-N 3.11Å; H476-T516 HydrophobicContact CB-CG2 4.01Å; H476-I518 HydrophobicContact CB-CD1 4.23Å; H476-I518 WeakPolarHBondContact CD2-CD1 3.24Å
477	L	92.9	Very high	92.6	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-106.3	-12.1	-177.8	-52.1	178	0	0	0	113.2	L473 F479 R508 I509 L512 A513	L473-L477 HydrophobicContact CD2-CD1 3.6Å; L473-L477 HydrophobicContact CD2-CG 4.44Å; L473-L477 WeakPolarHBondContact O-CA 3.22Å; L473-L477 VanDerWaalsContact O-CB 3.22Å; L473-L477 WeakPolarHBondContact O-CB 3.48Å; L473-L477 PolarHBondContact O-N 3.26Å; L477-F479 VanDerWaalsContact C-N 3.3Å; L477-F479 HydrophobicContact CB-CD1 4.21Å; L477-F479 PolarHBondContact O-N 3.14Å; L477-R508 PolarHBondContact O-NH1 3.37Å; L477-R508 PolarHBondContact O-NH2 3.27Å; L477-I509 HydrophobicContact CD1-CG2 4.22Å; L477-L512 HydrophobicContact CB-CD2 4.47Å; L477-L512 HydrophobicContact CD2-CD2 4.31Å; L477-L512 HydrophobicContact CD2-CG 4.1Å; L477-A513 HydrophobicContact CD2-CB 3.99Å
478	D	89.7	Confident	92.6	Very high	129 Å²	129	59.5 Å²	59.5	69%	0.69	32%	0.319	S	S	*	.			trans	41.9	55.8	177.9	-174.7	29.5	0	0	0	111.9	E474 R508	E474-D478 VanDerWaalsContact O-CA 3.3Å; E474-D478 WeakPolarHBondContact O-CA 3.32Å; E474-D478 PolarHBondContact O-N 3.07Å; E474-D478 VanDerWaalsContact O-N 3.08Å; D478-R508 PolarHBondContact O-NH2 3.19Å
479	F	87.8	Confident	92.7	Very high	17 Å²	17	56 Å²	56	8%	0.075	30%	0.302	C	S	.	.			trans	-91.5	148.3	-175.3	65.3	-98.1	0	0	0	112.7	L473 E474 L477 G481 V484 L486 E505 I509	L473-F479 HydrophobicContact CB-CE1 3.66Å; L473-F479 HydrophobicContact CB-CZ 4.5Å; E474-F479 HydrophobicContact CG-CE1 3.94Å; E474-F479 HydrophobicContact CG-CE2 4.34Å; E474-F479 HydrophobicContact CG-CZ 3.66Å; L477-F479 VanDerWaalsContact C-N 3.3Å; L477-F479 HydrophobicContact CB-CD1 4.21Å; L477-F479 PolarHBondContact O-N 3.14Å; F479-G481 PolarHBondContact O-N 3.17Å; F479-G481 VanDerWaalsContact O-N 3.15Å; F479-V484 HydrophobicContact CB-CG2 3.94Å; F479-V484 HydrophobicContact CD2-CB 3.47Å; F479-V484 VanDerWaalsContact CD2-CB 3.47Å; F479-V484 HydrophobicContact CD2-CG1 3.79Å; F479-V484 HydrophobicContact CD2-CG2 3.74Å; F479-V484 HydrophobicContact CE2-CB 3.93Å; F479-V484 HydrophobicContact CE2-CG1 3.97Å; F479-V484 HydrophobicContact CG-CB 4.21Å; F479-V484 HydrophobicContact CG-CG1 4.28Å; F479-V484 HydrophobicContact CG-CG2 4.07Å; F479-L486 HydrophobicContact CE2-CD1 4.04Å; F479-L486 HydrophobicContact CZ-CD1 3.8Å; F479-E505 VanDerWaalsContact CA-OE1 3.31Å; F479-E505 WeakPolarHBondContact CA-OE1 2.96Å; F479-I509 HydrophobicContact CB-CD1 3.54Å; F479-I509 HydrophobicContact CB-CG1 4.15Å; F479-I509 HydrophobicContact CG-CD1 4.37Å
480	K	86.1	Confident	92.7	Very high	117 Å²	117	56.2 Å²	56.2	51%	0.509	30%	0.303	S	S	.	.			trans	-74.1	107.3	179.4	-63.9	178.5	-176.9	177.7	0	110	H482 L483 V484 E505	K480-H482 PolarHBondContact O-N 3.03Å; K480-L483 HydrophobicContact CB-CB 4.25Å; K480-L483 HydrophobicContact CB-CD1 3.97Å; K480-L483 HydrophobicContact CB-CG 4.03Å; K480-L483 HydrophobicContact CD-CD1 3.79Å; K480-L483 HydrophobicContact CG-CD1 4.47Å; K480-L483 WeakPolarHBondContact O-CA 3.3Å; K480-L483 WeakPolarHBondContact O-CB 3.24Å; K480-L483 PolarHBondContact O-N 3.37Å; K480-V484 PolarHBondContact O-N 3.36Å; K480-E505 PolarHBondContact N-OE1 3.15Å
481	G	84.1	Confident	92.8	Very high	53 Å²	53	57.8 Å²	57.8	55%	0.546	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-26.2	-174.8	0	0	0	0	0	116.1	F479 L483 V484	F479-G481 PolarHBondContact O-N 3.17Å; F479-G481 VanDerWaalsContact O-N 3.15Å; G481-L483 VanDerWaalsContact C-N 3.31Å; G481-L483 PolarHBondContact O-N 3.39Å; G481-V484 VanDerWaalsContact O-O 3.13Å
482	H	89.1	Confident	92.7	Very high	152 Å²	152	58.6 Å²	58.6	70%	0.704	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-15.7	174	65	-83.8	0	0	0	113.7	K480	K480-H482 PolarHBondContact O-N 3.03Å
483	L	92.1	Very high	92.7	Very high	30 Å²	30	59 Å²	59	16%	0.157	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-17.8	179.1	-59.3	-176.6	0	0	0	113.2	K480 G481 I500 S501 C502 E505	K480-L483 HydrophobicContact CB-CB 4.25Å; K480-L483 HydrophobicContact CB-CD1 3.97Å; K480-L483 HydrophobicContact CB-CG 4.03Å; K480-L483 HydrophobicContact CD-CD1 3.79Å; K480-L483 HydrophobicContact CG-CD1 4.47Å; K480-L483 WeakPolarHBondContact O-CA 3.3Å; K480-L483 WeakPolarHBondContact O-CB 3.24Å; K480-L483 PolarHBondContact O-N 3.37Å; G481-L483 VanDerWaalsContact C-N 3.31Å; G481-L483 PolarHBondContact O-N 3.39Å; L483-I500 CarbonylContact O-C 3.48Å; L483-I500 WeakPolarHBondContact O-CA 3.14Å; L483-S501 WeakPolarHBondContact CA-OG 3.46Å; L483-S501 PolarHBondContact O-N 3.19Å; L483-S501 PolarHBondContact O-OG 2.94Å; L483-C502 HydrophobicContact CD1-CB 3.86Å; L483-C502 HydrophobicContact CD2-CB 4.27Å; L483-C502 HydrophobicContact CG-CB 4.46Å; L483-E505 HydrophobicContact CB-CG 4.38Å; L483-E505 HydrophobicContact CD1-CB 4.15Å; L483-E505 HydrophobicContact CD1-CG 4.25Å
484	V	95	Very high	92.8	Very high	6 Å²	6	59 Å²	59	4%	0.036	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	128	-172.8	-177.9	0	0	0	0	110.2	F479 K480 G481 L486 L498 I500 E505 I509	F479-V484 HydrophobicContact CB-CG2 3.94Å; F479-V484 HydrophobicContact CD2-CB 3.47Å; F479-V484 VanDerWaalsContact CD2-CB 3.47Å; F479-V484 HydrophobicContact CD2-CG1 3.79Å; F479-V484 HydrophobicContact CD2-CG2 3.74Å; F479-V484 HydrophobicContact CE2-CB 3.93Å; F479-V484 HydrophobicContact CE2-CG1 3.97Å; F479-V484 HydrophobicContact CG-CB 4.21Å; F479-V484 HydrophobicContact CG-CG1 4.28Å; F479-V484 HydrophobicContact CG-CG2 4.07Å; K480-V484 PolarHBondContact O-N 3.36Å; G481-V484 VanDerWaalsContact O-O 3.13Å; V484-L486 HydrophobicContact CG1-CD1 4.27Å; V484-L498 HydrophobicContact CG1-CB 4.25Å; V484-L498 HydrophobicContact CG1-CD2 3.81Å; V484-L498 HydrophobicContact CG1-CG 4.07Å; V484-I500 HydrophobicContact CG1-CG1 4.28Å; V484-I500 HydrophobicContact CG2-CG1 4.16Å; V484-I500 HydrophobicContact CG2-CG2 4.19Å; V484-E505 HydrophobicContact CG2-CG 4.2Å; V484-I509 HydrophobicContact CG2-CD1 3.69Å
485	T	95.6	Very high	93.1	Very high	86 Å²	86	53.7 Å²	53.7	53%	0.528	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	123.5	174.9	-53.7	0	0	0	0	109.9	T487 L498 Q499	T485-T487 HydrophobicContact CG2-CG2 4.27Å; T485-T487 PolarHBondContact O-N 2.99Å; T485-L498 CarbonylContact O-C 3.53Å; T485-L498 WeakPolarHBondContact O-CA 3.46Å; T485-Q499 PolarHBondContact N-O 3.01Å; T485-Q499 PolarHBondContact O-N 3.47Å
486	L	96.2	Very high	93.3	Very high	37 Å²	37	46.9 Å²	46.9	19%	0.194	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	115.1	174.2	-69.8	69.4	0	0	0	107.8	C470 L473 F479 V484 F489 V496	C470-L486 HydrophobicContact CB-CD2 4.39Å; C470-L486 VanDerWaalsContact SG-CD2 3.59Å; L473-L486 HydrophobicContact CD1-CD2 4.02Å; F479-L486 HydrophobicContact CE2-CD1 4.04Å; F479-L486 HydrophobicContact CZ-CD1 3.8Å; V484-L486 HydrophobicContact CG1-CD1 4.27Å; L486-F489 HydrophobicContact CB-CE1 4.49Å; L486-F489 HydrophobicContact CB-CE2 4.23Å; L486-F489 HydrophobicContact CB-CZ 3.75Å; L486-F489 HydrophobicContact CD2-CE1 3.97Å; L486-F489 HydrophobicContact CD2-CZ 3.87Å; L486-F489 HydrophobicContact CG-CZ 4.47Å; L486-V496 HydrophobicContact CB-CG1 4.17Å; L486-V496 HydrophobicContact CD2-CG1 4.04Å; L486-V496 HydrophobicContact CG-CG1 4.08Å
487	T	95.8	Very high	93.5	Very high	52 Å²	52	43.8 Å²	43.8	32%	0.319	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	-38.4	-169.9	58.8	0	0	0	0	113.8	T485 A497 Q499	T485-T487 HydrophobicContact CG2-CG2 4.27Å; T485-T487 PolarHBondContact O-N 2.99Å; T487-A497 PolarHBondContact N-O 3Å; T487-A497 PolarHBondContact OG1-O 3.33Å; T487-Q499 HydrophobicContact CG2-CB 3.99Å; T487-Q499 HydrophobicContact CG2-CG 3.37Å
488	H	96.5	Very high	93.7	Very high	50 Å²	50	43.8 Å²	43.8	23%	0.231	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	133.1	-176.8	-60.1	73.6	0	0	0	110.2	Y490 V496 A497 H585	H488-Y490 HydrophobicContact CB-CE2 3.76Å; H488-V496 CarbonylContact O-C 3.58Å; H488-V496 WeakPolarHBondContact O-CA 3.39Å; H488-A497 HydrophobicContact CB-CB 3.99Å; H488-A497 PolarHBondContact O-N 3.11Å; H488-H585 AromaticContact CG-CE1 3.93Å; H488-H585 AromaticContact ND1-CE1 3.74Å
489	F	96.9	Very high	93.9	Very high	23 Å²	23	39.3 Å²	39.3	10%	0.101	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	135.7	175.5	-60.9	-98.6	0	0	0	108.8	K466 Y469 L486 V496 K617	K466-F489 HydrophobicContact CB-CD1 4.17Å; K466-F489 HydrophobicContact CB-CE1 4.08Å; K466-F489 HydrophobicContact CB-CG 4.42Å; K466-F489 HydrophobicContact CB-CZ 4.26Å; K466-F489 HydrophobicContact CD-CD2 3.94Å; K466-F489 HydrophobicContact CD-CE2 4.19Å; K466-F489 HydrophobicContact CD-CG 4.28Å; K466-F489 HydrophobicContact CG-CB 4.28Å; K466-F489 HydrophobicContact CG-CD1 4.05Å; K466-F489 HydrophobicContact CG-CD2 4Å; K466-F489 HydrophobicContact CG-CE1 4.38Å; K466-F489 HydrophobicContact CG-CE2 4.36Å; K466-F489 HydrophobicContact CG-CG 3.84Å; Y469-F489 HydrophobicContact CD2-CD1 4.05Å; Y469-F489 HydrophobicContact CG-CD1 4.4Å; L486-F489 HydrophobicContact CB-CE1 4.49Å; L486-F489 HydrophobicContact CB-CE2 4.23Å; L486-F489 HydrophobicContact CB-CZ 3.75Å; L486-F489 HydrophobicContact CD2-CE1 3.97Å; L486-F489 HydrophobicContact CD2-CZ 3.87Å; L486-F489 HydrophobicContact CG-CZ 4.47Å; F489-V496 HydrophobicContact CD1-CG1 4.12Å; F489-V496 HydrophobicContact CD1-CG2 3.9Å; F489-V496 HydrophobicContact CE1-CG1 4.06Å; F489-V496 HydrophobicContact CE1-CG2 4.3Å; F489-K617 PolarHBondContact O-NZ 2.86Å
490	Y	96.6	Very high	94.3	Very high	4 Å²	4	38.6 Å²	38.6	2%	0.016	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	79.1	179.4	-64.8	-80.9	0	0	0	108.3	L456 H488 A492 Q493 G494 A495 L581 H585 V614 K617	L456-Y490 HydrophobicContact CD1-CD2 4.46Å; L456-Y490 HydrophobicContact CD1-CE2 4.39Å; H488-Y490 HydrophobicContact CB-CE2 3.76Å; Y490-A492 VanDerWaalsContact C-N 3.34Å; Y490-A492 PolarHBondContact O-N 2.94Å; Y490-Q493 CarbonylContact O-C 3.55Å; Y490-Q493 PolarHBondContact O-N 3.36Å; Y490-G494 PolarHBondContact O-N 3.45Å; Y490-A495 PolarHBondContact N-O 3.13Å; Y490-A495 PolarHBondContact O-N 3.03Å; Y490-L581 HydrophobicContact CD1-CD1 3.61Å; Y490-L581 HydrophobicContact CD1-CD2 4.42Å; Y490-L581 HydrophobicContact CD2-CD1 4.19Å; Y490-L581 HydrophobicContact CD2-CD2 3.9Å; Y490-L581 HydrophobicContact CD2-CG 4.47Å; Y490-L581 HydrophobicContact CE1-CD1 3.67Å; Y490-L581 HydrophobicContact CE2-CD1 4.24Å; Y490-L581 HydrophobicContact CG-CD1 3.88Å; Y490-L581 HydrophobicContact CG-CD2 3.84Å; Y490-L581 HydrophobicContact CG-CG 4.45Å; Y490-H585 AromaticContact CE2-ND1 3.79Å; Y490-H585 AromaticContact CZ-ND1 3.69Å; Y490-H585 PolarHBondContact OH-ND1 2.91Å; Y490-V614 HydrophobicContact CD1-CG1 3.68Å; Y490-V614 HydrophobicContact CE1-CB 4.28Å; Y490-V614 HydrophobicContact CE1-CG1 3.8Å; Y490-K617 HydrophobicContact CD1-CD 4.18Å; Y490-K617 HydrophobicContact CE1-CD 3.77Å
491	E	95	Very high	94.6	Very high	69 Å²	69	35.6 Å²	35.6	32%	0.322	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-58.7	-46.3	-170.5	-54.8	99.4	-174.2	0	0	111.1	P462 L463 L464 Y469 Q493 G494	P462-E491 CarbonylContact C-O 3.27Å; P462-E491 VanDerWaalsContact CA-O 3.23Å; P462-E491 WeakPolarHBondContact CA-O 3.22Å; P462-E491 WeakPolarHBondContact CB-O 3.49Å; L463-E491 PolarHBondContact N-O 3.19Å; L464-E491 VanDerWaalsContact O-CG 3.3Å; L464-E491 WeakPolarHBondContact O-CG 3.33Å; Y469-E491 HydrophobicContact CE2-CB 4.34Å; Y469-E491 HydrophobicContact CE2-CG 4.15Å; Y469-E491 PolarHBondContact OH-O 3.18Å; E491-Q493 PolarHBondContact O-N 3.26Å; E491-Q493 VanDerWaalsContact O-N 3.12Å; E491-G494 PolarHBondContact O-N 3.46Å
492	A	92	Very high	94.9	Very high	50 Å²	50	35 Å²	35	41%	0.413	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-61.8	-22.7	179.2	0	0	0	0	0	114.1	Y490 T613	Y490-A492 VanDerWaalsContact C-N 3.34Å; Y490-A492 PolarHBondContact O-N 2.94Å; A492-T613 HydrophobicContact CB-CG2 4.16Å
493	Q	94.4	Very high	94.9	Very high	44 Å²	44	28.9 Å²	28.9	21%	0.206	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-103.5	-10.8	-179.7	-73.7	72.3	50.1	0	0	113.7	Y490 E491 A495 L581 V610 T613	Y490-Q493 CarbonylContact O-C 3.55Å; Y490-Q493 PolarHBondContact O-N 3.36Å; E491-Q493 PolarHBondContact O-N 3.26Å; E491-Q493 VanDerWaalsContact O-N 3.12Å; Q493-A495 HydrophobicContact CB-CB 4.46Å; Q493-L581 HydrophobicContact CB-CD2 3.85Å; Q493-L581 HydrophobicContact CG-CD2 4.18Å; Q493-V610 HydrophobicContact CG-CG1 4.27Å; Q493-T613 PolarHBondContact NE2-OG1 3.41Å
494	G	95.3	Very high	94.8	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.1	54.7	-172.9	0	0	0	0	0	111.9	G459 L460 Y469 Y490 E491	G459-G494 PolarHBondContact N-O 3.37Å; G459-G494 VanDerWaalsContact N-O 3.16Å; L460-G494 WeakPolarHBondContact CB-O 3.47Å; L460-G494 PolarHBondContact N-O 3.24Å; L460-G494 WeakPolarHBondContact O-CA 3.23Å; Y469-G494 WeakPolarHBondContact OH-CA 3.17Å; Y490-G494 PolarHBondContact O-N 3.45Å; E491-G494 PolarHBondContact O-N 3.46Å
495	A	96.9	Very high	94.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	149.2	-176.3	0	0	0	0	0	113.4	L456 I457 S458 Y490 Q493 L581	L456-A495 HydrophobicContact CD1-CB 4.4Å; I457-A495 CarbonylContact O-C 3.57Å; I457-A495 WeakPolarHBondContact O-CA 3.23Å; I457-A495 VanDerWaalsContact O-CB 3.28Å; I457-A495 WeakPolarHBondContact O-CB 3.4Å; S458-A495 WeakPolarHBondContact OG-CB 3.14Å; Y490-A495 PolarHBondContact N-O 3.13Å; Y490-A495 PolarHBondContact O-N 3.03Å; Q493-A495 HydrophobicContact CB-CB 4.46Å; A495-L581 HydrophobicContact CB-CD2 3.44Å; A495-L581 VanDerWaalsContact CB-CD2 3.44Å
496	V	97.6	Very high	94.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	134.7	179.1	-173.3	0	0	0	0	109.9	I457 L460 Y469 L473 L486 H488 F489 L498	I457-V496 PolarHBondContact N-O 3.28Å; I457-V496 PolarHBondContact O-N 3.43Å; L460-V496 HydrophobicContact CD1-CB 4.49Å; L460-V496 HydrophobicContact CD1-CG2 3.81Å; Y469-V496 HydrophobicContact CD1-CG2 4.24Å; Y469-V496 HydrophobicContact CG-CG2 4.01Å; L473-V496 HydrophobicContact CD1-CB 3.9Å; L473-V496 HydrophobicContact CD1-CG1 4.04Å; L473-V496 HydrophobicContact CD1-CG2 3.94Å; L486-V496 HydrophobicContact CB-CG1 4.17Å; L486-V496 HydrophobicContact CD2-CG1 4.04Å; L486-V496 HydrophobicContact CG-CG1 4.08Å; H488-V496 CarbonylContact O-C 3.58Å; H488-V496 WeakPolarHBondContact O-CA 3.39Å; F489-V496 HydrophobicContact CD1-CG1 4.12Å; F489-V496 HydrophobicContact CD1-CG2 3.9Å; F489-V496 HydrophobicContact CE1-CG1 4.06Å; F489-V496 HydrophobicContact CE1-CG2 4.3Å; V496-L498 HydrophobicContact CB-CD1 4.24Å; V496-L498 HydrophobicContact CG1-CD1 4.03Å; V496-L498 WeakPolarHBondContact O-CD1 3.46Å
497	A	97.4	Very high	94.5	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.008	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	126.5	174.6	0	0	0	0	0	111	L455 L456 T487 H488 H585	L455-A497 CarbonylContact O-C 3.56Å; L455-A497 WeakPolarHBondContact O-CA 3.16Å; L456-A497 HydrophobicContact CD1-CB 4.11Å; T487-A497 PolarHBondContact N-O 3Å; T487-A497 PolarHBondContact OG1-O 3.33Å; H488-A497 HydrophobicContact CB-CB 3.99Å; H488-A497 PolarHBondContact O-N 3.11Å; A497-H585 WeakPolarHBondContact CB-CE1 3.25Å; A497-H585 WeakPolarHBondContact CB-NE2 3.47Å
498	L	96.8	Very high	94.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	144	-177.5	-69.7	65	0	0	0	109.8	G454 L455 I457 V484 T485 V496 I500 I509	G454-L498 WeakPolarHBondContact CA-O 3.15Å; L455-L498 HydrophobicContact CB-CB 4.43Å; L455-L498 PolarHBondContact N-O 3.12Å; L455-L498 PolarHBondContact O-N 3.34Å; I457-L498 HydrophobicContact CB-CD1 4.32Å; I457-L498 HydrophobicContact CG1-CD1 3.69Å; I457-L498 HydrophobicContact CG1-CD2 4.22Å; V484-L498 HydrophobicContact CG1-CB 4.25Å; V484-L498 HydrophobicContact CG1-CD2 3.81Å; V484-L498 HydrophobicContact CG1-CG 4.07Å; T485-L498 CarbonylContact O-C 3.53Å; T485-L498 WeakPolarHBondContact O-CA 3.46Å; V496-L498 HydrophobicContact CB-CD1 4.24Å; V496-L498 HydrophobicContact CG1-CD1 4.03Å; V496-L498 WeakPolarHBondContact O-CD1 3.46Å; L498-I500 HydrophobicContact CB-CD1 4.45Å; L498-I500 HydrophobicContact CB-CG1 4.27Å; L498-I509 HydrophobicContact CD2-CG2 4.32Å
499	Q	95.4	Very high	94.4	Very high	35 Å²	35	27.5 Å²	27.5	16%	0.164	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	124.7	166.2	-68.4	-64	-30.6	0	0	108.3	T485 T487	T485-Q499 PolarHBondContact N-O 3.01Å; T485-Q499 PolarHBondContact O-N 3.47Å; T487-Q499 HydrophobicContact CG2-CB 3.99Å; T487-Q499 HydrophobicContact CG2-CG 3.37Å
500	I	94.6	Very high	94.3	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.005	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	126.4	-169.1	-52.6	171.8	0	0	0	110.1	Q452 V453 L455 L483 V484 L498 C502 E505 A506 I509	Q452-I500 WeakPolarHBondContact CA-O 3.38Å; V453-I500 HydrophobicContact CB-CB 4.47Å; V453-I500 PolarHBondContact N-O 2.98Å; V453-I500 PolarHBondContact O-N 3.49Å; L455-I500 HydrophobicContact CB-CD1 4.49Å; L455-I500 HydrophobicContact CD1-CD1 3.51Å; L455-I500 HydrophobicContact CG-CD1 3.91Å; L483-I500 CarbonylContact O-C 3.48Å; L483-I500 WeakPolarHBondContact O-CA 3.14Å; V484-I500 HydrophobicContact CG1-CG1 4.28Å; V484-I500 HydrophobicContact CG2-CG1 4.16Å; V484-I500 HydrophobicContact CG2-CG2 4.19Å; L498-I500 HydrophobicContact CB-CD1 4.45Å; L498-I500 HydrophobicContact CB-CG1 4.27Å; I500-C502 WeakPolarHBondContact CG2-O 3.4Å; I500-E505 HydrophobicContact CG2-CB 4.18Å; I500-E505 HydrophobicContact CG2-CG 4.27Å; I500-A506 HydrophobicContact CB-CB 4.05Å; I500-A506 HydrophobicContact CD1-CB 3.94Å; I500-A506 HydrophobicContact CG2-CB 3.86Å; I500-I509 HydrophobicContact CD1-CD1 3.95Å
501	S	92.7	Very high	94.2	Very high	55 Å²	55	30 Å²	30	39%	0.385	17%	0.166	S	C	.	.	S	Bend	trans	-94.6	14.2	-174.8	61.7	0	0	0	0	115.2	V451 L483	V451-S501 WeakPolarHBondContact CB-O 3.48Å; V451-S501 WeakPolarHBondContact O-CA 3.47Å; V451-S501 WeakPolarHBondContact O-CB 3.48Å; L483-S501 WeakPolarHBondContact CA-OG 3.46Å; L483-S501 PolarHBondContact O-N 3.19Å; L483-S501 PolarHBondContact O-OG 2.94Å
502	C	90.6	Very high	94.2	Very high	40 Å²	40	29.8 Å²	29.8	27%	0.27	17%	0.166	S	C	.	.			trans	-142.9	128.4	176.4	177.1	0	0	0	0	110.9	L483 I500 E505 A506	L483-C502 HydrophobicContact CD1-CB 3.86Å; L483-C502 HydrophobicContact CD2-CB 4.27Å; L483-C502 HydrophobicContact CG-CB 4.46Å; I500-C502 WeakPolarHBondContact CG2-O 3.4Å; C502-E505 HydrophobicContact CB-CB 3.93Å; C502-E505 PolarHBondContact O-N 3.25Å; C502-A506 WeakPolarHBondContact O-CB 3.48Å; C502-A506 PolarHBondContact O-N 3.25Å
503	F	89.1	Confident	94.3	Very high	23 Å²	23	27.4 Å²	27.4	10%	0.101	15%	0.147	C	C	.	.	H	α-helix	trans	-62.7	-43.8	-179.6	-72.2	-65.8	0	0	0	113.1	Q226 R228 V451 V453 E505 A506 E507	Q226-F503 HydrophobicContact CB-CE1 3.76Å; Q226-F503 HydrophobicContact CB-CZ 3.98Å; R228-F503 HydrophobicContact CB-CD1 3.9Å; R228-F503 HydrophobicContact CB-CD2 4.2Å; R228-F503 HydrophobicContact CB-CE1 3.77Å; R228-F503 HydrophobicContact CB-CE2 4.07Å; R228-F503 HydrophobicContact CB-CG 4.12Å; R228-F503 HydrophobicContact CB-CZ 3.86Å; V451-F503 HydrophobicContact CB-CE2 4.37Å; V451-F503 HydrophobicContact CG1-CD1 4.18Å; V451-F503 HydrophobicContact CG1-CD2 3.96Å; V451-F503 HydrophobicContact CG1-CE1 4.05Å; V451-F503 HydrophobicContact CG1-CE2 3.83Å; V451-F503 HydrophobicContact CG1-CG 4.13Å; V451-F503 HydrophobicContact CG1-CZ 3.87Å; V451-F503 HydrophobicContact CG2-CD2 4.04Å; V451-F503 HydrophobicContact CG2-CE2 3.58Å; V451-F503 HydrophobicContact CG2-CZ 4.17Å; V453-F503 HydrophobicContact CG2-CD1 3.91Å; V453-F503 HydrophobicContact CG2-CE1 3.95Å; F503-E505 VanDerWaalsContact C-N 3.32Å; F503-E505 PolarHBondContact O-N 2.98Å; F503-A506 PolarHBondContact O-N 2.61Å; F503-E507 WeakPolarHBondContact O-CB 3.17Å; F503-E507 PolarHBondContact O-N 3.38Å
504	A	90.8	Very high	94.1	Very high	60 Å²	60	28.7 Å²	28.7	50%	0.496	15%	0.152	S	C	.	.	H	α-helix	trans	-64.1	-39.8	-179.9	0	0	0	0	0	111.5	R508	A504-R508 WeakPolarHBondContact O-CB 3.44Å; A504-R508 PolarHBondContact O-N 2.72Å
505	E	93.4	Very high	94	Very high	10 Å²	10	34.2 Å²	34.2	5%	0.047	18%	0.181	C	C	.	.	H	α-helix	trans	-69.4	-39.7	177	-172.5	65.4	175.1	0	0	111.6	F479 K480 L483 V484 I500 C502 F503 R508 I509	F479-E505 VanDerWaalsContact CA-OE1 3.31Å; F479-E505 WeakPolarHBondContact CA-OE1 2.96Å; K480-E505 PolarHBondContact N-OE1 3.15Å; L483-E505 HydrophobicContact CB-CG 4.38Å; L483-E505 HydrophobicContact CD1-CB 4.15Å; L483-E505 HydrophobicContact CD1-CG 4.25Å; V484-E505 HydrophobicContact CG2-CG 4.2Å; I500-E505 HydrophobicContact CG2-CB 4.18Å; I500-E505 HydrophobicContact CG2-CG 4.27Å; C502-E505 HydrophobicContact CB-CB 3.93Å; C502-E505 PolarHBondContact O-N 3.25Å; F503-E505 VanDerWaalsContact C-N 3.32Å; F503-E505 PolarHBondContact O-N 2.98Å; E505-R508 PolarHBondContact O-N 3.36Å; E505-R508 IonicContact OE1-CZ 3.14Å; E505-R508 IonicContact OE1-NE 2.68Å; E505-R508 IonicContact OE1-NH2 3.78Å; E505-R508 PolarHBondContact OE1-NH2 2.98Å; E505-R508 IonicContact OE2-CZ 3.7Å; E505-R508 IonicContact OE2-NE 2.69Å; E505-R508 PolarHBondContact OE2-NE 2.95Å; E505-R508 IonicContact OE2-NH2 3.59Å; E505-I509 HydrophobicContact CG-CD1 3.88Å; E505-I509 WeakPolarHBondContact O-CB 3.15Å; E505-I509 VanDerWaalsContact O-CG1 3.3Å; E505-I509 WeakPolarHBondContact O-CG1 3.39Å; E505-I509 PolarHBondContact O-N 2.87Å
506	A	93.9	Very high	93.9	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.5	-44.1	175.9	0	0	0	0	0	112.3	F230 V453 I500 C502 F503 Y510	F230-A506 HydrophobicContact CE2-CB 4.16Å; F230-A506 HydrophobicContact CZ-CB 3.99Å; V453-A506 HydrophobicContact CB-CB 3.83Å; V453-A506 HydrophobicContact CG1-CB 3.86Å; V453-A506 HydrophobicContact CG2-CB 4.04Å; I500-A506 HydrophobicContact CB-CB 4.05Å; I500-A506 HydrophobicContact CD1-CB 3.94Å; I500-A506 HydrophobicContact CG2-CB 3.86Å; C502-A506 WeakPolarHBondContact O-CB 3.48Å; C502-A506 PolarHBondContact O-N 3.25Å; F503-A506 PolarHBondContact O-N 2.61Å; A506-Y510 WeakPolarHBondContact O-CB 3.41Å; A506-Y510 PolarHBondContact O-N 3.42Å
507	E	93.7	Very high	93.7	Very high	79 Å²	79	38.6 Å²	38.6	37%	0.369	21%	0.208	S	C	.	.	H	α-helix	trans	-63.7	-45.3	176.3	-178.2	175.7	-156.5	0	0	111.5	N229 F230 F503 I509 Y510 M511	N229-E507 HydrophobicContact CB-CB 4.27Å; N229-E507 WeakPolarHBondContact CB-OE2 3.42Å; N229-E507 PolarHBondContact ND2-OE2 3.33Å; F230-E507 HydrophobicContact CE1-CB 4.44Å; F230-E507 HydrophobicContact CZ-CB 4.38Å; F503-E507 WeakPolarHBondContact O-CB 3.17Å; F503-E507 PolarHBondContact O-N 3.38Å; E507-I509 PolarHBondContact O-N 3.22Å; E507-Y510 PolarHBondContact O-N 3.25Å; E507-M511 WeakPolarHBondContact O-CG 3.45Å; E507-M511 PolarHBondContact O-N 3.04Å
508	R	94.6	Very high	93.5	Very high	83 Å²	83	39 Å²	39	31%	0.313	21%	0.21	S	C	.	.	H	α-helix	trans	-57.1	-51.7	176.4	-171.7	-168.7	69	75.6	2.1	111.5	L477 D478 A504 E505 Y510 M511 L512	L477-R508 PolarHBondContact O-NH1 3.37Å; L477-R508 PolarHBondContact O-NH2 3.27Å; D478-R508 PolarHBondContact O-NH2 3.19Å; A504-R508 WeakPolarHBondContact O-CB 3.44Å; A504-R508 PolarHBondContact O-N 2.72Å; E505-R508 PolarHBondContact O-N 3.36Å; E505-R508 IonicContact OE1-CZ 3.14Å; E505-R508 IonicContact OE1-NE 2.68Å; E505-R508 IonicContact OE1-NH2 3.78Å; E505-R508 PolarHBondContact OE1-NH2 2.98Å; E505-R508 IonicContact OE2-CZ 3.7Å; E505-R508 IonicContact OE2-NE 2.69Å; E505-R508 PolarHBondContact OE2-NE 2.95Å; E505-R508 IonicContact OE2-NH2 3.59Å; R508-Y510 VanDerWaalsContact C-N 3.34Å; R508-Y510 PolarHBondContact O-N 3.34Å; R508-M511 PolarHBondContact O-N 3.4Å; R508-L512 VanDerWaalsContact O-CB 3.23Å; R508-L512 WeakPolarHBondContact O-CB 3.37Å; R508-L512 PolarHBondContact O-N 2.95Å
509	I	95.5	Very high	93	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.3	-42.2	179	-70.2	167.9	0	0	0	111	L455 I457 L477 F479 V484 L498 I500 E505 E507 M511 A513	L455-I509 HydrophobicContact CD1-CB 4.38Å; L455-I509 HydrophobicContact CD1-CG2 3.99Å; I457-I509 HydrophobicContact CD1-CG2 4.47Å; L477-I509 HydrophobicContact CD1-CG2 4.22Å; F479-I509 HydrophobicContact CB-CD1 3.54Å; F479-I509 HydrophobicContact CB-CG1 4.15Å; F479-I509 HydrophobicContact CG-CD1 4.37Å; V484-I509 HydrophobicContact CG2-CD1 3.69Å; L498-I509 HydrophobicContact CD2-CG2 4.32Å; I500-I509 HydrophobicContact CD1-CD1 3.95Å; E505-I509 HydrophobicContact CG-CD1 3.88Å; E505-I509 WeakPolarHBondContact O-CB 3.15Å; E505-I509 VanDerWaalsContact O-CG1 3.3Å; E505-I509 WeakPolarHBondContact O-CG1 3.39Å; E505-I509 PolarHBondContact O-N 2.87Å; E507-I509 PolarHBondContact O-N 3.22Å; I509-M511 PolarHBondContact O-N 2.97Å; I509-A513 WeakPolarHBondContact O-CB 3.28Å; I509-A513 PolarHBondContact O-N 3.23Å
510	Y	94.9	Very high	92.6	Very high	10 Å²	10	49.9 Å²	49.9	4%	0.039	28%	0.277	C	S	.	.	H	α-helix	trans	-60.2	-45.1	178.3	174	-95.4	0	0	0	112.5	F230 Q234 L455 A506 E507 R508 K514 S525 I527	F230-Y510 HydrophobicContact CD1-CD1 4.38Å; F230-Y510 AromaticContact CE1-CD1 3.95Å; F230-Y510 HydrophobicContact CE1-CD1 3.95Å; F230-Y510 HydrophobicContact CE1-CD2 4.33Å; F230-Y510 AromaticContact CE1-CG 3.77Å; F230-Y510 HydrophobicContact CE1-CG 3.77Å; Q234-Y510 WeakPolarHBondContact CB-OH 3.41Å; Q234-Y510 HydrophobicContact CG-CE1 4.11Å; Q234-Y510 VanDerWaalsContact CG-OH 3.31Å; Q234-Y510 WeakPolarHBondContact CG-OH 3.23Å; L455-Y510 HydrophobicContact CD2-CD2 4.25Å; A506-Y510 WeakPolarHBondContact O-CB 3.41Å; A506-Y510 PolarHBondContact O-N 3.42Å; E507-Y510 PolarHBondContact O-N 3.25Å; R508-Y510 VanDerWaalsContact C-N 3.34Å; R508-Y510 PolarHBondContact O-N 3.34Å; Y510-K514 HydrophobicContact CE1-CD 4.31Å; Y510-K514 VanDerWaalsContact CZ-NZ 3.29Å; Y510-K514 WeakPolarHBondContact O-CG 3.43Å; Y510-K514 WeakPolarHBondContact OH-CE 3.38Å; Y510-K514 PolarHBondContact OH-NZ 3.1Å; Y510-S525 WeakPolarHBondContact CD2-OG 3.37Å; Y510-S525 VanDerWaalsContact CE2-O 3.24Å; Y510-S525 WeakPolarHBondContact CE2-O 3.18Å; Y510-I527 HydrophobicContact CD2-CG1 4.22Å; Y510-I527 HydrophobicContact CE2-CD1 4.44Å; Y510-I527 HydrophobicContact CE2-CG1 4.1Å
511	M	93.3	Very high	92.4	Very high	71 Å²	71	55.4 Å²	55.4	35%	0.35	30%	0.301	S	S	.	.	H	α-helix	trans	-70.9	-49.4	178.9	-66.2	-62.1	-73	0	0	111.2	E507 R508 I509 A513 K514 D515	E507-M511 WeakPolarHBondContact O-CG 3.45Å; E507-M511 PolarHBondContact O-N 3.04Å; R508-M511 PolarHBondContact O-N 3.4Å; I509-M511 PolarHBondContact O-N 2.97Å; M511-A513 PolarHBondContact O-N 2.89Å; M511-K514 PolarHBondContact O-N 3.02Å; M511-K514 VanDerWaalsContact O-N 3.15Å; M511-D515 PolarHBondContact O-N 3.01Å
512	L	95.3	Very high	92.4	Very high	63 Å²	63	56.4 Å²	56.4	33%	0.33	31%	0.305	S	S	.	.	H	α-helix	trans	-59.2	-44.7	-179	-179.7	59.1	0	0	0	112.2	L477 R508 K514 D515 T516	L477-L512 HydrophobicContact CB-CD2 4.47Å; L477-L512 HydrophobicContact CD2-CD2 4.31Å; L477-L512 HydrophobicContact CD2-CG 4.1Å; R508-L512 VanDerWaalsContact O-CB 3.23Å; R508-L512 WeakPolarHBondContact O-CB 3.37Å; R508-L512 PolarHBondContact O-N 2.95Å; L512-K514 VanDerWaalsContact C-N 3.26Å; L512-K514 PolarHBondContact O-N 3.39Å; L512-D515 PolarHBondContact O-N 3.34Å; L512-D515 VanDerWaalsContact O-N 3.09Å; L512-T516 WeakPolarHBondContact O-CB 3.41Å; L512-T516 PolarHBondContact O-N 3.05Å; L512-T516 VanDerWaalsContact O-N 3.07Å; L512-T516 PolarHBondContact O-OG1 3.04Å
513	A	94.4	Very high	92.6	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-59	-38.5	178.9	0	0	0	0	0	111.9	I457 L477 I509 M511 D515 T516 L523	I457-A513 HydrophobicContact CD1-CB 3.94Å; L477-A513 HydrophobicContact CD2-CB 3.99Å; I509-A513 WeakPolarHBondContact O-CB 3.28Å; I509-A513 PolarHBondContact O-N 3.23Å; M511-A513 PolarHBondContact O-N 2.89Å; A513-D515 PolarHBondContact O-N 2.84Å; A513-T516 PolarHBondContact O-N 3.09Å; A513-T516 VanDerWaalsContact O-N 3.16Å; A513-L523 WeakPolarHBondContact O-CB 3.3Å
514	K	90.4	Very high	92.8	Very high	71 Å²	71	55.5 Å²	55.5	31%	0.309	30%	0.3	S	S	.	.	H	α-helix	trans	-65.7	-25.5	179	-74.7	-176.8	171.8	-166.6	0	114.1	Y510 M511 L512 T522	Y510-K514 HydrophobicContact CE1-CD 4.31Å; Y510-K514 VanDerWaalsContact CZ-NZ 3.29Å; Y510-K514 WeakPolarHBondContact O-CG 3.43Å; Y510-K514 WeakPolarHBondContact OH-CE 3.38Å; Y510-K514 PolarHBondContact OH-NZ 3.1Å; M511-K514 PolarHBondContact O-N 3.02Å; M511-K514 VanDerWaalsContact O-N 3.15Å; L512-K514 VanDerWaalsContact C-N 3.26Å; L512-K514 PolarHBondContact O-N 3.39Å; K514-T522 VanDerWaalsContact O-CG2 3.23Å; K514-T522 WeakPolarHBondContact O-CG2 3.38Å
515	D	92.1	Very high	93	Very high	117 Å²	117	52.7 Å²	52.7	63%	0.626	28%	0.277	S	S	*	.	H	α-helix	trans	-98.6	-1.4	179.3	-60.4	-29	0	0	0	111.8	M511 L512 A513	M511-D515 PolarHBondContact O-N 3.01Å; L512-D515 PolarHBondContact O-N 3.34Å; L512-D515 VanDerWaalsContact O-N 3.09Å; A513-D515 PolarHBondContact O-N 2.84Å
516	T	94.9	Very high	93.1	Very high	17 Å²	17	52.5 Å²	52.5	10%	0.104	28%	0.276	C	S	.	.			trans	-93.3	136.2	-179	-61.1	0	0	0	0	111.1	H476 L512 A513 I518 T522 L523	H476-T516 HydrophobicContact CB-CG2 4.01Å; L512-T516 WeakPolarHBondContact O-CB 3.41Å; L512-T516 PolarHBondContact O-N 3.05Å; L512-T516 VanDerWaalsContact O-N 3.07Å; L512-T516 PolarHBondContact O-OG1 3.04Å; A513-T516 PolarHBondContact O-N 3.09Å; A513-T516 VanDerWaalsContact O-N 3.16Å; T516-I518 HydrophobicContact CG2-CG1 4.19Å; T516-T522 WeakPolarHBondContact O-CA 3.45Å; T516-L523 HydrophobicContact CG2-CD1 3.84Å; T516-L523 HydrophobicContact CG2-CG 4.33Å; T516-L523 PolarHBondContact O-N 3.37Å
517	T	94.5	Very high	93.2	Very high	74 Å²	74	52.6 Å²	52.6	45%	0.454	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	127.7	176.2	-63.3	0	0	0	0	110.2	K521 T522	T517-K521 WeakPolarHBondContact CA-O 3.47Å; T517-T522 PolarHBondContact OG1-OG1 3.07Å
518	I	92.5	Very high	93.2	Very high	10 Å²	10	49.2 Å²	49.2	5%	0.051	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	129.7	177.8	-59.6	-178.6	0	0	0	107.7	L460 P461 H476 T516 N520 K521 L523	L460-I518 HydrophobicContact CD2-CD1 3.93Å; P461-I518 HydrophobicContact CG-CG2 4.12Å; H476-I518 HydrophobicContact CB-CD1 4.23Å; H476-I518 WeakPolarHBondContact CD2-CD1 3.24Å; T516-I518 HydrophobicContact CG2-CG1 4.19Å; I518-N520 VanDerWaalsContact C-N 3.28Å; I518-N520 PolarHBondContact O-N 3.05Å; I518-K521 PolarHBondContact N-O 2.63Å; I518-K521 PolarHBondContact O-N 3.36Å; I518-K521 VanDerWaalsContact O-O 3.12Å; I518-L523 HydrophobicContact CB-CD2 4.45Å; I518-L523 HydrophobicContact CD1-CD1 3.92Å; I518-L523 HydrophobicContact CD1-CD2 4.13Å; I518-L523 HydrophobicContact CD1-CG 4.34Å; I518-L523 HydrophobicContact CG1-CD1 4.43Å; I518-L523 HydrophobicContact CG1-CD2 4.33Å; I518-L523 HydrophobicContact CG1-CG 4.44Å
519	S	87.1	Confident	93.2	Very high	99 Å²	99	45.5 Å²	45.5	69%	0.692	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.4	45.2	-179	-53.7	0	0	0	0	113.5	K521	S519-K521 PolarHBondContact O-N 3.37Å
520	N	87.3	Confident	93.1	Very high	165 Å²	165	49 Å²	49	88%	0.882	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	16.3	-176.2	-60.8	-25.8	0	0	0	115.6	I518	I518-N520 VanDerWaalsContact C-N 3.28Å; I518-N520 PolarHBondContact O-N 3.05Å
521	K	89.4	Confident	93.1	Very high	117 Å²	117	48.9 Å²	48.9	51%	0.509	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	119.7	175.7	-167.6	173.3	179.8	-174.6	0	110.3	T517 I518 S519 L523	T517-K521 WeakPolarHBondContact CA-O 3.47Å; I518-K521 PolarHBondContact N-O 2.63Å; I518-K521 PolarHBondContact O-N 3.36Å; I518-K521 VanDerWaalsContact O-O 3.12Å; S519-K521 PolarHBondContact O-N 3.37Å; K521-L523 PolarHBondContact O-N 2.93Å
522	T	92.5	Very high	93	Very high	75 Å²	75	46.7 Å²	46.7	46%	0.46	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	132.9	174.3	-50.1	0	0	0	0	109.6	K514 T516 T517	K514-T522 VanDerWaalsContact O-CG2 3.23Å; K514-T522 WeakPolarHBondContact O-CG2 3.38Å; T516-T522 WeakPolarHBondContact O-CA 3.45Å; T517-T522 PolarHBondContact OG1-OG1 3.07Å
523	L	94.7	Very high	92.8	Very high	4 Å²	4	45.2 Å²	45.2	2%	0.021	25%	0.247	C	C	.	.			trans	-69.2	148.9	177.4	-55	179.3	0	0	0	110	I457 S458 L460 A513 T516 I518 K521	I457-L523 HydrophobicContact CG2-CD1 4.22Å; S458-L523 CarbonylContact O-C 3.53Å; S458-L523 WeakPolarHBondContact O-CA 3.48Å; L460-L523 HydrophobicContact CD2-CD1 4.47Å; L460-L523 HydrophobicContact CD2-CD2 3.83Å; L460-L523 HydrophobicContact CG-CD2 4.13Å; A513-L523 WeakPolarHBondContact O-CB 3.3Å; T516-L523 HydrophobicContact CG2-CD1 3.84Å; T516-L523 HydrophobicContact CG2-CG 4.33Å; T516-L523 PolarHBondContact O-N 3.37Å; I518-L523 HydrophobicContact CB-CD2 4.45Å; I518-L523 HydrophobicContact CD1-CD1 3.92Å; I518-L523 HydrophobicContact CD1-CD2 4.13Å; I518-L523 HydrophobicContact CD1-CG 4.34Å; I518-L523 HydrophobicContact CG1-CD1 4.43Å; I518-L523 HydrophobicContact CG1-CD2 4.33Å; I518-L523 HydrophobicContact CG1-CG 4.44Å; K521-L523 PolarHBondContact O-N 2.93Å
524	T	93.3	Very high	92.5	Very high	41 Å²	41	54.6 Å²	54.6	25%	0.252	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	132.9	171.1	-50.9	0	0	0	0	108.3	I457 S458 L526	I457-T524 CarbonylContact C-O 3.6Å; I457-T524 WeakPolarHBondContact CA-O 3.3Å; S458-T524 PolarHBondContact N-O 3.09Å; S458-T524 PolarHBondContact O-N 2.77Å; T524-L526 HydrophobicContact CG2-CD2 4.04Å; T524-L526 HydrophobicContact CG2-CG 4.04Å
525	S	95	Very high	92.4	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	122.3	172.6	-173.6	0	0	0	0	110	I457 Y510	I457-S525 WeakPolarHBondContact CD1-OG 3.45Å; Y510-S525 WeakPolarHBondContact CD2-OG 3.37Å; Y510-S525 VanDerWaalsContact CE2-O 3.24Å; Y510-S525 WeakPolarHBondContact CE2-O 3.18Å
526	L	95.6	Very high	92.2	Very high	7 Å²	7	52 Å²	52	4%	0.037	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	133.2	-179.3	-59.8	178.5	0	0	0	111	R237 L455 L456 T524 I528 N577 A582	R237-L526 HydrophobicContact CG-CB 4.44Å; R237-L526 HydrophobicContact CG-CD2 4.17Å; L455-L526 CarbonylContact C-O 3.56Å; L455-L526 WeakPolarHBondContact CA-O 3.47Å; L456-L526 PolarHBondContact N-O 2.97Å; L456-L526 PolarHBondContact O-N 3.08Å; T524-L526 HydrophobicContact CG2-CD2 4.04Å; T524-L526 HydrophobicContact CG2-CG 4.04Å; L526-I528 HydrophobicContact CB-CD1 4.24Å; L526-N577 WeakPolarHBondContact CD1-O 3.42Å; L526-A582 HydrophobicContact CD1-CB 3.64Å
527	I	95.3	Very high	91.6	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	127.5	171.3	-57.3	168.8	0	0	0	108.5	L225 F230 Q234 R237 L455 Y510	L225-I527 HydrophobicContact CD1-CG2 3.52Å; L225-I527 HydrophobicContact CD2-CG2 4.36Å; L225-I527 HydrophobicContact CG-CG2 4.44Å; F230-I527 HydrophobicContact CB-CD1 3.62Å; F230-I527 HydrophobicContact CD1-CD1 3.36Å; F230-I527 HydrophobicContact CD1-CG1 4.27Å; F230-I527 HydrophobicContact CD2-CD1 3.98Å; F230-I527 HydrophobicContact CE1-CD1 3.92Å; F230-I527 HydrophobicContact CE1-CG1 4.37Å; F230-I527 HydrophobicContact CE2-CD1 4.49Å; F230-I527 HydrophobicContact CG-CD1 3.36Å; F230-I527 HydrophobicContact CG-CG1 4.45Å; F230-I527 HydrophobicContact CZ-CD1 4.45Å; Q234-I527 HydrophobicContact CB-CD1 3.85Å; R237-I527 PolarHBondContact NH1-O 2.95Å; L455-I527 HydrophobicContact CD2-CB 4.43Å; L455-I527 HydrophobicContact CD2-CG1 3.84Å; Y510-I527 HydrophobicContact CD2-CG1 4.22Å; Y510-I527 HydrophobicContact CE2-CD1 4.44Å; Y510-I527 HydrophobicContact CE2-CG1 4.1Å
528	I	95	Very high	90.9	Very high	9 Å²	9	56.5 Å²	56.5	5%	0.046	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	125.6	-179.6	-55.6	-58	0	0	0	109.8	G454 L456 L526 A582 A586	G454-I528 PolarHBondContact O-N 3.3Å; L456-I528 HydrophobicContact CB-CD1 4.1Å; L456-I528 HydrophobicContact CB-CG1 3.74Å; L526-I528 HydrophobicContact CB-CD1 4.24Å; I528-A582 HydrophobicContact CD1-CB 4.02Å; I528-A586 HydrophobicContact CG2-CB 3.85Å
529	P	94.5	Very high	90.4	Very high	4 Å²	4	60.5 Å²	60.5	3%	0.026	34%	0.34	C	S	.	.			trans	-74.9	157.5	174.8	35.2	-38.1	0	0	0	111.7	V223 L225 H570	V223-P529 HydrophobicContact CG1-CB 3.67Å; V223-P529 HydrophobicContact CG1-CG 4.37Å; L225-P529 HydrophobicContact CB-CB 4.45Å; L225-P529 HydrophobicContact CD1-CB 4.22Å; P529-H570 HydrophobicContact CG-CB 4.16Å
530	E	92.4	Very high	90.5	Very high	74 Å²	74	57.2 Å²	57.2	35%	0.346	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	131.5	167.8	-172.9	-163.8	162.8	0	0	109.4	R224	R224-E530 HydrophobicContact CB-CB 4.34Å; R224-E530 WeakPolarHBondContact CD-OE2 3.18Å; R224-E530 IonicContact CZ-OE2 2.61Å; R224-E530 PolarHBondContact N-O 2.93Å; R224-E530 IonicContact NE-OE2 2.81Å; R224-E530 VanDerWaalsContact NH1-CD 3.29Å; R224-E530 IonicContact NH1-OE1 3.7Å; R224-E530 PolarHBondContact NH1-OE1 3.39Å; R224-E530 VanDerWaalsContact NH1-OE1 3.09Å; R224-E530 IonicContact NH1-OE2 3.22Å; R224-E530 PolarHBondContact NH1-OE2 2.97Å; R224-E530 PolarHBondContact O-N 3.46Å
531	I	94.9	Very high	90.8	Very high	8 Å²	8	51.2 Å²	51.2	4%	0.041	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	114.9	175.1	-58.7	179.5	0	0	0	108.8	L218 C222 C533 L536 A586 F587 V590	L218-I531 HydrophobicContact CD1-CG2 3.96Å; L218-I531 HydrophobicContact CD2-CD1 3.96Å; L218-I531 HydrophobicContact CD2-CG1 4.25Å; C222-I531 CarbonylContact O-C 3.55Å; C222-I531 WeakPolarHBondContact O-CA 3.31Å; I531-C533 VanDerWaalsContact C-N 3.32Å; I531-C533 PolarHBondContact O-N 3.35Å; I531-C533 PolarHBondContact O-SG 3.46Å; I531-C533 VanDerWaalsContact O-SG 3.41Å; I531-L536 HydrophobicContact CG2-CD1 4.05Å; I531-A586 WeakPolarHBondContact CD1-O 3.11Å; I531-F587 HydrophobicContact CD1-CD2 3.67Å; I531-F587 HydrophobicContact CD1-CE2 3.74Å; I531-F587 HydrophobicContact CD1-CG 4.13Å; I531-F587 HydrophobicContact CD1-CZ 4.28Å; I531-V590 HydrophobicContact CB-CG2 4.3Å; I531-V590 HydrophobicContact CD1-CG2 3.91Å; I531-V590 HydrophobicContact CG2-CG2 3.9Å
532	Q	91.6	Very high	91.1	Very high	25 Å²	25	45.7 Å²	45.7	12%	0.117	26%	0.263	C	S	.	.			trans	-76.9	81.2	179	-54.6	-157.6	-82.7	0	0	110.5	C222 R224 Q534 K535	C222-Q532 PolarHBondContact O-N 2.94Å; R224-Q532 HydrophobicContact CB-CG 4.44Å; Q532-Q534 PolarHBondContact O-N 3.28Å; Q532-Q534 VanDerWaalsContact O-N 3.12Å; Q532-K535 HydrophobicContact CB-CB 4.39Å; Q532-K535 HydrophobicContact CB-CD 4.11Å; Q532-K535 HydrophobicContact CB-CG 4.24Å; Q532-K535 WeakPolarHBondContact O-CB 3.47Å; Q532-K535 PolarHBondContact O-N 3.5Å; Q532-K535 VanDerWaalsContact OE1-CE 3.25Å
533	C	91.1	Very high	91.4	Very high	31 Å²	31	42.2 Å²	42.2	21%	0.209	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-59.8	-28.3	-172.4	-62.4	0	0	0	0	113.6	I531 K535 L536 E589	I531-C533 VanDerWaalsContact C-N 3.32Å; I531-C533 PolarHBondContact O-N 3.35Å; I531-C533 PolarHBondContact O-SG 3.46Å; I531-C533 VanDerWaalsContact O-SG 3.41Å; C533-K535 PolarHBondContact O-N 2.96Å; C533-L536 WeakPolarHBondContact O-CB 3.46Å; C533-L536 PolarHBondContact O-N 3.48Å; C533-L536 VanDerWaalsContact O-N 3.12Å; C533-E589 VanDerWaalsContact SG-C 3.54Å; C533-E589 PolarHBondContact SG-O 2.85Å; C533-E589 VanDerWaalsContact SG-O 3.4Å
534	Q	89.3	Confident	91.6	Very high	197 Å²	197	42 Å²	42	92%	0.921	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-64	-23.1	175.6	-59.2	161.2	14.8	0	0	113.2	Q532	Q532-Q534 PolarHBondContact O-N 3.28Å; Q532-Q534 VanDerWaalsContact O-N 3.12Å
535	K	87.9	Confident	91.8	Very high	110 Å²	110	40 Å²	40	48%	0.478	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-92.7	-9.5	177.4	-64.2	-175.7	175.9	177.9	0	112.8	P221 C222 Q532 C533 G537	P221-K535 WeakPolarHBondContact O-CD 3.39Å; C222-K535 PolarHBondContact SG-O 2.87Å; C222-K535 VanDerWaalsContact SG-O 3.39Å; Q532-K535 HydrophobicContact CB-CB 4.39Å; Q532-K535 HydrophobicContact CB-CD 4.11Å; Q532-K535 HydrophobicContact CB-CG 4.24Å; Q532-K535 WeakPolarHBondContact O-CB 3.47Å; Q532-K535 PolarHBondContact O-N 3.5Å; Q532-K535 VanDerWaalsContact OE1-CE 3.25Å; C533-K535 PolarHBondContact O-N 2.96Å; K535-G537 PolarHBondContact O-N 3.29Å
536	L	87.2	Confident	92	Very high	23 Å²	23	40 Å²	40	12%	0.12	23%	0.228	C	C	.	.	S	Bend	trans	-75.1	120	172.9	-67.7	172.3	0	0	0	108.1	L218 C222 I531 C533 V540 P542 V590	L218-L536 HydrophobicContact CD1-CD2 3.93Å; C222-L536 HydrophobicContact CB-CD2 3.91Å; C222-L536 HydrophobicContact CB-CG 4.39Å; I531-L536 HydrophobicContact CG2-CD1 4.05Å; C533-L536 WeakPolarHBondContact O-CB 3.46Å; C533-L536 PolarHBondContact O-N 3.48Å; C533-L536 VanDerWaalsContact O-N 3.12Å; L536-V540 HydrophobicContact CD2-CG1 4.37Å; L536-P542 HydrophobicContact CD1-CG 4.35Å; L536-P542 HydrophobicContact CD2-CG 4.23Å; L536-V590 HydrophobicContact CD1-CG1 4.18Å
537	G	82.5	Confident	92.1	Very high	42 Å²	42	39.7 Å²	39.7	43%	0.433	23%	0.226	S	C	.	.			trans	-67.2	153.6	174.6	0	0	0	0	0	112	K535 A539 V540	K535-G537 PolarHBondContact O-N 3.29Å; G537-A539 PolarHBondContact O-N 3.38Å; G537-V540 WeakPolarHBondContact O-CB 3.46Å; G537-V540 PolarHBondContact O-N 3.15Å
538	D	80.3	Confident	92.1	Very high	144 Å²	144	40.9 Å²	40.9	77%	0.77	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-19.9	-177	-65.9	-35.1	0	0	0	114.5	R592	D538-R592 PolarHBondContact O-NH2 2.93Å
539	A	81.6	Confident	92	Very high	95 Å²	95	41.2 Å²	41.2	79%	0.785	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-6	177.2	0	0	0	0	0	113.6	G537	G537-A539 PolarHBondContact O-N 3.38Å
540	V	88.3	Confident	91.6	Very high	30 Å²	30	48.5 Å²	48.5	18%	0.182	27%	0.267	C	S	.	.			trans	-92.4	127.5	-177	-171.5	0	0	0	0	109.7	S215 L536 G537 P542	S215-V540 WeakPolarHBondContact O-CG1 3.43Å; L536-V540 HydrophobicContact CD2-CG1 4.37Å; G537-V540 WeakPolarHBondContact O-CB 3.46Å; G537-V540 PolarHBondContact O-N 3.15Å; V540-P542 HydrophobicContact CG1-CG 3.94Å
541	C	94	Very high	91.3	Very high	39 Å²	39	46 Å²	46	26%	0.264	26%	0.257	S	S	.	.			trans	-126.2	84.4	171.8	-172	0	0	0	0	108.1	S215 M216	S215-C541 CarbonylContact O-C 3.53Å; S215-C541 VanDerWaalsContact O-C 3.27Å; S215-C541 PolarHBondContact O-N 3.09Å; M216-C541 WeakPolarHBondContact CA-O 3.47Å
542	P	96.5	Very high	90.7	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.006	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-56.9	145.2	-173.6	-24.6	35.1	0	0	0	112.1	M216 L536 V540 F587 R592 F593 R594	M216-P542 CarbonylContact O-C 3.54Å; M216-P542 WeakPolarHBondContact O-CA 3.35Å; L536-P542 HydrophobicContact CD1-CG 4.35Å; L536-P542 HydrophobicContact CD2-CG 4.23Å; V540-P542 HydrophobicContact CG1-CG 3.94Å; P542-F587 HydrophobicContact CB-CE1 3.91Å; P542-F587 HydrophobicContact CB-CZ 4.46Å; P542-R592 WeakPolarHBondContact CD-O 3.39Å; P542-F593 VanDerWaalsContact O-CA 3.29Å; P542-F593 WeakPolarHBondContact O-CA 3.46Å; P542-F593 WeakPolarHBondContact O-CB 3.18Å; P542-R594 PolarHBondContact O-N 3.24Å
543	L	98.4	Very high	90	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	129.5	172.8	-175	67.5	0	0	0	109.9	M216 V545 L567 Q571 R594 L596 L655 V658	M216-L543 HydrophobicContact CB-CB 4Å; M216-L543 PolarHBondContact O-N 3.06Å; M216-L543 HydrophobicContact SD-CD2 4.25Å; L543-V545 HydrophobicContact CD2-CG2 3.72Å; L543-V545 HydrophobicContact CG-CG2 3.78Å; L543-L567 HydrophobicContact CD2-CD1 4.21Å; L543-Q571 WeakPolarHBondContact O-CB 3.33Å; L543-Q571 PolarHBondContact O-NE2 3.28Å; L543-R594 CarbonylContact C-O 3.53Å; L543-R594 WeakPolarHBondContact CA-O 3.23Å; L543-R594 HydrophobicContact CD1-CB 3.84Å; L543-L596 HydrophobicContact CD1-CB 4Å; L543-L596 HydrophobicContact CD2-CB 4.16Å; L543-L596 HydrophobicContact CD2-CD2 4.29Å; L543-L596 HydrophobicContact CG-CB 4.3Å; L543-L655 HydrophobicContact CD2-CD2 3.63Å; L543-V658 HydrophobicContact CD1-CG1 3.87Å; L543-V658 HydrophobicContact CD2-CG1 4.23Å
544	L	98.6	Very high	89.5	Confident	0 Å²	0	51 Å²	51	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	121.8	167.7	174.1	58.9	0	0	0	108.7	F546 F573 L584 F587 F593 R594 V595 L596	L544-F546 HydrophobicContact CD1-CE1 4.46Å; L544-F546 HydrophobicContact CD1-CZ 4.18Å; L544-F546 HydrophobicContact CD2-CE2 3.74Å; L544-F546 HydrophobicContact CD2-CZ 3.62Å; L544-F546 HydrophobicContact CG-CE2 3.85Å; L544-F546 HydrophobicContact CG-CZ 3.87Å; L544-F573 HydrophobicContact CD1-CD2 3.5Å; L544-F573 HydrophobicContact CD1-CE2 3.55Å; L544-L584 HydrophobicContact CD2-CD2 4.13Å; L544-F587 HydrophobicContact CB-CD1 4.17Å; L544-F587 HydrophobicContact CB-CE1 3.95Å; L544-F587 HydrophobicContact CB-CE2 4.47Å; L544-F587 HydrophobicContact CB-CG 4.49Å; L544-F587 HydrophobicContact CB-CZ 4.12Å; L544-F587 HydrophobicContact CD1-CD2 4.03Å; L544-F587 HydrophobicContact CD1-CE2 3.91Å; L544-F587 HydrophobicContact CD1-CZ 4.32Å; L544-F587 HydrophobicContact CD2-CB 4.4Å; L544-F587 HydrophobicContact CD2-CD2 4.43Å; L544-F587 HydrophobicContact CD2-CG 4.26Å; L544-F593 HydrophobicContact CB-CD2 4.18Å; L544-F593 HydrophobicContact CB-CE2 4.45Å; L544-F593 HydrophobicContact CD2-CE2 4.03Å; L544-R594 PolarHBondContact N-O 3.48Å; L544-V595 HydrophobicContact CB-CG2 4.39Å; L544-V595 HydrophobicContact CD2-CG2 4.44Å; L544-V595 CarbonylContact O-C 3.58Å; L544-V595 VanDerWaalsContact O-CA 3.24Å; L544-V595 WeakPolarHBondContact O-CA 3.27Å; L544-L596 PolarHBondContact O-N 3.31Å
545	V	98.7	Very high	89.4	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	122.7	-174.5	-172.9	0	0	0	0	110.2	L543 V547 F563 L567 Q571 V572 F573 L596	L543-V545 HydrophobicContact CD2-CG2 3.72Å; L543-V545 HydrophobicContact CG-CG2 3.78Å; V545-V547 HydrophobicContact CG1-CG2 3.82Å; V545-F563 HydrophobicContact CG1-CD2 3.87Å; V545-F563 HydrophobicContact CG1-CE2 4.34Å; V545-F563 HydrophobicContact CG1-CG 4.46Å; V545-L567 HydrophobicContact CG2-CD1 3.55Å; V545-Q571 PolarHBondContact N-O 3.5Å; V545-V572 HydrophobicContact CB-CG1 4.35Å; V545-V572 HydrophobicContact CB-CG2 4.38Å; V545-V572 HydrophobicContact CG1-CG1 4.43Å; V545-F573 PolarHBondContact O-N 2.7Å; V545-L596 CarbonylContact C-O 3.56Å; V545-L596 WeakPolarHBondContact CA-O 3.4Å; V545-L596 HydrophobicContact CG1-CB 4.39Å; V545-L596 HydrophobicContact CG1-CD2 4.36Å; V545-L596 HydrophobicContact CG2-CB 4.28Å
546	F	98.6	Very high	89.6	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	128.8	168.9	-64.1	-66.7	0	0	0	109.7	L544 F573 I575 P580 L584 V595 L596 C598 V607	L544-F546 HydrophobicContact CD1-CE1 4.46Å; L544-F546 HydrophobicContact CD1-CZ 4.18Å; L544-F546 HydrophobicContact CD2-CE2 3.74Å; L544-F546 HydrophobicContact CD2-CZ 3.62Å; L544-F546 HydrophobicContact CG-CE2 3.85Å; L544-F546 HydrophobicContact CG-CZ 3.87Å; F546-F573 HydrophobicContact CD1-CB 3.73Å; F546-F573 HydrophobicContact CE1-CB 3.91Å; F546-F573 HydrophobicContact CE1-CG 4.25Å; F546-I575 HydrophobicContact CB-CD1 4.48Å; F546-P580 HydrophobicContact CD1-CB 4.22Å; F546-P580 VanDerWaalsContact CE1-CA 3.49Å; F546-P580 HydrophobicContact CE1-CB 3.91Å; F546-P580 WeakPolarHBondContact CE1-O 3.34Å; F546-P580 HydrophobicContact CE2-CB 4.29Å; F546-P580 HydrophobicContact CZ-CB 3.93Å; F546-P580 VanDerWaalsContact CZ-O 3.23Å; F546-P580 WeakPolarHBondContact CZ-O 3.3Å; F546-L584 HydrophobicContact CZ-CG 4.18Å; F546-V595 HydrophobicContact CD2-CG1 3.74Å; F546-V595 HydrophobicContact CE2-CG1 3.89Å; F546-L596 PolarHBondContact N-O 3.04Å; F546-C598 PolarHBondContact O-N 3.39Å; F546-V607 HydrophobicContact CB-CG2 4.49Å; F546-V607 HydrophobicContact CD2-CG1 4.1Å; F546-V607 HydrophobicContact CD2-CG2 4.14Å; F546-V607 HydrophobicContact CE2-CG1 4.2Å; F546-V607 HydrophobicContact CG-CG2 4.41Å
547	V	97.8	Very high	89.8	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	129.1	178.1	-171.6	0	0	0	0	109.7	V545 P549 G556 L560 F563 V572 F573 I575 C598	V545-V547 HydrophobicContact CG1-CG2 3.82Å; V547-P549 VanDerWaalsContact O-CD 3.24Å; V547-P549 WeakPolarHBondContact O-CD 3.19Å; V547-G556 WeakPolarHBondContact CG1-O 3.49Å; V547-L560 HydrophobicContact CB-CB 4.21Å; V547-L560 HydrophobicContact CB-CD1 4.12Å; V547-L560 HydrophobicContact CG1-CB 3.93Å; V547-L560 HydrophobicContact CG2-CB 4.47Å; V547-L560 HydrophobicContact CG2-CD1 4.18Å; V547-F563 HydrophobicContact CG2-CD2 4.21Å; V547-V572 HydrophobicContact CG2-CG1 4.38Å; V547-F573 PolarHBondContact N-O 3.07Å; V547-I575 PolarHBondContact O-N 3.45Å; V547-C598 HydrophobicContact CB-CB 4.3Å; V547-C598 HydrophobicContact CG1-CB 4.01Å; V547-C598 HydrophobicContact CG2-CB 4.16Å
548	N	95	Very high	90.1	Very high	26 Å²	26	48 Å²	48	14%	0.139	27%	0.265	C	S	.	.			trans	-90	101.8	165.8	-174.7	-20.8	0	0	0	109.3	K550 S551 I575 C598 T603	N548-K550 PolarHBondContact O-N 2.88Å; N548-K550 PolarHBondContact OD1-N 3.16Å; N548-K550 VanDerWaalsContact OD1-N 3.15Å; N548-S551 VanDerWaalsContact CG-OG 3.24Å; N548-S551 PolarHBondContact ND2-OG 2.94Å; N548-S551 PolarHBondContact O-N 3.49Å; N548-S551 VanDerWaalsContact O-N 3.14Å; N548-I575 HydrophobicContact CB-CG2 3.83Å; N548-C598 PolarHBondContact N-O 2.8Å; N548-T603 HydrophobicContact CB-CG2 4.1Å; N548-T603 PolarHBondContact ND2-OG1 3.43Å
549	P	91.8	Very high	90.8	Very high	15 Å²	15	41.1 Å²	41.1	10%	0.097	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-23.6	-175.1	28.2	-38	0	0	0	113.5	V547 S551 R557 L560 D574 T576	V547-P549 VanDerWaalsContact O-CD 3.24Å; V547-P549 WeakPolarHBondContact O-CD 3.19Å; P549-S551 VanDerWaalsContact C-N 3.34Å; P549-R557 HydrophobicContact CB-CB 4.14Å; P549-R557 PolarHBondContact O-N 3.47Å; P549-L560 HydrophobicContact CB-CD2 4.47Å; P549-D574 WeakPolarHBondContact CD-OD1 3.35Å; P549-D574 WeakPolarHBondContact CG-OD1 3.48Å; P549-T576 HydrophobicContact CG-CG2 4.07Å
550	K	86.9	Confident	91.4	Very high	158 Å²	158	36.9 Å²	36.9	69%	0.687	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-17	179.7	-60.6	-175.8	180	-177.6	0	112.9	N548	N548-K550 PolarHBondContact O-N 2.88Å; N548-K550 PolarHBondContact OD1-N 3.16Å; N548-K550 VanDerWaalsContact OD1-N 3.15Å
551	S	86.3	Confident	91.6	Very high	20 Å²	20	36.5 Å²	36.5	14%	0.14	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	153.6	-176.4	-70.3	0	0	0	0	113.3	N548 P549 G553 G556	N548-S551 VanDerWaalsContact CG-OG 3.24Å; N548-S551 PolarHBondContact ND2-OG 2.94Å; N548-S551 PolarHBondContact O-N 3.49Å; N548-S551 VanDerWaalsContact O-N 3.14Å; P549-S551 VanDerWaalsContact C-N 3.34Å; S551-G553 PolarHBondContact O-N 3.28Å; S551-G556 PolarHBondContact O-N 3.34Å
552	G	81.6	Confident	91.5	Very high	18 Å²	18	36.1 Å²	36.1	19%	0.186	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.1	25.1	172.4	0	0	0	0	0	115.4	K555 L630	G552-K555 WeakPolarHBondContact O-CB 3.23Å; G552-K555 WeakPolarHBondContact O-CD 3.23Å; G552-K555 WeakPolarHBondContact O-CG 3.46Å; G552-L630 WeakPolarHBondContact CA-O 3.25Å; G552-L630 PolarHBondContact N-O 3.21Å
553	G	78.2	Confident	91.5	Very high	39 Å²	39	36 Å²	36	40%	0.402	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.6	50.8	-176	0	0	0	0	0	111.8	S551 K555 T724	S551-G553 PolarHBondContact O-N 3.28Å; G553-K555 PolarHBondContact O-N 3.25Å; G553-T724 VanDerWaalsContact CA-O 3.3Å; G553-T724 WeakPolarHBondContact CA-O 3.25Å; G553-T724 PolarHBondContact N-O 3.02Å
554	L	79.1	Confident	91.3	Very high	114 Å²	114	36.2 Å²	36.2	60%	0.597	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.6	-1.2	-175.6	-52.9	175.9	0	0	0	116.3	G556 R557 E558	L554-G556 PolarHBondContact O-N 2.85Å; L554-R557 WeakPolarHBondContact O-CB 3.45Å; L554-R557 PolarHBondContact O-N 3.31Å; L554-E558 PolarHBondContact O-N 3.01Å
555	K	88.4	Confident	91	Very high	59 Å²	59	38 Å²	38	26%	0.257	19%	0.194	S	C	.	.	H	α-helix	trans	-57.3	-30.4	170.8	-70.4	-179.6	179.6	-170.3	0	112.9	G552 G553 R557 E558 L559 L630 Y646	G552-K555 WeakPolarHBondContact O-CB 3.23Å; G552-K555 WeakPolarHBondContact O-CD 3.23Å; G552-K555 WeakPolarHBondContact O-CG 3.46Å; G553-K555 PolarHBondContact O-N 3.25Å; K555-R557 VanDerWaalsContact C-N 3.29Å; K555-R557 PolarHBondContact O-N 2.92Å; K555-E558 PolarHBondContact O-N 3.32Å; K555-L559 PolarHBondContact O-N 2.79Å; K555-L630 HydrophobicContact CB-CD2 4.24Å; K555-Y646 HydrophobicContact CB-CD1 4.2Å; K555-Y646 HydrophobicContact CB-CE1 4.39Å; K555-Y646 HydrophobicContact CD-CD1 4Å; K555-Y646 HydrophobicContact CD-CE1 4.47Å; K555-Y646 PolarHBondContact NZ-O 2.99Å; K555-Y646 VanDerWaalsContact NZ-O 3.12Å
556	G	92.3	Very high	90.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-57.9	-41.3	172.9	0	0	0	0	0	112.4	V547 S551 L554 E558 L559 L560	V547-G556 WeakPolarHBondContact CG1-O 3.49Å; S551-G556 PolarHBondContact O-N 3.34Å; L554-G556 PolarHBondContact O-N 2.85Å; G556-E558 PolarHBondContact O-N 3.17Å; G556-L559 PolarHBondContact O-N 2.86Å; G556-L560 WeakPolarHBondContact O-CB 3.48Å; G556-L560 PolarHBondContact O-N 2.83Å
557	R	90.4	Very high	90.6	Very high	125 Å²	125	39.1 Å²	39.1	47%	0.472	20%	0.2	S	C	.	.	H	α-helix	trans	-65.4	-38.2	177.6	-168.6	174.9	-171.1	167	3.3	112.1	P549 L554 K555 L560 H561	P549-R557 HydrophobicContact CB-CB 4.14Å; P549-R557 PolarHBondContact O-N 3.47Å; L554-R557 WeakPolarHBondContact O-CB 3.45Å; L554-R557 PolarHBondContact O-N 3.31Å; K555-R557 VanDerWaalsContact C-N 3.29Å; K555-R557 PolarHBondContact O-N 2.92Å; R557-L560 PolarHBondContact O-N 3.07Å; R557-H561 PolarHBondContact O-N 2.91Å; R557-H561 PolarHBondContact O-ND1 3.12Å
558	E	89.9	Confident	90.5	Very high	123 Å²	123	39.1 Å²	39.1	58%	0.575	20%	0.2	S	C	*	.	H	α-helix	trans	-65.7	-41.8	175	-61	-173.3	158.4	0	0	112.3	L554 K555 G556 H561 S562	L554-E558 PolarHBondContact O-N 3.01Å; K555-E558 PolarHBondContact O-N 3.32Å; G556-E558 PolarHBondContact O-N 3.17Å; E558-H561 PolarHBondContact O-N 3.25Å; E558-S562 WeakPolarHBondContact O-CB 3.31Å; E558-S562 PolarHBondContact O-N 3.35Å; E558-S562 PolarHBondContact O-OG 2.96Å
559	L	94.9	Very high	90.5	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-63.8	-41.9	174.5	-79.5	170.7	0	0	0	112.1	K555 G556 H561 S562 F563 V628 L630 Y646 P651 I654	K555-L559 PolarHBondContact O-N 2.79Å; G556-L559 PolarHBondContact O-N 2.86Å; L559-H561 PolarHBondContact O-N 3.37Å; L559-S562 PolarHBondContact O-N 2.82Å; L559-S562 VanDerWaalsContact O-N 3.16Å; L559-F563 HydrophobicContact CB-CD2 4.35Å; L559-F563 HydrophobicContact CB-CE2 4.11Å; L559-F563 HydrophobicContact CD2-CE2 3.91Å; L559-F563 HydrophobicContact CD2-CZ 3.91Å; L559-F563 HydrophobicContact CG-CE2 4.49Å; L559-F563 VanDerWaalsContact O-CD2 3.32Å; L559-F563 WeakPolarHBondContact O-CD2 3.31Å; L559-F563 WeakPolarHBondContact O-CG 3.3Å; L559-F563 PolarHBondContact O-N 2.73Å; L559-V628 HydrophobicContact CD1-CG1 3.88Å; L559-L630 HydrophobicContact CD1-CD1 4.02Å; L559-L630 HydrophobicContact CD1-CD2 3.85Å; L559-L630 HydrophobicContact CD1-CG 4.34Å; L559-Y646 HydrophobicContact CD1-CD1 3.88Å; L559-Y646 HydrophobicContact CD1-CE1 3.73Å; L559-Y646 HydrophobicContact CD1-CG 4.45Å; L559-Y646 HydrophobicContact CD2-CE1 4.05Å; L559-Y646 HydrophobicContact CD2-CE2 4.41Å; L559-Y646 HydrophobicContact CG-CD1 4.48Å; L559-Y646 HydrophobicContact CG-CE1 3.83Å; L559-P651 HydrophobicContact CD2-CB 4.37Å; L559-P651 HydrophobicContact CD2-CG 4.05Å; L559-I654 HydrophobicContact CD2-CD1 4.08Å
560	L	94.5	Very high	90.7	Very high	5 Å²	5	37.1 Å²	37.1	3%	0.026	19%	0.189	C	C	.	.	H	α-helix	trans	-55.7	-50.2	176.4	178.4	60.4	0	0	0	111.3	V547 P549 G556 R557 S562 R564 V572 D574	V547-L560 HydrophobicContact CB-CB 4.21Å; V547-L560 HydrophobicContact CB-CD1 4.12Å; V547-L560 HydrophobicContact CG1-CB 3.93Å; V547-L560 HydrophobicContact CG2-CB 4.47Å; V547-L560 HydrophobicContact CG2-CD1 4.18Å; P549-L560 HydrophobicContact CB-CD2 4.47Å; G556-L560 WeakPolarHBondContact O-CB 3.48Å; G556-L560 PolarHBondContact O-N 2.83Å; R557-L560 PolarHBondContact O-N 3.07Å; L560-S562 PolarHBondContact O-N 3.13Å; L560-R564 WeakPolarHBondContact O-CG 3.49Å; L560-R564 PolarHBondContact O-N 2.77Å; L560-V572 HydrophobicContact CD1-CG1 3.68Å; L560-D574 HydrophobicContact CD2-CB 4.03Å
561	H	91.6	Very high	91.2	Very high	22 Å²	22	29.6 Å²	29.6	10%	0.102	16%	0.156	C	C	.	.	H	α-helix	trans	-60.6	-45.1	175.5	-61.2	135.3	0	0	0	111.8	R123 E125 R557 E558 L559 F563 R564 K565	R123-H561 PolarHBondContact NH2-CE1 2.64Å; R123-H561 VanDerWaalsContact NH2-CE1 3.26Å; R123-H561 PolarHBondContact NH2-ND1 2.85Å; R123-H561 VanDerWaalsContact NH2-ND1 3.18Å; E125-H561 VanDerWaalsContact CD-CD2 3.46Å; E125-H561 IonicContact OE1-NE2 3.81Å; E125-H561 IonicContact OE2-CD2 2.91Å; E125-H561 PolarHBondContact OE2-CD2 3.35Å; E125-H561 VanDerWaalsContact OE2-CD2 3.22Å; E125-H561 IonicContact OE2-NE2 2.76Å; R557-H561 PolarHBondContact O-N 2.91Å; R557-H561 PolarHBondContact O-ND1 3.12Å; E558-H561 PolarHBondContact O-N 3.25Å; L559-H561 PolarHBondContact O-N 3.37Å; H561-F563 PolarHBondContact O-N 3.12Å; H561-R564 PolarHBondContact O-N 3.34Å; H561-K565 PolarHBondContact O-N 3.49Å; H561-K565 VanDerWaalsContact O-N 3.12Å
562	S	92.9	Very high	91.7	Very high	31 Å²	31	28.7 Å²	28.7	22%	0.217	15%	0.149	C	C	.	.	H	α-helix	trans	-64.7	-40.8	-177.2	-56.8	0	0	0	0	112.2	E558 L559 L560 K565 L566	E558-S562 WeakPolarHBondContact O-CB 3.31Å; E558-S562 PolarHBondContact O-N 3.35Å; E558-S562 PolarHBondContact O-OG 2.96Å; L559-S562 PolarHBondContact O-N 2.82Å; L559-S562 VanDerWaalsContact O-N 3.16Å; L560-S562 PolarHBondContact O-N 3.13Å; S562-K565 WeakPolarHBondContact O-CB 3.24Å; S562-K565 PolarHBondContact O-N 3.03Å; S562-L566 WeakPolarHBondContact O-CG 3.39Å; S562-L566 PolarHBondContact O-N 3.32Å
563	F	96.3	Very high	92.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-72.2	-34.4	177.1	-67.4	-40.7	0	0	0	112.7	V545 V547 L559 H561 K565 L566 L567 V572 L596 P651 I654 L655	V545-F563 HydrophobicContact CG1-CD2 3.87Å; V545-F563 HydrophobicContact CG1-CE2 4.34Å; V545-F563 HydrophobicContact CG1-CG 4.46Å; V547-F563 HydrophobicContact CG2-CD2 4.21Å; L559-F563 HydrophobicContact CB-CD2 4.35Å; L559-F563 HydrophobicContact CB-CE2 4.11Å; L559-F563 HydrophobicContact CD2-CE2 3.91Å; L559-F563 HydrophobicContact CD2-CZ 3.91Å; L559-F563 HydrophobicContact CG-CE2 4.49Å; L559-F563 VanDerWaalsContact O-CD2 3.32Å; L559-F563 WeakPolarHBondContact O-CD2 3.31Å; L559-F563 WeakPolarHBondContact O-CG 3.3Å; L559-F563 PolarHBondContact O-N 2.73Å; H561-F563 PolarHBondContact O-N 3.12Å; F563-K565 PolarHBondContact O-N 3.34Å; F563-L566 PolarHBondContact O-N 3.25Å; F563-L567 WeakPolarHBondContact O-CB 3.35Å; F563-L567 PolarHBondContact O-N 3.43Å; F563-V572 HydrophobicContact CB-CG1 4.01Å; F563-V572 HydrophobicContact CB-CG2 4.08Å; F563-L596 HydrophobicContact CE2-CD2 4.32Å; F563-L596 HydrophobicContact CZ-CD2 4.12Å; F563-P651 HydrophobicContact CD1-CB 4.27Å; F563-P651 HydrophobicContact CE1-CB 3.83Å; F563-P651 HydrophobicContact CZ-CB 4.47Å; F563-I654 HydrophobicContact CZ-CD1 4.44Å; F563-I654 HydrophobicContact CZ-CG2 4.35Å; F563-L655 HydrophobicContact CD1-CD1 4.09Å; F563-L655 HydrophobicContact CD1-CD2 4.04Å; F563-L655 HydrophobicContact CD1-CG 4.15Å; F563-L655 HydrophobicContact CE1-CD1 4.24Å; F563-L655 HydrophobicContact CE1-CD2 3.8Å; F563-L655 HydrophobicContact CE1-CG 3.82Å
564	R	94.1	Very high	93.3	Very high	5 Å²	5	27.6 Å²	27.6	2%	0.019	13%	0.13	C	C	.	.	H	α-helix	trans	-61.9	-30.3	171.1	-75.9	174.2	173.8	157.3	1.7	112.8	E125 L560 H561 L567 V572	E125-R564 IonicContact OE2-CZ 3.54Å; E125-R564 IonicContact OE2-NH1 3.82Å; E125-R564 PolarHBondContact OE2-NH1 3Å; L560-R564 WeakPolarHBondContact O-CG 3.49Å; L560-R564 PolarHBondContact O-N 2.77Å; H561-R564 PolarHBondContact O-N 3.34Å; R564-L567 VanDerWaalsContact O-O 3.11Å; R564-V572 HydrophobicContact CG-CB 4.04Å; R564-V572 HydrophobicContact CG-CG1 4.09Å
565	K	90.9	Very high	94	Very high	37 Å²	37	22.2 Å²	22.2	16%	0.161	10%	0.102	C	C	.	.	H	α-helix	trans	-74.2	-44.2	171.9	-175.8	-152.8	-172.4	167.7	0	112.5	E128 R144 H561 S562 F563	E128-K565 VanDerWaalsContact CD-CE 3.43Å; E128-K565 VanDerWaalsContact CD-NZ 3.31Å; E128-K565 HydrophobicContact CG-CB 4.47Å; E128-K565 HydrophobicContact CG-CD 3.88Å; E128-K565 HydrophobicContact CG-CG 4Å; E128-K565 WeakPolarHBondContact OE1-CD 3.37Å; E128-K565 IonicContact OE1-NZ 2.66Å; E128-K565 WeakPolarHBondContact OE2-CE 3.3Å; E128-K565 IonicContact OE2-NZ 2.88Å; E128-K565 PolarHBondContact OE2-NZ 3.01Å; R144-K565 PolarHBondContact NH1-O 3.48Å; H561-K565 PolarHBondContact O-N 3.49Å; H561-K565 VanDerWaalsContact O-N 3.12Å; S562-K565 WeakPolarHBondContact O-CB 3.24Å; S562-K565 PolarHBondContact O-N 3.03Å; F563-K565 PolarHBondContact O-N 3.34Å
566	L	93.4	Very high	94.1	Very high	23 Å²	23	22.7 Å²	22.7	12%	0.12	11%	0.109	C	C	.	.	H	α-helix	trans	-80.7	-37.7	-173	-68	175.4	0	0	0	113.1	L213 S562 F563 P651 Y652 L655	L213-L566 HydrophobicContact CD1-CB 4.49Å; S562-L566 WeakPolarHBondContact O-CG 3.39Å; S562-L566 PolarHBondContact O-N 3.32Å; F563-L566 PolarHBondContact O-N 3.25Å; L566-P651 HydrophobicContact CD1-CB 3.85Å; L566-Y652 HydrophobicContact CD2-CD2 4.27Å; L566-L655 HydrophobicContact CB-CD1 3.93Å; L566-L655 HydrophobicContact CD1-CD1 4.01Å
567	L	95.8	Very high	93.9	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.122	C	C	.	.	S	Bend	trans	-105.1	176.8	-179.3	-59.6	174.8	0	0	0	110.6	R144 M216 L543 V545 F563 R564 V572 L655	R144-L567 PolarHBondContact NH1-O 3.22Å; M216-L567 HydrophobicContact CG-CD2 4.36Å; M216-L567 HydrophobicContact SD-CD2 4.38Å; L543-L567 HydrophobicContact CD2-CD1 4.21Å; V545-L567 HydrophobicContact CG2-CD1 3.55Å; F563-L567 WeakPolarHBondContact O-CB 3.35Å; F563-L567 PolarHBondContact O-N 3.43Å; R564-L567 VanDerWaalsContact O-O 3.11Å; L567-V572 HydrophobicContact CB-CG2 4.14Å; L567-V572 HydrophobicContact CD1-CG2 4.29Å; L567-L655 HydrophobicContact CD1-CD1 4.35Å; L567-L655 HydrophobicContact CD1-CD2 4.04Å; L567-L655 HydrophobicContact CD2-CD1 3.98Å; L567-L655 HydrophobicContact CG-CD1 4.02Å
568	N	95.8	Very high	93.5	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.109	C	C	.	.			trans	-70.4	129	167.6	-173.3	-34.5	0	0	0	108.9	C146 W191 L218 H570 Q571	C146-N568 PolarHBondContact O-ND2 3.31Å; W191-N568 HydrophobicContact CH2-CB 4.36Å; W191-N568 HydrophobicContact CZ3-CB 4.26Å; L218-N568 HydrophobicContact CB-CB 4.22Å; L218-N568 WeakPolarHBondContact O-CB 3.34Å; L218-N568 PolarHBondContact O-ND2 3.05Å; N568-H570 PolarHBondContact O-N 3.47Å; N568-H570 WeakPolarHBondContact OD1-CB 3.46Å; N568-H570 PolarHBondContact OD1-CD2 2.99Å; N568-H570 VanDerWaalsContact OD1-CD2 3.31Å; N568-H570 PolarHBondContact OD1-N 3Å; N568-Q571 HydrophobicContact CB-CG 4.13Å; N568-Q571 VanDerWaalsContact O-CB 3.25Å; N568-Q571 WeakPolarHBondContact O-CB 3.43Å; N568-Q571 PolarHBondContact O-N 3.02Å
569	P	95.8	Very high	93.6	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	9%	0.086	C	C	.	.	G	3₁₀ helix	trans	-55	-21.9	177.5	-26.9	34.1	0	0	0	115	V126 C146 Y236 Q571 V572	V126-P569 HydrophobicContact CG1-CG 3.8Å; V126-P569 HydrophobicContact CG2-CG 4.12Å; C146-P569 WeakPolarHBondContact SG-CD 3.18Å; Y236-P569 HydrophobicContact CD1-CB 3.95Å; Y236-P569 HydrophobicContact CD2-CB 4.49Å; Y236-P569 HydrophobicContact CG-CB 3.96Å; P569-Q571 PolarHBondContact O-N 3.37Å; P569-V572 PolarHBondContact O-N 3.22Å
570	H	96.3	Very high	93.7	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	9%	0.086	C	C	.	.	G	3₁₀ helix	trans	-70.5	-8.1	172.5	-68.2	-64.9	0	0	0	114.3	H147 L218 V223 C235 Y236 R237 P529 N568 F573	H147-H570 AromaticContact CE1-NE2 3.77Å; H147-H570 AromaticContact CG-NE2 3.79Å; H147-H570 AromaticContact ND1-CD2 3.88Å; H147-H570 AromaticContact ND1-CE1 3.79Å; H147-H570 AromaticContact ND1-NE2 2.89Å; H147-H570 PolarHBondContact ND1-NE2 3.01Å; L218-H570 HydrophobicContact CD2-CB 4.39Å; V223-H570 HydrophobicContact CG1-CB 4.29Å; C235-H570 PolarHBondContact O-CE1 2.89Å; Y236-H570 AromaticContact CD1-CE1 3.65Å; Y236-H570 AromaticContact CD1-NE2 3.62Å; Y236-H570 AromaticContact CE1-CE1 3.8Å; Y236-H570 AromaticContact CE1-NE2 3.31Å; Y236-H570 VanDerWaalsContact CE1-NE2 3.31Å; Y236-H570 WeakPolarHBondContact CE1-NE2 3.43Å; R237-H570 PolarHBondContact NH2-ND1 3.39Å; P529-H570 HydrophobicContact CG-CB 4.16Å; N568-H570 PolarHBondContact O-N 3.47Å; N568-H570 WeakPolarHBondContact OD1-CB 3.46Å; N568-H570 PolarHBondContact OD1-CD2 2.99Å; N568-H570 VanDerWaalsContact OD1-CD2 3.31Å; N568-H570 PolarHBondContact OD1-N 3Å; H570-F573 VanDerWaalsContact O-CE2 3.27Å; H570-F573 WeakPolarHBondContact O-CE2 3.34Å
571	Q	96.9	Very high	93.9	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	9%	0.086	C	C	.	.	G	3₁₀ helix	trans	-98.5	-11	174.7	-59.6	-178.3	-92.7	0	0	113.1	M216 L218 L543 V545 N568 P569 F587	M216-Q571 PolarHBondContact O-NE2 2.87Å; L218-Q571 HydrophobicContact CB-CG 3.44Å; L218-Q571 VanDerWaalsContact CB-CG 3.44Å; L218-Q571 HydrophobicContact CD2-CG 3.91Å; L218-Q571 HydrophobicContact CG-CG 4.34Å; L543-Q571 WeakPolarHBondContact O-CB 3.33Å; L543-Q571 PolarHBondContact O-NE2 3.28Å; V545-Q571 PolarHBondContact N-O 3.5Å; N568-Q571 HydrophobicContact CB-CG 4.13Å; N568-Q571 VanDerWaalsContact O-CB 3.25Å; N568-Q571 WeakPolarHBondContact O-CB 3.43Å; N568-Q571 PolarHBondContact O-N 3.02Å; P569-Q571 PolarHBondContact O-N 3.37Å; Q571-F587 HydrophobicContact CB-CZ 4.49Å; Q571-F587 HydrophobicContact CG-CZ 4.12Å
572	V	97.6	Very high	94.1	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	112.2	-168.1	-169.5	0	0	0	0	110.1	V545 V547 L560 F563 R564 L567 P569	V545-V572 HydrophobicContact CB-CG1 4.35Å; V545-V572 HydrophobicContact CB-CG2 4.38Å; V545-V572 HydrophobicContact CG1-CG1 4.43Å; V547-V572 HydrophobicContact CG2-CG1 4.38Å; L560-V572 HydrophobicContact CD1-CG1 3.68Å; F563-V572 HydrophobicContact CB-CG1 4.01Å; F563-V572 HydrophobicContact CB-CG2 4.08Å; R564-V572 HydrophobicContact CG-CB 4.04Å; R564-V572 HydrophobicContact CG-CG1 4.09Å; L567-V572 HydrophobicContact CB-CG2 4.14Å; L567-V572 HydrophobicContact CD1-CG2 4.29Å; P569-V572 PolarHBondContact O-N 3.22Å
573	F	97.1	Very high	94.3	Very high	8 Å²	8	12.1 Å²	12.1	4%	0.035	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	130.6	-173.8	-69.6	-98.9	0	0	0	111	L544 V545 F546 V547 H570 I575 A582 A586	L544-F573 HydrophobicContact CD1-CD2 3.5Å; L544-F573 HydrophobicContact CD1-CE2 3.55Å; V545-F573 PolarHBondContact O-N 2.7Å; F546-F573 HydrophobicContact CD1-CB 3.73Å; F546-F573 HydrophobicContact CE1-CB 3.91Å; F546-F573 HydrophobicContact CE1-CG 4.25Å; V547-F573 PolarHBondContact N-O 3.07Å; H570-F573 VanDerWaalsContact O-CE2 3.27Å; H570-F573 WeakPolarHBondContact O-CE2 3.34Å; F573-I575 PolarHBondContact O-N 3.22Å; F573-A582 HydrophobicContact CD1-CB 4.08Å; F573-A582 HydrophobicContact CE1-CB 4.03Å; F573-A586 HydrophobicContact CZ-CB 4.18Å
574	D	95.3	Very high	94.4	Very high	27 Å²	27	12.1 Å²	12.1	14%	0.144	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	111.3	164.8	-177.8	-19.3	0	0	0	108.1	P549 L560 T576 N577	P549-D574 WeakPolarHBondContact CD-OD1 3.35Å; P549-D574 WeakPolarHBondContact CG-OD1 3.48Å; L560-D574 HydrophobicContact CD2-CB 4.03Å; D574-T576 PolarHBondContact O-N 3.47Å; D574-T576 WeakPolarHBondContact OD1-CB 3.41Å; D574-T576 PolarHBondContact OD1-N 2.97Å; D574-T576 PolarHBondContact OD1-OG1 3.47Å; D574-N577 HydrophobicContact CB-CB 4.18Å; D574-N577 PolarHBondContact O-N 2.9Å
575	I	93.4	Very high	94.6	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-18	-175.8	-153.6	175.9	0	0	0	112.5	F546 V547 N548 F573 N577 G579 P580 T603 W606 V607	F546-I575 HydrophobicContact CB-CD1 4.48Å; V547-I575 PolarHBondContact O-N 3.45Å; N548-I575 HydrophobicContact CB-CG2 3.83Å; F573-I575 PolarHBondContact O-N 3.22Å; I575-N577 PolarHBondContact O-N 3Å; I575-G579 WeakPolarHBondContact O-CA 3.5Å; I575-G579 PolarHBondContact O-N 3.24Å; I575-G579 VanDerWaalsContact O-N 3.16Å; I575-P580 HydrophobicContact CD1-CB 4.19Å; I575-P580 HydrophobicContact CD1-CG 4.32Å; I575-P580 HydrophobicContact CG1-CB 4.32Å; I575-T603 HydrophobicContact CD1-CG2 4.03Å; I575-T603 HydrophobicContact CG2-CG2 4.42Å; I575-W606 HydrophobicContact CB-CZ3 4.41Å; I575-W606 HydrophobicContact CD1-CD2 4.19Å; I575-W606 HydrophobicContact CD1-CE3 3.6Å; I575-W606 HydrophobicContact CD1-CZ3 3.87Å; I575-W606 HydrophobicContact CG1-CE3 3.94Å; I575-W606 HydrophobicContact CG1-CH2 4.12Å; I575-W606 HydrophobicContact CG1-CZ3 3.66Å; I575-W606 HydrophobicContact CG2-CZ3 4.14Å; I575-W606 WeakPolarHBondContact O-CH2 3.39Å; I575-V607 HydrophobicContact CD1-CG2 3.68Å
576	T	90.2	Very high	94.8	Very high	69 Å²	69	10.6 Å²	10.6	42%	0.423	7%	0.067	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-13.3	174.7	66.8	0	0	0	0	112.4	P549 D574	P549-T576 HydrophobicContact CG-CG2 4.07Å; D574-T576 PolarHBondContact O-N 3.47Å; D574-T576 WeakPolarHBondContact OD1-CB 3.41Å; D574-T576 PolarHBondContact OD1-N 2.97Å; D574-T576 PolarHBondContact OD1-OG1 3.47Å
577	N	88.9	Confident	95.1	Very high	49 Å²	49	9.5 Å²	9.5	26%	0.262	6%	0.061	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105	82.2	177	-172.5	21.3	0	0	0	110.3	R237 L526 D574 I575	R237-N577 PolarHBondContact O-ND2 2.96Å; L526-N577 WeakPolarHBondContact CD1-O 3.42Å; D574-N577 HydrophobicContact CB-CB 4.18Å; D574-N577 PolarHBondContact O-N 2.9Å; I575-N577 PolarHBondContact O-N 3Å
578	G	82.1	Confident	95.1	Very high	20 Å²	20	11 Å²	11	21%	0.206	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	83	12.3	177.3	0	0	0	0	0	116.2
579	G	92.8	Very high	95.2	Very high	8 Å²	8	15.3 Å²	15.3	8%	0.082	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	-172.4	173.1	0	0	0	0	0	114.7	I575 L581	I575-G579 WeakPolarHBondContact O-CA 3.5Å; I575-G579 PolarHBondContact O-N 3.24Å; I575-G579 VanDerWaalsContact O-N 3.16Å; G579-L581 VanDerWaalsContact C-N 3.3Å; G579-L581 PolarHBondContact O-N 3.21Å
580	P	97.1	Very high	95.2	Very high	2 Å²	2	15.3 Å²	15.3	1%	0.013	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-16.7	-178.1	29.8	-34.2	0	0	0	113.7	F546 I575 A582 G583 L584 V607 V610	F546-P580 HydrophobicContact CD1-CB 4.22Å; F546-P580 VanDerWaalsContact CE1-CA 3.49Å; F546-P580 HydrophobicContact CE1-CB 3.91Å; F546-P580 WeakPolarHBondContact CE1-O 3.34Å; F546-P580 HydrophobicContact CE2-CB 4.29Å; F546-P580 HydrophobicContact CZ-CB 3.93Å; F546-P580 VanDerWaalsContact CZ-O 3.23Å; F546-P580 WeakPolarHBondContact CZ-O 3.3Å; I575-P580 HydrophobicContact CD1-CB 4.19Å; I575-P580 HydrophobicContact CD1-CG 4.32Å; I575-P580 HydrophobicContact CG1-CB 4.32Å; P580-A582 VanDerWaalsContact C-N 3.29Å; P580-A582 PolarHBondContact O-N 3.06Å; P580-G583 PolarHBondContact O-N 3.19Å; P580-L584 PolarHBondContact O-N 3.36Å; P580-V607 HydrophobicContact CB-CG2 4.07Å; P580-V610 HydrophobicContact CG-CB 3.77Å; P580-V610 HydrophobicContact CG-CG1 4.08Å; P580-V610 HydrophobicContact CG-CG2 3.66Å
581	L	97.7	Very high	95.1	Very high	5 Å²	5	18.6 Å²	18.6	3%	0.026	11%	0.108	C	C	.	.	H	α-helix	trans	-57.8	-40	-176.4	179.2	63.1	0	0	0	112.4	L456 Y490 Q493 A495 G579 G583 L584 H585 V610 V614	L456-L581 HydrophobicContact CD1-CD2 4.48Å; L456-L581 HydrophobicContact CD2-CD2 4.38Å; L456-L581 HydrophobicContact CD2-CG 4.2Å; Y490-L581 HydrophobicContact CD1-CD1 3.61Å; Y490-L581 HydrophobicContact CD1-CD2 4.42Å; Y490-L581 HydrophobicContact CD2-CD1 4.19Å; Y490-L581 HydrophobicContact CD2-CD2 3.9Å; Y490-L581 HydrophobicContact CD2-CG 4.47Å; Y490-L581 HydrophobicContact CE1-CD1 3.67Å; Y490-L581 HydrophobicContact CE2-CD1 4.24Å; Y490-L581 HydrophobicContact CG-CD1 3.88Å; Y490-L581 HydrophobicContact CG-CD2 3.84Å; Y490-L581 HydrophobicContact CG-CG 4.45Å; Q493-L581 HydrophobicContact CB-CD2 3.85Å; Q493-L581 HydrophobicContact CG-CD2 4.18Å; A495-L581 HydrophobicContact CB-CD2 3.44Å; A495-L581 VanDerWaalsContact CB-CD2 3.44Å; G579-L581 VanDerWaalsContact C-N 3.3Å; G579-L581 PolarHBondContact O-N 3.21Å; L581-G583 VanDerWaalsContact C-N 3.31Å; L581-G583 PolarHBondContact O-N 3.48Å; L581-L584 PolarHBondContact O-N 3.39Å; L581-H585 VanDerWaalsContact O-CB 3.25Å; L581-H585 WeakPolarHBondContact O-CB 3.29Å; L581-H585 PolarHBondContact O-N 2.99Å; L581-V610 HydrophobicContact CB-CG1 4.33Å; L581-V614 HydrophobicContact CD1-CG1 3.84Å
582	A	96	Very high	95	Very high	1 Å²	1	25 Å²	25	1%	0.008	13%	0.132	C	C	.	.	H	α-helix	trans	-57.9	-42.9	-179.7	0	0	0	0	0	112.8	L456 L526 I528 F573 P580 A586	L456-A582 HydrophobicContact CD2-CB 3.88Å; L526-A582 HydrophobicContact CD1-CB 3.64Å; I528-A582 HydrophobicContact CD1-CB 4.02Å; F573-A582 HydrophobicContact CD1-CB 4.08Å; F573-A582 HydrophobicContact CE1-CB 4.03Å; P580-A582 VanDerWaalsContact C-N 3.29Å; P580-A582 PolarHBondContact O-N 3.06Å; A582-A586 WeakPolarHBondContact O-CB 2.87Å; A582-A586 PolarHBondContact O-N 3.3Å
583	G	97.2	Very high	95	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-69.9	-44.5	177.3	0	0	0	0	0	112.5	P580 L581 H585 A586 F587	P580-G583 PolarHBondContact O-N 3.19Å; L581-G583 VanDerWaalsContact C-N 3.31Å; L581-G583 PolarHBondContact O-N 3.48Å; G583-H585 VanDerWaalsContact C-N 3.34Å; G583-H585 PolarHBondContact O-N 3.39Å; G583-A586 PolarHBondContact O-N 3.22Å; G583-F587 PolarHBondContact O-N 3.44Å
584	L	98.1	Very high	95	Very high	1 Å²	1	27 Å²	27	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-64.1	-39.2	178.1	-66.8	172.1	0	0	0	111.8	L544 F546 P580 L581 F587 R588 V610 L611 V614 L618	L544-L584 HydrophobicContact CD2-CD2 4.13Å; F546-L584 HydrophobicContact CZ-CG 4.18Å; P580-L584 PolarHBondContact O-N 3.36Å; L581-L584 PolarHBondContact O-N 3.39Å; L584-F587 CarbonylContact O-C 3.54Å; L584-F587 PolarHBondContact O-N 2.9Å; L584-R588 PolarHBondContact O-N 2.99Å; L584-V610 HydrophobicContact CD1-CB 4.45Å; L584-V610 HydrophobicContact CD1-CG1 3.87Å; L584-L611 HydrophobicContact CD1-CB 4.33Å; L584-L611 HydrophobicContact CD2-CD1 3.94Å; L584-V614 HydrophobicContact CB-CG2 4.29Å; L584-V614 HydrophobicContact CD1-CG2 3.93Å; L584-L618 HydrophobicContact CD2-CD1 4.47Å; L584-L618 WeakPolarHBondContact O-CD2 3.32Å
585	H	97.6	Very high	95.2	Very high	3 Å²	3	25.8 Å²	25.8	1%	0.014	13%	0.133	C	C	.	.	H	α-helix	trans	-66.8	-40.6	175.2	177	70.6	0	0	0	112.1	H488 Y490 A497 L581 G583 F587 R588	H488-H585 AromaticContact CG-CE1 3.93Å; H488-H585 AromaticContact ND1-CE1 3.74Å; Y490-H585 AromaticContact CE2-ND1 3.79Å; Y490-H585 AromaticContact CZ-ND1 3.69Å; Y490-H585 PolarHBondContact OH-ND1 2.91Å; A497-H585 WeakPolarHBondContact CB-CE1 3.25Å; A497-H585 WeakPolarHBondContact CB-NE2 3.47Å; L581-H585 VanDerWaalsContact O-CB 3.25Å; L581-H585 WeakPolarHBondContact O-CB 3.29Å; L581-H585 PolarHBondContact O-N 2.99Å; G583-H585 VanDerWaalsContact C-N 3.34Å; G583-H585 PolarHBondContact O-N 3.39Å; H585-F587 VanDerWaalsContact C-N 3.27Å; H585-F587 PolarHBondContact O-N 3.14Å; H585-R588 PolarHBondContact CE1-NH1 3.08Å; H585-R588 PolarHBondContact NE2-NH1 2.87Å; H585-R588 WeakPolarHBondContact O-CB 3.29Å; H585-R588 WeakPolarHBondContact O-CD 3.27Å; H585-R588 VanDerWaalsContact O-CG 3.29Å; H585-R588 WeakPolarHBondContact O-CG 3.48Å; H585-R588 PolarHBondContact O-N 2.97Å; H585-R588 PolarHBondContact O-NH1 3.26Å
586	A	96.9	Very high	95.4	Very high	7 Å²	7	25.8 Å²	25.8	6%	0.058	13%	0.133	C	C	.	.	H	α-helix	trans	-62.7	-35.1	175.3	0	0	0	0	0	112.3	I528 I531 F573 A582 G583	I528-A586 HydrophobicContact CG2-CB 3.85Å; I531-A586 WeakPolarHBondContact CD1-O 3.11Å; F573-A586 HydrophobicContact CZ-CB 4.18Å; A582-A586 WeakPolarHBondContact O-CB 2.87Å; A582-A586 PolarHBondContact O-N 3.3Å; G583-A586 PolarHBondContact O-N 3.22Å
587	F	97.8	Very high	95.8	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	5.2	-178.5	-84.1	-120.6	0	0	0	114	I531 P542 L544 Q571 G583 L584 H585 E589 V590 F593	I531-F587 HydrophobicContact CD1-CD2 3.67Å; I531-F587 HydrophobicContact CD1-CE2 3.74Å; I531-F587 HydrophobicContact CD1-CG 4.13Å; I531-F587 HydrophobicContact CD1-CZ 4.28Å; P542-F587 HydrophobicContact CB-CE1 3.91Å; P542-F587 HydrophobicContact CB-CZ 4.46Å; L544-F587 HydrophobicContact CB-CD1 4.17Å; L544-F587 HydrophobicContact CB-CE1 3.95Å; L544-F587 HydrophobicContact CB-CE2 4.47Å; L544-F587 HydrophobicContact CB-CG 4.49Å; L544-F587 HydrophobicContact CB-CZ 4.12Å; L544-F587 HydrophobicContact CD1-CD2 4.03Å; L544-F587 HydrophobicContact CD1-CE2 3.91Å; L544-F587 HydrophobicContact CD1-CZ 4.32Å; L544-F587 HydrophobicContact CD2-CB 4.4Å; L544-F587 HydrophobicContact CD2-CD2 4.43Å; L544-F587 HydrophobicContact CD2-CG 4.26Å; Q571-F587 HydrophobicContact CB-CZ 4.49Å; Q571-F587 HydrophobicContact CG-CZ 4.12Å; G583-F587 PolarHBondContact O-N 3.44Å; L584-F587 CarbonylContact O-C 3.54Å; L584-F587 PolarHBondContact O-N 2.9Å; H585-F587 VanDerWaalsContact C-N 3.27Å; H585-F587 PolarHBondContact O-N 3.14Å; F587-E589 PolarHBondContact O-N 2.88Å; F587-E589 VanDerWaalsContact O-N 3.1Å; F587-V590 HydrophobicContact CB-CG2 4.29Å; F587-V590 HydrophobicContact CD1-CB 4.33Å; F587-V590 HydrophobicContact CD1-CG2 4.09Å; F587-V590 HydrophobicContact CG-CG2 4.25Å; F587-V590 WeakPolarHBondContact O-CB 3.43Å; F587-V590 PolarHBondContact O-N 3.33Å; F587-F593 HydrophobicContact CB-CD1 4.38Å; F587-F593 HydrophobicContact CB-CE1 4.1Å; F587-F593 HydrophobicContact CB-CE2 4.38Å; F587-F593 HydrophobicContact CB-CZ 4.12Å; F587-F593 HydrophobicContact CD1-CB 3.87Å; F587-F593 HydrophobicContact CD1-CD1 4.11Å; F587-F593 AromaticContact CD1-CD2 3.86Å; F587-F593 HydrophobicContact CD1-CD2 3.86Å; F587-F593 HydrophobicContact CD1-CE2 4.39Å; F587-F593 AromaticContact CD1-CG 3.71Å; F587-F593 HydrophobicContact CD1-CG 3.71Å; F587-F593 HydrophobicContact CE1-CB 4.15Å; F587-F593 HydrophobicContact CE1-CG 4.41Å
588	R	97.4	Very high	96.3	Very high	31 Å²	31	20.1 Å²	20.1	12%	0.117	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-31.8	-170	76.8	-168.8	175.7	-94.5	-7.8	114.3	L584 H585 L618 V619	L584-R588 PolarHBondContact O-N 2.99Å; H585-R588 PolarHBondContact CE1-NH1 3.08Å; H585-R588 PolarHBondContact NE2-NH1 2.87Å; H585-R588 WeakPolarHBondContact O-CB 3.29Å; H585-R588 WeakPolarHBondContact O-CD 3.27Å; H585-R588 VanDerWaalsContact O-CG 3.29Å; H585-R588 WeakPolarHBondContact O-CG 3.48Å; H585-R588 PolarHBondContact O-N 2.97Å; H585-R588 PolarHBondContact O-NH1 3.26Å; R588-L618 HydrophobicContact CB-CD2 3.74Å; R588-V619 WeakPolarHBondContact O-CG2 3.32Å; R588-V619 PolarHBondContact O-N 3.22Å
589	E	96.5	Very high	96.9	Very high	90 Å²	90	19.2 Å²	19.2	42%	0.421	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-9.4	-179.3	-64.4	172.2	-158.3	0	0	112.6	C533 F587 P591	C533-E589 VanDerWaalsContact SG-C 3.54Å; C533-E589 PolarHBondContact SG-O 2.85Å; C533-E589 VanDerWaalsContact SG-O 3.4Å; F587-E589 PolarHBondContact O-N 2.88Å; F587-E589 VanDerWaalsContact O-N 3.1Å; E589-P591 WeakPolarHBondContact O-CD 3.12Å
590	V	96.4	Very high	96.9	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.006	9%	0.092	C	C	.	.			trans	-72.4	119.8	-177.7	-178.3	0	0	0	0	109.1	I531 L536 F587 R592 F593 C620	I531-V590 HydrophobicContact CB-CG2 4.3Å; I531-V590 HydrophobicContact CD1-CG2 3.91Å; I531-V590 HydrophobicContact CG2-CG2 3.9Å; L536-V590 HydrophobicContact CD1-CG1 4.18Å; F587-V590 HydrophobicContact CB-CG2 4.29Å; F587-V590 HydrophobicContact CD1-CB 4.33Å; F587-V590 HydrophobicContact CD1-CG2 4.09Å; F587-V590 HydrophobicContact CG-CG2 4.25Å; F587-V590 WeakPolarHBondContact O-CB 3.43Å; F587-V590 PolarHBondContact O-N 3.33Å; V590-R592 VanDerWaalsContact C-N 3.33Å; V590-R592 PolarHBondContact O-N 3.08Å; V590-F593 HydrophobicContact CB-CD1 4.05Å; V590-F593 HydrophobicContact CG1-CB 4.09Å; V590-F593 HydrophobicContact CG1-CD1 4.13Å; V590-C620 WeakPolarHBondContact O-CB 3.4Å
591	P	94.1	Very high	96.6	Very high	69 Å²	69	20.5 Å²	20.5	45%	0.448	10%	0.098	S	C	.	.	S	Bend	trans	-71	-27.9	-170.5	25.8	-34.7	0	0	0	113.5	E589 V619 C620	E589-P591 WeakPolarHBondContact O-CD 3.12Å; P591-V619 HydrophobicContact CB-CG1 4.22Å; P591-C620 WeakPolarHBondContact O-CB 3.24Å
592	R	94.4	Very high	96.2	Very high	135 Å²	135	22.3 Å²	22.3	51%	0.509	12%	0.118	S	C	.	.	S	Bend	trans	-147.2	121.8	178.1	-68.5	-178.6	-68.1	161.9	1.9	110.3	D538 P542 V590	D538-R592 PolarHBondContact O-NH2 2.93Å; P542-R592 WeakPolarHBondContact CD-O 3.39Å; V590-R592 VanDerWaalsContact C-N 3.33Å; V590-R592 PolarHBondContact O-N 3.08Å
593	F	97.4	Very high	96.2	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.009	12%	0.121	C	C	.	.			trans	-149.8	162.3	173.7	67.1	-89.4	0	0	0	110.4	P542 L544 F587 V590 V595 C620 P623	P542-F593 VanDerWaalsContact O-CA 3.29Å; P542-F593 WeakPolarHBondContact O-CA 3.46Å; P542-F593 WeakPolarHBondContact O-CB 3.18Å; L544-F593 HydrophobicContact CB-CD2 4.18Å; L544-F593 HydrophobicContact CB-CE2 4.45Å; L544-F593 HydrophobicContact CD2-CE2 4.03Å; F587-F593 HydrophobicContact CB-CD1 4.38Å; F587-F593 HydrophobicContact CB-CE1 4.1Å; F587-F593 HydrophobicContact CB-CE2 4.38Å; F587-F593 HydrophobicContact CB-CZ 4.12Å; F587-F593 HydrophobicContact CD1-CB 3.87Å; F587-F593 HydrophobicContact CD1-CD1 4.11Å; F587-F593 AromaticContact CD1-CD2 3.86Å; F587-F593 HydrophobicContact CD1-CD2 3.86Å; F587-F593 HydrophobicContact CD1-CE2 4.39Å; F587-F593 AromaticContact CD1-CG 3.71Å; F587-F593 HydrophobicContact CD1-CG 3.71Å; F587-F593 HydrophobicContact CE1-CB 4.15Å; F587-F593 HydrophobicContact CE1-CG 4.41Å; V590-F593 HydrophobicContact CB-CD1 4.05Å; V590-F593 HydrophobicContact CG1-CB 4.09Å; V590-F593 HydrophobicContact CG1-CD1 4.13Å; F593-V595 HydrophobicContact CD2-CG2 4.07Å; F593-V595 HydrophobicContact CE2-CG2 3.72Å; F593-C620 HydrophobicContact CD1-CB 3.78Å; F593-C620 HydrophobicContact CE1-CB 3.61Å; F593-P623 HydrophobicContact CD2-CB 3.88Å; F593-P623 HydrophobicContact CD2-CG 4.5Å; F593-P623 HydrophobicContact CE1-CB 4.41Å; F593-P623 HydrophobicContact CE2-CB 3.59Å; F593-P623 HydrophobicContact CE2-CG 3.71Å; F593-P623 HydrophobicContact CG-CB 4.4Å; F593-P623 HydrophobicContact CZ-CB 3.88Å; F593-P623 HydrophobicContact CZ-CG 3.75Å; F593-P623 WeakPolarHBondContact O-CB 3.18Å
594	R	98.2	Very high	96.1	Very high	47 Å²	47	23 Å²	23	18%	0.177	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	159	172.6	-72.3	178.4	172.4	-177.8	-0.2	109.8	P542 L543 L544 P624 V658 D659 E663 L867	P542-R594 PolarHBondContact O-N 3.24Å; L543-R594 CarbonylContact C-O 3.53Å; L543-R594 WeakPolarHBondContact CA-O 3.23Å; L543-R594 HydrophobicContact CD1-CB 3.84Å; L544-R594 PolarHBondContact N-O 3.48Å; R594-P624 HydrophobicContact CG-CB 4.47Å; R594-P624 HydrophobicContact CG-CG 4.47Å; R594-V658 PolarHBondContact NH1-O 3.36Å; R594-V658 VanDerWaalsContact NH1-O 3.07Å; R594-D659 PolarHBondContact NH1-O 3.05Å; R594-E663 IonicContact CZ-OE1 3.21Å; R594-E663 IonicContact NE-OE1 3.21Å; R594-E663 IonicContact NH2-OE1 3.14Å; R594-E663 PolarHBondContact NH2-OE1 3.36Å; R594-L867 HydrophobicContact CB-CD1 4.42Å
595	V	98.8	Very high	95.9	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.006	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	139.2	176.5	-177.4	0	0	0	0	110.1	L544 F546 F593 V597 V607 P623 P624 I625 G626	L544-V595 HydrophobicContact CB-CG2 4.39Å; L544-V595 HydrophobicContact CD2-CG2 4.44Å; L544-V595 CarbonylContact O-C 3.58Å; L544-V595 VanDerWaalsContact O-CA 3.24Å; L544-V595 WeakPolarHBondContact O-CA 3.27Å; F546-V595 HydrophobicContact CD2-CG1 3.74Å; F546-V595 HydrophobicContact CE2-CG1 3.89Å; F593-V595 HydrophobicContact CD2-CG2 4.07Å; F593-V595 HydrophobicContact CE2-CG2 3.72Å; V595-V597 HydrophobicContact CG1-CG2 4.01Å; V595-V607 HydrophobicContact CG1-CG1 4.47Å; V595-P623 HydrophobicContact CG2-CB 4.1Å; V595-P623 HydrophobicContact CG2-CG 4.1Å; V595-P624 PolarHBondContact N-O 3.24Å; V595-I625 HydrophobicContact CB-CG1 4.16Å; V595-I625 HydrophobicContact CB-CG2 4.36Å; V595-I625 HydrophobicContact CG1-CG2 4.3Å; V595-I625 CarbonylContact O-C 3.53Å; V595-I625 WeakPolarHBondContact O-CA 3.41Å; V595-G626 PolarHBondContact O-N 2.92Å
596	L	98.8	Very high	95.8	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	122.1	168.7	-178.4	63.8	0	0	0	109.6	L543 L544 V545 F546 F563 V628 I654 L655 V658	L543-L596 HydrophobicContact CD1-CB 4Å; L543-L596 HydrophobicContact CD2-CB 4.16Å; L543-L596 HydrophobicContact CD2-CD2 4.29Å; L543-L596 HydrophobicContact CG-CB 4.3Å; L544-L596 PolarHBondContact O-N 3.31Å; V545-L596 CarbonylContact C-O 3.56Å; V545-L596 WeakPolarHBondContact CA-O 3.4Å; V545-L596 HydrophobicContact CG1-CB 4.39Å; V545-L596 HydrophobicContact CG1-CD2 4.36Å; V545-L596 HydrophobicContact CG2-CB 4.28Å; F546-L596 PolarHBondContact N-O 3.04Å; F563-L596 HydrophobicContact CE2-CD2 4.32Å; F563-L596 HydrophobicContact CZ-CD2 4.12Å; L596-V628 HydrophobicContact CD1-CG2 3.9Å; L596-V628 HydrophobicContact CD2-CG2 4.16Å; L596-V628 HydrophobicContact CG-CG2 4.21Å; L596-I654 HydrophobicContact CD2-CG2 4.45Å; L596-L655 HydrophobicContact CD2-CD2 4.31Å; L596-V658 HydrophobicContact CD1-CG2 3.83Å; L596-V658 HydrophobicContact CD2-CG2 4.27Å
597	V	98.6	Very high	95.8	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	120	177.9	-174.2	0	0	0	0	109.8	V595 T603 V604 V607 I625 G626 I627 V628	V595-V597 HydrophobicContact CG1-CG2 4.01Å; V597-T603 HydrophobicContact CG1-CG2 3.85Å; V597-V604 HydrophobicContact CB-CG2 4.24Å; V597-V604 HydrophobicContact CG1-CG2 3.97Å; V597-V607 HydrophobicContact CG1-CG2 4.05Å; V597-V607 HydrophobicContact CG2-CB 4.07Å; V597-V607 HydrophobicContact CG2-CG1 3.92Å; V597-V607 HydrophobicContact CG2-CG2 3.89Å; V597-I625 HydrophobicContact CG2-CG2 3.74Å; V597-G626 PolarHBondContact N-O 2.78Å; V597-I627 CarbonylContact O-C 3.6Å; V597-I627 WeakPolarHBondContact O-CA 3.15Å; V597-V628 PolarHBondContact O-N 2.87Å
598	C	97.9	Very high	95.7	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	99.4	177.2	-50.9	0	0	0	0	109.1	F546 V547 N548 V628 L630	F546-C598 PolarHBondContact O-N 3.39Å; V547-C598 HydrophobicContact CB-CB 4.3Å; V547-C598 HydrophobicContact CG1-CB 4.01Å; V547-C598 HydrophobicContact CG2-CB 4.16Å; N548-C598 PolarHBondContact N-O 2.8Å; C598-V628 HydrophobicContact CB-CB 4.06Å; C598-L630 HydrophobicContact CB-CD1 3.94Å
599	G	95.2	Very high	95.5	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.5	-171.8	-171.2	0	0	0	0	0	112.6	V628 L630	G599-V628 PolarHBondContact N-O 3.25Å; G599-V628 VanDerWaalsContact N-O 3.13Å; G599-L630 PolarHBondContact O-N 2.8Å
600	G	92	Very high	95.4	Very high	11 Å²	11	25.2 Å²	25.2	11%	0.113	14%	0.14	C	C	.	.			trans	-90.1	-177.6	166.7	0	0	0	0	0	112.1	G602 T603 V604	G600-G602 VanDerWaalsContact C-N 3.32Å; G600-G602 PolarHBondContact O-N 2.85Å; G600-T603 WeakPolarHBondContact O-CB 3.33Å; G600-T603 PolarHBondContact O-N 3.12Å; G600-V604 PolarHBondContact O-N 3.29Å
601	D	90.8	Very high	95.4	Very high	27 Å²	27	25.9 Å²	25.9	14%	0.144	14%	0.143	C	C	.	.	H	α-helix	trans	-54.8	-43.4	-178.6	-58.8	-67.2	0	0	0	112.4	T603 V604 G605 N634 D635 L636 N698	D601-T603 VanDerWaalsContact C-N 3.32Å; D601-T603 PolarHBondContact O-N 2.87Å; D601-V604 WeakPolarHBondContact O-CB 3.38Å; D601-V604 PolarHBondContact O-N 3.28Å; D601-G605 PolarHBondContact O-N 3.46Å; D601-N634 WeakPolarHBondContact OD2-CA 3.39Å; D601-N634 PolarHBondContact OD2-N 3.06Å; D601-D635 PolarHBondContact OD1-N 3.23Å; D601-D635 PolarHBondContact OD2-N 3.04Å; D601-L636 PolarHBondContact OD1-N 2.82Å; D601-N698 PolarHBondContact OD1-ND2 3.33Å
602	G	91.1	Very high	95.3	Very high	42 Å²	42	25.5 Å²	25.5	43%	0.433	14%	0.136	S	C	.	.	H	α-helix	trans	-62.5	-31.9	175.8	0	0	0	0	0	114.7	G600 W606	G600-G602 VanDerWaalsContact C-N 3.32Å; G600-G602 PolarHBondContact O-N 2.85Å; G602-W606 PolarHBondContact O-N 3.49Å
603	T	94.4	Very high	95.2	Very high	14 Å²	14	21.7 Å²	21.7	9%	0.086	13%	0.127	C	C	.	.	H	α-helix	trans	-69.3	-37.9	173.4	-55	0	0	0	0	111	N548 I575 V597 G600 D601 W606 V607	N548-T603 HydrophobicContact CB-CG2 4.1Å; N548-T603 PolarHBondContact ND2-OG1 3.43Å; I575-T603 HydrophobicContact CD1-CG2 4.03Å; I575-T603 HydrophobicContact CG2-CG2 4.42Å; V597-T603 HydrophobicContact CG1-CG2 3.85Å; G600-T603 WeakPolarHBondContact O-CB 3.33Å; G600-T603 PolarHBondContact O-N 3.12Å; D601-T603 VanDerWaalsContact C-N 3.32Å; D601-T603 PolarHBondContact O-N 2.87Å; T603-W606 PolarHBondContact O-N 3.03Å; T603-V607 WeakPolarHBondContact O-CG2 3.3Å; T603-V607 PolarHBondContact O-N 3.44Å
604	V	95.7	Very high	95.1	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.006	13%	0.128	C	C	.	.	H	α-helix	trans	-67	-44.8	175.8	-179.4	0	0	0	0	110.4	V597 G600 D601 W606 V607 L608 I627 L636 M866	V597-V604 HydrophobicContact CB-CG2 4.24Å; V597-V604 HydrophobicContact CG1-CG2 3.97Å; G600-V604 PolarHBondContact O-N 3.29Å; D601-V604 WeakPolarHBondContact O-CB 3.38Å; D601-V604 PolarHBondContact O-N 3.28Å; V604-W606 VanDerWaalsContact C-N 3.32Å; V604-W606 PolarHBondContact O-N 3.43Å; V604-V607 PolarHBondContact O-N 2.88Å; V604-L608 HydrophobicContact CG1-CD1 3.99Å; V604-L608 HydrophobicContact CG1-CG 4.42Å; V604-L608 WeakPolarHBondContact O-CG 3.36Å; V604-L608 PolarHBondContact O-N 3.4Å; V604-I627 HydrophobicContact CG1-CD1 4.08Å; V604-I627 HydrophobicContact CG1-CG1 4.39Å; V604-I627 HydrophobicContact CG2-CD1 3.98Å; V604-I627 HydrophobicContact CG2-CG1 3.96Å; V604-I627 HydrophobicContact CG2-CG2 4.03Å; V604-L636 HydrophobicContact CG1-CD2 4Å; V604-M866 HydrophobicContact CG1-CE 4.48Å
605	G	94.1	Very high	94.9	Very high	19 Å²	19	23.8 Å²	23.8	20%	0.196	14%	0.136	C	C	.	.	H	α-helix	trans	-57.3	-42	174.3	0	0	0	0	0	112.7	D601 L608 G609	D601-G605 PolarHBondContact O-N 3.46Å; G605-L608 PolarHBondContact O-N 3.07Å; G605-G609 PolarHBondContact O-N 2.92Å
606	W	94.8	Very high	94.7	Very high	121 Å²	121	29.9 Å²	29.9	46%	0.458	16%	0.164	S	C	.	.	H	α-helix	trans	-61.7	-45	175.5	-176.8	21.9	0	0	0	112.6	I575 G602 T603 V604 G609 V610	I575-W606 HydrophobicContact CB-CZ3 4.41Å; I575-W606 HydrophobicContact CD1-CD2 4.19Å; I575-W606 HydrophobicContact CD1-CE3 3.6Å; I575-W606 HydrophobicContact CD1-CZ3 3.87Å; I575-W606 HydrophobicContact CG1-CE3 3.94Å; I575-W606 HydrophobicContact CG1-CH2 4.12Å; I575-W606 HydrophobicContact CG1-CZ3 3.66Å; I575-W606 HydrophobicContact CG2-CZ3 4.14Å; I575-W606 WeakPolarHBondContact O-CH2 3.39Å; G602-W606 PolarHBondContact O-N 3.49Å; T603-W606 PolarHBondContact O-N 3.03Å; V604-W606 VanDerWaalsContact C-N 3.32Å; V604-W606 PolarHBondContact O-N 3.43Å; W606-G609 PolarHBondContact O-N 3.05Å; W606-V610 WeakPolarHBondContact O-CG2 3.34Å; W606-V610 PolarHBondContact O-N 3.22Å
607	V	97.1	Very high	94.5	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.006	18%	0.176	C	C	.	.	H	α-helix	trans	-63.2	-44.9	176.7	174.8	0	0	0	0	111.1	F546 I575 P580 V595 V597 T603 V604 V610 L611	F546-V607 HydrophobicContact CB-CG2 4.49Å; F546-V607 HydrophobicContact CD2-CG1 4.1Å; F546-V607 HydrophobicContact CD2-CG2 4.14Å; F546-V607 HydrophobicContact CE2-CG1 4.2Å; F546-V607 HydrophobicContact CG-CG2 4.41Å; I575-V607 HydrophobicContact CD1-CG2 3.68Å; P580-V607 HydrophobicContact CB-CG2 4.07Å; V595-V607 HydrophobicContact CG1-CG1 4.47Å; V597-V607 HydrophobicContact CG1-CG2 4.05Å; V597-V607 HydrophobicContact CG2-CB 4.07Å; V597-V607 HydrophobicContact CG2-CG1 3.92Å; V597-V607 HydrophobicContact CG2-CG2 3.89Å; T603-V607 WeakPolarHBondContact O-CG2 3.3Å; T603-V607 PolarHBondContact O-N 3.44Å; V604-V607 PolarHBondContact O-N 2.88Å; V607-V610 PolarHBondContact O-N 3.15Å; V607-L611 VanDerWaalsContact O-CB 3.27Å; V607-L611 WeakPolarHBondContact O-CB 3.35Å; V607-L611 PolarHBondContact O-N 3.08Å
608	L	95.6	Very high	94.4	Very high	2 Å²	2	33 Å²	33	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-60	-45.6	177.2	-75.9	169.2	0	0	0	111.9	V604 G605 L611 E612 I625 M666 V864 M866	V604-L608 HydrophobicContact CG1-CD1 3.99Å; V604-L608 HydrophobicContact CG1-CG 4.42Å; V604-L608 WeakPolarHBondContact O-CG 3.36Å; V604-L608 PolarHBondContact O-N 3.4Å; G605-L608 PolarHBondContact O-N 3.07Å; L608-L611 PolarHBondContact O-N 3.27Å; L608-E612 WeakPolarHBondContact O-CB 3.35Å; L608-E612 PolarHBondContact O-N 3.43Å; L608-I625 HydrophobicContact CD2-CD1 3.54Å; L608-I625 HydrophobicContact CG-CD1 4.26Å; L608-M666 HydrophobicContact CD1-CE 4Å; L608-V864 HydrophobicContact CD2-CB 4.16Å; L608-V864 HydrophobicContact CD2-CG1 4.08Å; L608-V864 HydrophobicContact CD2-CG2 4.09Å; L608-M866 HydrophobicContact CD2-SD 4.5Å
609	G	93.3	Very high	94.3	Very high	26 Å²	26	37.5 Å²	37.5	27%	0.268	21%	0.205	S	C	.	.	H	α-helix	trans	-62.9	-45.1	178.7	0	0	0	0	0	112.5	G605 W606 E612 T613	G605-G609 PolarHBondContact O-N 2.92Å; W606-G609 PolarHBondContact O-N 3.05Å; G609-E612 PolarHBondContact O-N 3.29Å; G609-T613 WeakPolarHBondContact O-CG2 3.38Å; G609-T613 PolarHBondContact O-N 2.85Å
610	V	95.8	Very high	94.4	Very high	11 Å²	11	38 Å²	38	7%	0.067	21%	0.209	C	C	.	.	H	α-helix	trans	-66.3	-43.5	176.1	178.2	0	0	0	0	110.8	Q493 P580 L581 L584 W606 V607 E612 T613 V614	Q493-V610 HydrophobicContact CG-CG1 4.27Å; P580-V610 HydrophobicContact CG-CB 3.77Å; P580-V610 HydrophobicContact CG-CG1 4.08Å; P580-V610 HydrophobicContact CG-CG2 3.66Å; L581-V610 HydrophobicContact CB-CG1 4.33Å; L584-V610 HydrophobicContact CD1-CB 4.45Å; L584-V610 HydrophobicContact CD1-CG1 3.87Å; W606-V610 WeakPolarHBondContact O-CG2 3.34Å; W606-V610 PolarHBondContact O-N 3.22Å; V607-V610 PolarHBondContact O-N 3.15Å; V610-E612 VanDerWaalsContact C-N 3.29Å; V610-E612 PolarHBondContact O-N 2.78Å; V610-T613 PolarHBondContact O-N 3.48Å; V610-T613 PolarHBondContact O-OG1 2.92Å; V610-V614 HydrophobicContact CG1-CG1 4.42Å; V610-V614 WeakPolarHBondContact O-CG2 3.48Å; V610-V614 PolarHBondContact O-N 3.46Å; V610-V614 VanDerWaalsContact O-N 3.07Å
611	L	95.3	Very high	94.5	Very high	14 Å²	14	44.6 Å²	44.6	7%	0.073	23%	0.23	C	C	.	.	H	α-helix	trans	-56.3	-44	177.1	177.2	62.7	0	0	0	111.9	L584 V607 L608 T613 V614 R615 L618 P623 I625	L584-L611 HydrophobicContact CD1-CB 4.33Å; L584-L611 HydrophobicContact CD2-CD1 3.94Å; V607-L611 VanDerWaalsContact O-CB 3.27Å; V607-L611 WeakPolarHBondContact O-CB 3.35Å; V607-L611 PolarHBondContact O-N 3.08Å; L608-L611 PolarHBondContact O-N 3.27Å; L611-T613 PolarHBondContact O-N 3Å; L611-V614 PolarHBondContact O-N 3.37Å; L611-R615 WeakPolarHBondContact O-CA 3.29Å; L611-R615 VanDerWaalsContact O-CB 3.32Å; L611-R615 WeakPolarHBondContact O-CB 3.41Å; L611-R615 PolarHBondContact O-N 3.36Å; L611-L618 HydrophobicContact CD1-CD1 3.46Å; L611-L618 VanDerWaalsContact CD1-CD1 3.46Å; L611-P623 HydrophobicContact CD1-CG 3.99Å; L611-P623 HydrophobicContact CD2-CG 4.02Å; L611-I625 HydrophobicContact CD2-CD1 3.88Å
612	E	92.6	Very high	94.7	Very high	61 Å²	61	46.8 Å²	46.8	29%	0.285	24%	0.239	S	C	.	.	H	α-helix	trans	-58.2	-48	177.4	178	172.1	-159.2	0	0	112	L608 G609 V610 V614 R615 R668	L608-E612 WeakPolarHBondContact O-CB 3.35Å; L608-E612 PolarHBondContact O-N 3.43Å; G609-E612 PolarHBondContact O-N 3.29Å; V610-E612 VanDerWaalsContact C-N 3.29Å; V610-E612 PolarHBondContact O-N 2.78Å; E612-V614 VanDerWaalsContact C-N 3.34Å; E612-V614 PolarHBondContact O-N 3.38Å; E612-R615 PolarHBondContact O-N 2.89Å; E612-R668 IonicContact OE2-CZ 3.8Å; E612-R668 VanDerWaalsContact OE2-CZ 3.24Å; E612-R668 IonicContact OE2-NH1 3.53Å; E612-R668 PolarHBondContact OE2-NH1 2.86Å; E612-R668 IonicContact OE2-NH2 2.89Å; E612-R668 PolarHBondContact OE2-NH2 3.42Å
613	T	92.4	Very high	94.9	Very high	55 Å²	55	44.9 Å²	44.9	34%	0.337	22%	0.219	S	C	.	.	H	α-helix	trans	-64.7	-36	179.4	60.8	0	0	0	0	113.1	A492 Q493 G609 V610 L611 H616	A492-T613 HydrophobicContact CB-CG2 4.16Å; Q493-T613 PolarHBondContact NE2-OG1 3.41Å; G609-T613 WeakPolarHBondContact O-CG2 3.38Å; G609-T613 PolarHBondContact O-N 2.85Å; V610-T613 PolarHBondContact O-N 3.48Å; V610-T613 PolarHBondContact O-OG1 2.92Å; L611-T613 PolarHBondContact O-N 3Å; T613-H616 PolarHBondContact O-CE1 3.25Å; T613-H616 VanDerWaalsContact O-CE1 3.24Å; T613-H616 PolarHBondContact O-ND1 2.95Å
614	V	95.1	Very high	95.1	Very high	3 Å²	3	44.4 Å²	44.4	2%	0.018	22%	0.216	C	C	.	.	H	α-helix	trans	-95.4	-1.3	-177.1	-52	0	0	0	0	113.5	Y490 L581 L584 V610 L611 E612 H616 K617 L618	Y490-V614 HydrophobicContact CD1-CG1 3.68Å; Y490-V614 HydrophobicContact CE1-CB 4.28Å; Y490-V614 HydrophobicContact CE1-CG1 3.8Å; L581-V614 HydrophobicContact CD1-CG1 3.84Å; L584-V614 HydrophobicContact CB-CG2 4.29Å; L584-V614 HydrophobicContact CD1-CG2 3.93Å; V610-V614 HydrophobicContact CG1-CG1 4.42Å; V610-V614 WeakPolarHBondContact O-CG2 3.48Å; V610-V614 PolarHBondContact O-N 3.46Å; V610-V614 VanDerWaalsContact O-N 3.07Å; L611-V614 PolarHBondContact O-N 3.37Å; E612-V614 VanDerWaalsContact C-N 3.34Å; E612-V614 PolarHBondContact O-N 3.38Å; V614-H616 PolarHBondContact O-N 3.17Å; V614-K617 WeakPolarHBondContact O-CA 3.33Å; V614-K617 WeakPolarHBondContact O-CB 3.44Å; V614-K617 PolarHBondContact O-N 3.34Å; V614-L618 HydrophobicContact CG2-CD1 4.16Å; V614-L618 HydrophobicContact CG2-CD2 4.41Å; V614-L618 HydrophobicContact CG2-CG 4.3Å; V614-L618 PolarHBondContact O-N 3.46Å
615	R	94	Very high	95.2	Very high	91 Å²	91	44.4 Å²	44.4	34%	0.343	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-54	-37	-171	106.9	-179	-145	-140.1	6.4	113.2	L611 E612 K617 L618	L611-R615 WeakPolarHBondContact O-CA 3.29Å; L611-R615 VanDerWaalsContact O-CB 3.32Å; L611-R615 WeakPolarHBondContact O-CB 3.41Å; L611-R615 PolarHBondContact O-N 3.36Å; E612-R615 PolarHBondContact O-N 2.89Å; R615-K617 PolarHBondContact O-N 3.34Å; R615-L618 PolarHBondContact O-N 3.11Å
616	H	93.7	Very high	95.4	Very high	128 Å²	128	43.5 Å²	43.5	59%	0.593	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-72.3	-16.6	-178.7	68.3	-83.9	0	0	0	113	T613 V614	T613-H616 PolarHBondContact O-CE1 3.25Å; T613-H616 VanDerWaalsContact O-CE1 3.24Å; T613-H616 PolarHBondContact O-ND1 2.95Å; V614-H616 PolarHBondContact O-N 3.17Å
617	K	95.4	Very high	95.6	Very high	59 Å²	59	37.9 Å²	37.9	26%	0.257	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-94.2	-3	175.7	-52.3	-169.4	-175.9	-136.4	0	112.9	F489 Y490 V614 R615	F489-K617 PolarHBondContact O-NZ 2.86Å; Y490-K617 HydrophobicContact CD1-CD 4.18Å; Y490-K617 HydrophobicContact CE1-CD 3.77Å; V614-K617 WeakPolarHBondContact O-CA 3.33Å; V614-K617 WeakPolarHBondContact O-CB 3.44Å; V614-K617 PolarHBondContact O-N 3.34Å; R615-K617 PolarHBondContact O-N 3.34Å
618	L	96.5	Very high	95.6	Very high	7 Å²	7	38 Å²	38	4%	0.037	19%	0.187	C	C	.	.			trans	-101.7	139.5	178.4	-53.4	179.5	0	0	0	110.6	L584 R588 L611 V614 R615 C620 R621	L584-L618 HydrophobicContact CD2-CD1 4.47Å; L584-L618 WeakPolarHBondContact O-CD2 3.32Å; R588-L618 HydrophobicContact CB-CD2 3.74Å; L611-L618 HydrophobicContact CD1-CD1 3.46Å; L611-L618 VanDerWaalsContact CD1-CD1 3.46Å; V614-L618 HydrophobicContact CG2-CD1 4.16Å; V614-L618 HydrophobicContact CG2-CD2 4.41Å; V614-L618 HydrophobicContact CG2-CG 4.3Å; V614-L618 PolarHBondContact O-N 3.46Å; R615-L618 PolarHBondContact O-N 3.11Å; L618-C620 WeakPolarHBondContact CB-O 3.44Å; L618-R621 WeakPolarHBondContact O-CG 3.19Å
619	V	96.6	Very high	95.6	Very high	94 Å²	94	38.2 Å²	38.2	57%	0.57	19%	0.188	S	C	*	.	S	Bend	trans	-65.7	-49.8	168	177.5	0	0	0	0	109.6	R588 P591 R621	R588-V619 WeakPolarHBondContact O-CG2 3.32Å; R588-V619 PolarHBondContact O-N 3.22Å; P591-V619 HydrophobicContact CB-CG1 4.22Å; V619-R621 PolarHBondContact O-N 3.19Å
620	C	95.6	Very high	95.6	Very high	12 Å²	12	37.2 Å²	37.2	8%	0.081	18%	0.177	C	C	.	.	S	Bend	trans	-83.9	93.6	168.7	-178.4	0	0	0	0	110	V590 P591 F593 L618 E622	V590-C620 WeakPolarHBondContact O-CB 3.4Å; P591-C620 WeakPolarHBondContact O-CB 3.24Å; F593-C620 HydrophobicContact CD1-CB 3.78Å; F593-C620 HydrophobicContact CE1-CB 3.61Å; L618-C620 WeakPolarHBondContact CB-O 3.44Å; C620-E622 PolarHBondContact O-N 3.33Å
621	R	94.8	Very high	95.2	Very high	149 Å²	149	37.3 Å²	37.3	56%	0.562	18%	0.18	S	C	*	.	S	Bend	trans	-69.8	-27.7	-173.9	-62.9	-175.2	174.4	174.8	-1.9	114.9	L618 V619	L618-R621 WeakPolarHBondContact O-CG 3.19Å; V619-R621 PolarHBondContact O-N 3.19Å
622	E	94.3	Very high	94.7	Very high	72 Å²	72	38.6 Å²	38.6	34%	0.336	19%	0.188	S	C	.	.	S	Bend	trans	-135.1	58.4	-170.8	-64.8	175.2	177.3	0	0	111.2	C620 R865	C620-E622 PolarHBondContact O-N 3.33Å; E622-R865 PolarHBondContact O-NE 3.04Å; E622-R865 PolarHBondContact O-NH2 3.46Å
623	P	97	Very high	94.3	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.013	18%	0.184	C	C	.	.			trans	-62.4	133.9	-179.3	29	-35.9	0	0	0	111	F593 V595 L611 I625	F593-P623 HydrophobicContact CD2-CB 3.88Å; F593-P623 HydrophobicContact CD2-CG 4.5Å; F593-P623 HydrophobicContact CE1-CB 4.41Å; F593-P623 HydrophobicContact CE2-CB 3.59Å; F593-P623 HydrophobicContact CE2-CG 3.71Å; F593-P623 HydrophobicContact CG-CB 4.4Å; F593-P623 HydrophobicContact CZ-CB 3.88Å; F593-P623 HydrophobicContact CZ-CG 3.75Å; F593-P623 WeakPolarHBondContact O-CB 3.18Å; V595-P623 HydrophobicContact CG2-CB 4.1Å; V595-P623 HydrophobicContact CG2-CG 4.1Å; L611-P623 HydrophobicContact CD1-CG 3.99Å; L611-P623 HydrophobicContact CD2-CG 4.02Å; P623-I625 WeakPolarHBondContact O-CG1 3.2Å
624	P	97.8	Very high	94.3	Very high	4 Å²	4	34 Å²	34	3%	0.026	17%	0.168	C	C	.	.			trans	-63.4	137.5	177.2	-22.1	32.4	0	0	0	112.9	R594 V595 E663 R865 L867	R594-P624 HydrophobicContact CG-CB 4.47Å; R594-P624 HydrophobicContact CG-CG 4.47Å; V595-P624 PolarHBondContact N-O 3.24Å; P624-E663 HydrophobicContact CB-CG 4Å; P624-E663 HydrophobicContact CG-CG 3.86Å; P624-E663 WeakPolarHBondContact CG-OE2 3.43Å; P624-R865 WeakPolarHBondContact CA-O 3.29Å; P624-R865 HydrophobicContact CB-CB 4.24Å; P624-R865 HydrophobicContact CG-CB 4.26Å; P624-L867 HydrophobicContact CB-CD2 3.59Å; P624-L867 HydrophobicContact CB-CG 3.87Å
625	I	98.4	Very high	94.3	Very high	2 Å²	2	34 Å²	34	1%	0.01	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	120.9	-174.7	-48.8	-172.5	0	0	0	112.4	V595 V597 L608 L611 P623 R865 M866 L867	V595-I625 HydrophobicContact CB-CG1 4.16Å; V595-I625 HydrophobicContact CB-CG2 4.36Å; V595-I625 HydrophobicContact CG1-CG2 4.3Å; V595-I625 CarbonylContact O-C 3.53Å; V595-I625 WeakPolarHBondContact O-CA 3.41Å; V597-I625 HydrophobicContact CG2-CG2 3.74Å; L608-I625 HydrophobicContact CD2-CD1 3.54Å; L608-I625 HydrophobicContact CG-CD1 4.26Å; L611-I625 HydrophobicContact CD2-CD1 3.88Å; P623-I625 WeakPolarHBondContact O-CG1 3.2Å; I625-R865 PolarHBondContact N-O 2.72Å; I625-M866 HydrophobicContact CB-CE 4.24Å; I625-M866 HydrophobicContact CB-SD 4.05Å; I625-M866 HydrophobicContact CG2-CE 4.48Å; I625-M866 CarbonylContact O-C 2.98Å; I625-M866 WeakPolarHBondContact O-CA 3.37Å; I625-L867 PolarHBondContact O-N 2.78Å
626	G	97.9	Very high	94.4	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	163	169.5	0	0	0	0	0	113	V595 V597	V595-G626 PolarHBondContact O-N 2.92Å; V597-G626 PolarHBondContact N-O 2.78Å
627	I	97.7	Very high	94.5	Very high	3 Å²	3	23.6 Å²	23.6	2%	0.015	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	132.3	-173.4	-54.4	171.4	0	0	0	110.8	V597 V604 L636 A637 L640 W642 M866	V597-I627 CarbonylContact O-C 3.6Å; V597-I627 WeakPolarHBondContact O-CA 3.15Å; V604-I627 HydrophobicContact CG1-CD1 4.08Å; V604-I627 HydrophobicContact CG1-CG1 4.39Å; V604-I627 HydrophobicContact CG2-CD1 3.98Å; V604-I627 HydrophobicContact CG2-CG1 3.96Å; V604-I627 HydrophobicContact CG2-CG2 4.03Å; I627-L636 HydrophobicContact CD1-CB 4.29Å; I627-L636 HydrophobicContact CD1-CD2 3.79Å; I627-L636 HydrophobicContact CD1-CG 3.73Å; I627-A637 HydrophobicContact CB-CB 4.46Å; I627-A637 HydrophobicContact CG2-CB 4.05Å; I627-L640 HydrophobicContact CD1-CD1 3.86Å; I627-W642 WeakPolarHBondContact O-CB 3.47Å; I627-W642 VanDerWaalsContact O-CD2 3.28Å; I627-M866 HydrophobicContact CD1-CE 4.06Å; I627-M866 HydrophobicContact CG1-CE 4.46Å
628	V	97.6	Very high	94.5	Very high	4 Å²	4	23.9 Å²	23.9	2%	0.024	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	110.8	159.1	-177.1	0	0	0	0	108.2	L559 L596 V597 C598 G599 L630 Y646 I654	L559-V628 HydrophobicContact CD1-CG1 3.88Å; L596-V628 HydrophobicContact CD1-CG2 3.9Å; L596-V628 HydrophobicContact CD2-CG2 4.16Å; L596-V628 HydrophobicContact CG-CG2 4.21Å; V597-V628 PolarHBondContact O-N 2.87Å; C598-V628 HydrophobicContact CB-CB 4.06Å; G599-V628 PolarHBondContact N-O 3.25Å; G599-V628 VanDerWaalsContact N-O 3.13Å; V628-L630 HydrophobicContact CG1-CD2 4.48Å; V628-L630 HydrophobicContact CG1-CG 4.5Å; V628-L630 PolarHBondContact O-N 2.89Å; V628-Y646 HydrophobicContact CG1-CD2 4.23Å; V628-Y646 HydrophobicContact CG1-CG 4.2Å; V628-I654 HydrophobicContact CG1-CD1 4.42Å; V628-I654 HydrophobicContact CG2-CD1 4.5Å; V628-I654 HydrophobicContact CG2-CG2 3.69Å
629	P	95.9	Very high	94.5	Very high	6 Å²	6	25.7 Å²	25.7	4%	0.039	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	99.1	-169	27.9	-33.5	0	0	0	112	N634 A637 W642 G645 Y646	P629-N634 HydrophobicContact CB-CB 3.72Å; P629-A637 HydrophobicContact CB-CB 3.63Å; P629-A637 HydrophobicContact CG-CB 4.11Å; P629-W642 HydrophobicContact CG-CB 4.49Å; P629-G645 CarbonylContact O-C 3.33Å; P629-G645 WeakPolarHBondContact O-CA 3.47Å; P629-Y646 PolarHBondContact O-N 3.39Å
630	L	93.4	Very high	94.5	Very high	4 Å²	4	21.3 Å²	21.3	2%	0.021	11%	0.106	C	C	.	.			trans	-102.8	-4	178.2	-62.7	177.5	0	0	0	113.4	G552 K555 L559 C598 G599 V628 Y646	G552-L630 WeakPolarHBondContact CA-O 3.25Å; G552-L630 PolarHBondContact N-O 3.21Å; K555-L630 HydrophobicContact CB-CD2 4.24Å; L559-L630 HydrophobicContact CD1-CD1 4.02Å; L559-L630 HydrophobicContact CD1-CD2 3.85Å; L559-L630 HydrophobicContact CD1-CG 4.34Å; C598-L630 HydrophobicContact CB-CD1 3.94Å; G599-L630 PolarHBondContact O-N 2.8Å; V628-L630 HydrophobicContact CG1-CD2 4.48Å; V628-L630 HydrophobicContact CG1-CG 4.5Å; V628-L630 PolarHBondContact O-N 2.89Å; L630-Y646 HydrophobicContact CD2-CD1 3.67Å; L630-Y646 HydrophobicContact CD2-CG 4.04Å
631	G	87.1	Confident	94.5	Very high	14 Å²	14	25.5 Å²	25.5	14%	0.144	12%	0.12	C	C	.	.	S	Bend	trans	-79.7	-173.3	177.3	0	0	0	0	0	114.1	N634 R726	G631-N634 WeakPolarHBondContact CA-OD1 3.32Å; G631-N634 PolarHBondContact N-OD1 3.26Å; G631-N634 PolarHBondContact O-ND2 2.71Å; G631-R726 WeakPolarHBondContact O-CD 3.26Å
632	T	84.6	Confident	94.5	Very high	40 Å²	40	19.7 Å²	19.7	25%	0.245	10%	0.098	C	C	.	.	S	Bend	trans	-90.5	-43.1	177.5	-51.2	0	0	0	0	112.5	R726 N729 K730	T632-R726 HydrophobicContact CG2-CB 4.37Å; T632-N729 HydrophobicContact CG2-CB 4Å; T632-N729 PolarHBondContact OG1-ND2 3.49Å; T632-K730 HydrophobicContact CG2-CG 3.79Å
633	G	84.6	Confident	94.5	Very high	19 Å²	19	17.2 Å²	17.2	20%	0.196	9%	0.092	C	C	.	.			trans	-81.6	-63.2	179.9	0	0	0	0	0	112.9	D635 R638	G633-D635 VanDerWaalsContact C-N 3.32Å; G633-D635 PolarHBondContact O-N 3.26Å; G633-R638 PolarHBondContact O-NE 3.3Å; G633-R638 PolarHBondContact O-NH2 2.89Å
634	N	92.9	Very high	94.3	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.005	12%	0.115	C	C	.	.			trans	58.5	38.7	177.6	-52.8	-48.7	0	0	0	112.8	D601 P629 G631 L636 A637 R638 P644	D601-N634 WeakPolarHBondContact OD2-CA 3.39Å; D601-N634 PolarHBondContact OD2-N 3.06Å; P629-N634 HydrophobicContact CB-CB 3.72Å; G631-N634 WeakPolarHBondContact CA-OD1 3.32Å; G631-N634 PolarHBondContact N-OD1 3.26Å; G631-N634 PolarHBondContact O-ND2 2.71Å; N634-L636 PolarHBondContact O-N 3.28Å; N634-A637 HydrophobicContact CB-CB 4.12Å; N634-A637 PolarHBondContact O-N 2.81Å; N634-R638 VanDerWaalsContact O-CG 3.31Å; N634-R638 WeakPolarHBondContact O-CG 3.49Å; N634-R638 PolarHBondContact O-N 3.31Å; N634-R638 VanDerWaalsContact O-N 3.11Å; N634-P644 PolarHBondContact ND2-O 3.02Å
635	D	95.3	Very high	94	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.011	12%	0.122	C	C	.	.	H	α-helix	trans	-61.1	-43.9	-174.9	-73.3	-80.7	0	0	0	111.7	D601 G633 A637 R638 I639 Y699 I773 S775 W776 S778 G779	D601-D635 PolarHBondContact OD1-N 3.23Å; D601-D635 PolarHBondContact OD2-N 3.04Å; G633-D635 VanDerWaalsContact C-N 3.32Å; G633-D635 PolarHBondContact O-N 3.26Å; D635-A637 VanDerWaalsContact C-N 3.34Å; D635-A637 PolarHBondContact O-N 3.29Å; D635-R638 WeakPolarHBondContact O-CB 3.34Å; D635-R638 PolarHBondContact O-N 2.89Å; D635-I639 PolarHBondContact O-N 2.94Å; D635-Y699 HydrophobicContact CB-CE1 4.45Å; D635-I773 HydrophobicContact CB-CD1 3.84Å; D635-S775 WeakPolarHBondContact CB-OG 3.3Å; D635-S775 PolarHBondContact OD1-OG 3.14Å; D635-W776 PolarHBondContact OD1-N 2.91Å; D635-S778 PolarHBondContact OD1-N 3.14Å; D635-S778 PolarHBondContact OD2-N 3.21Å; D635-S778 VanDerWaalsContact OD2-N 3.1Å; D635-G779 PolarHBondContact OD1-N 2.82Å
636	L	95.6	Very high	93.7	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.01	13%	0.125	C	C	.	.	H	α-helix	trans	-63.7	-40.7	177.5	-175.7	54	0	0	0	112.2	D601 V604 I627 N634 R638 I639 L640 M666 I773 I796 M866	D601-L636 PolarHBondContact OD1-N 2.82Å; V604-L636 HydrophobicContact CG1-CD2 4Å; I627-L636 HydrophobicContact CD1-CB 4.29Å; I627-L636 HydrophobicContact CD1-CD2 3.79Å; I627-L636 HydrophobicContact CD1-CG 3.73Å; N634-L636 PolarHBondContact O-N 3.28Å; L636-R638 VanDerWaalsContact C-N 3.28Å; L636-R638 PolarHBondContact O-N 3.47Å; L636-I639 PolarHBondContact O-N 3.26Å; L636-L640 HydrophobicContact CD1-CD1 4Å; L636-L640 HydrophobicContact CD1-CG 4.28Å; L636-L640 HydrophobicContact CG-CD1 4Å; L636-L640 WeakPolarHBondContact O-CB 3.33Å; L636-L640 WeakPolarHBondContact O-CG 3.4Å; L636-L640 PolarHBondContact O-N 3.1Å; L636-M666 HydrophobicContact CD1-SD 3.55Å; L636-M666 VanDerWaalsContact CD1-SD 3.55Å; L636-M666 HydrophobicContact CD2-CE 4.34Å; L636-M666 HydrophobicContact CD2-SD 4.13Å; L636-M666 HydrophobicContact CG-SD 4.49Å; L636-I773 HydrophobicContact CB-CD1 4.49Å; L636-I773 HydrophobicContact CD1-CG2 4.48Å; L636-I796 HydrophobicContact CD1-CD1 3.88Å; L636-M866 HydrophobicContact CD2-CE 4.04Å
637	A	96.5	Very high	93.1	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-65.5	-30.3	178.5	0	0	0	0	0	112.8	I627 P629 N634 D635 L640 R641 W642 G643	I627-A637 HydrophobicContact CB-CB 4.46Å; I627-A637 HydrophobicContact CG2-CB 4.05Å; P629-A637 HydrophobicContact CB-CB 3.63Å; P629-A637 HydrophobicContact CG-CB 4.11Å; N634-A637 HydrophobicContact CB-CB 4.12Å; N634-A637 PolarHBondContact O-N 2.81Å; D635-A637 VanDerWaalsContact C-N 3.34Å; D635-A637 PolarHBondContact O-N 3.29Å; A637-L640 CarbonylContact O-C 3.54Å; A637-R641 PolarHBondContact O-N 2.83Å; A637-R641 VanDerWaalsContact O-N 3.08Å; A637-W642 HydrophobicContact CB-CB 4.16Å; A637-W642 PolarHBondContact O-N 3.4Å; A637-G643 PolarHBondContact O-N 2.79Å
638	R	95.3	Very high	92.6	Very high	64 Å²	64	27.2 Å²	27.2	24%	0.242	18%	0.177	C	C	.	.	H	α-helix	trans	-67	-47.7	174.8	-67.8	163.5	-170.7	-71.9	-5.6	111	G633 N634 D635 L636 L640 R641 P644 G779	G633-R638 PolarHBondContact O-NE 3.3Å; G633-R638 PolarHBondContact O-NH2 2.89Å; N634-R638 VanDerWaalsContact O-CG 3.31Å; N634-R638 WeakPolarHBondContact O-CG 3.49Å; N634-R638 PolarHBondContact O-N 3.31Å; N634-R638 VanDerWaalsContact O-N 3.11Å; D635-R638 WeakPolarHBondContact O-CB 3.34Å; D635-R638 PolarHBondContact O-N 2.89Å; L636-R638 VanDerWaalsContact C-N 3.28Å; L636-R638 PolarHBondContact O-N 3.47Å; R638-L640 VanDerWaalsContact C-N 3.29Å; R638-L640 PolarHBondContact O-N 3.27Å; R638-R641 WeakPolarHBondContact O-CA 3.48Å; R638-R641 PolarHBondContact O-N 2.78Å; R638-P644 VanDerWaalsContact CZ-CB 3.49Å; R638-P644 VanDerWaalsContact NH2-CA 3.29Å; R638-P644 VanDerWaalsContact NH2-CB 3.26Å; R638-P644 PolarHBondContact NH2-O 2.79Å; R638-G779 VanDerWaalsContact CD-CA 3.49Å
639	I	95.3	Very high	92.2	Very high	45 Å²	45	31.2 Å²	31.2	23%	0.231	20%	0.199	C	C	.	.	H	α-helix	trans	-61.3	-41	177.6	-62.7	-47.7	0	0	0	111.2	D635 L636 R641 I773 P774 I796	D635-I639 PolarHBondContact O-N 2.94Å; L636-I639 PolarHBondContact O-N 3.26Å; I639-R641 PolarHBondContact O-N 3.18Å; I639-I773 HydrophobicContact CG1-CB 4.17Å; I639-I773 HydrophobicContact CG1-CD1 4.27Å; I639-P774 HydrophobicContact CD1-CG 3.82Å; I639-I796 HydrophobicContact CG2-CD1 4.16Å
640	L	96.6	Very high	92	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.01	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	5.5	175.6	-64.6	175.4	0	0	0	114	I627 L636 A637 R638 W642 V664 M866 R868 K869	I627-L640 HydrophobicContact CD1-CD1 3.86Å; L636-L640 HydrophobicContact CD1-CD1 4Å; L636-L640 HydrophobicContact CD1-CG 4.28Å; L636-L640 HydrophobicContact CG-CD1 4Å; L636-L640 WeakPolarHBondContact O-CB 3.33Å; L636-L640 WeakPolarHBondContact O-CG 3.4Å; L636-L640 PolarHBondContact O-N 3.1Å; A637-L640 CarbonylContact O-C 3.54Å; R638-L640 VanDerWaalsContact C-N 3.29Å; R638-L640 PolarHBondContact O-N 3.27Å; L640-W642 PolarHBondContact O-N 2.89Å; L640-V664 HydrophobicContact CD2-CG2 3.66Å; L640-M866 HydrophobicContact CD1-CB 3.86Å; L640-M866 HydrophobicContact CD1-CE 3.64Å; L640-M866 HydrophobicContact CD1-CG 4.3Å; L640-M866 HydrophobicContact CD2-CB 3.84Å; L640-R868 HydrophobicContact CD2-CB 4.2Å; L640-R868 WeakPolarHBondContact O-CA 3.48Å; L640-R868 WeakPolarHBondContact O-CG 3.48Å; L640-K869 PolarHBondContact O-N 2.91Å
641	R	95.9	Very high	92	Very high	101 Å²	101	36.4 Å²	36.4	38%	0.381	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	18.2	175.2	-52.6	178.9	-179.4	160.7	3.5	115.5	A637 R638 I639 R868 K869	A637-R641 PolarHBondContact O-N 2.83Å; A637-R641 VanDerWaalsContact O-N 3.08Å; R638-R641 WeakPolarHBondContact O-CA 3.48Å; R638-R641 PolarHBondContact O-N 2.78Å; I639-R641 PolarHBondContact O-N 3.18Å; R641-R868 HydrophobicContact CG-CG 4.33Å; R641-K869 HydrophobicContact CB-CB 4.16Å; R641-K869 WeakPolarHBondContact O-CB 3.46Å; R641-K869 WeakPolarHBondContact O-CD 3.49Å
642	W	95.6	Very high	92.3	Very high	27 Å²	27	39.6 Å²	39.6	10%	0.102	24%	0.235	C	C	.	.	S	Bend	trans	-75.5	-17.4	169.5	-65.8	104.3	0	0	0	112.4	I627 P629 A637 L640 V658 A661 L867 K869	I627-W642 WeakPolarHBondContact O-CB 3.47Å; I627-W642 VanDerWaalsContact O-CD2 3.28Å; P629-W642 HydrophobicContact CG-CB 4.49Å; A637-W642 HydrophobicContact CB-CB 4.16Å; A637-W642 PolarHBondContact O-N 3.4Å; L640-W642 PolarHBondContact O-N 2.89Å; W642-V658 HydrophobicContact CH2-CB 4.36Å; W642-V658 HydrophobicContact CH2-CG2 3.52Å; W642-V658 HydrophobicContact CZ2-CG2 4.32Å; W642-V658 HydrophobicContact CZ3-CG2 4.05Å; W642-A661 HydrophobicContact CH2-CB 4.48Å; W642-A661 HydrophobicContact CZ2-CB 4.18Å; W642-L867 HydrophobicContact CZ2-CB 4.27Å; W642-L867 PolarHBondContact NE1-O 3.48Å; W642-K869 HydrophobicContact CD2-CB 4.07Å; W642-K869 HydrophobicContact CE3-CB 4.21Å; W642-K869 HydrophobicContact CE3-CD 4.09Å; W642-K869 HydrophobicContact CE3-CG 4.43Å; W642-K869 HydrophobicContact CH2-CB 4.39Å; W642-K869 HydrophobicContact CZ2-CB 4.27Å; W642-K869 HydrophobicContact CZ3-CB 4.37Å; W642-K869 HydrophobicContact CZ3-CD 4.26Å; W642-K869 HydrophobicContact CZ3-CG 4.33Å
643	G	93.7	Very high	92.8	Very high	19 Å²	19	42 Å²	42	20%	0.196	24%	0.244	C	C	.	.			trans	103.4	-179.6	167.9	0	0	0	0	0	114	A637 G645	A637-G643 PolarHBondContact O-N 2.79Å; G643-G645 PolarHBondContact O-N 2.9Å
644	P	92.4	Very high	93.3	Very high	78 Å²	78	41.7 Å²	41.7	51%	0.506	24%	0.237	S	C	.	.	S	Bend	trans	-67.4	-19.1	-173.5	26.6	-36.8	0	0	0	114.8	N634 R638	N634-P644 PolarHBondContact ND2-O 3.02Å; R638-P644 VanDerWaalsContact CZ-CB 3.49Å; R638-P644 VanDerWaalsContact NH2-CA 3.29Å; R638-P644 VanDerWaalsContact NH2-CB 3.26Å; R638-P644 PolarHBondContact NH2-O 2.79Å
645	G	91.9	Very high	93.5	Very high	16 Å²	16	41.7 Å²	41.7	17%	0.165	24%	0.237	C	C	.	.	S	Bend	trans	157	156.6	-173.8	0	0	0	0	0	111.7	P629 G643 G647 R726	P629-G645 CarbonylContact O-C 3.33Å; P629-G645 WeakPolarHBondContact O-CA 3.47Å; G643-G645 PolarHBondContact O-N 2.9Å; G645-G647 PolarHBondContact O-N 2.95Å; G645-R726 VanDerWaalsContact CA-NH1 3.35Å
646	Y	92.3	Very high	93.5	Very high	18 Å²	18	41.9 Å²	41.9	7%	0.071	24%	0.239	C	C	.	.			trans	-70.6	120.3	-174.1	177.9	-125.8	0	0	0	112.3	K555 L559 V628 P629 L630 G648 D649 I654	K555-Y646 HydrophobicContact CB-CD1 4.2Å; K555-Y646 HydrophobicContact CB-CE1 4.39Å; K555-Y646 HydrophobicContact CD-CD1 4Å; K555-Y646 HydrophobicContact CD-CE1 4.47Å; K555-Y646 PolarHBondContact NZ-O 2.99Å; K555-Y646 VanDerWaalsContact NZ-O 3.12Å; L559-Y646 HydrophobicContact CD1-CD1 3.88Å; L559-Y646 HydrophobicContact CD1-CE1 3.73Å; L559-Y646 HydrophobicContact CD1-CG 4.45Å; L559-Y646 HydrophobicContact CD2-CE1 4.05Å; L559-Y646 HydrophobicContact CD2-CE2 4.41Å; L559-Y646 HydrophobicContact CG-CD1 4.48Å; L559-Y646 HydrophobicContact CG-CE1 3.83Å; V628-Y646 HydrophobicContact CG1-CD2 4.23Å; V628-Y646 HydrophobicContact CG1-CG 4.2Å; P629-Y646 PolarHBondContact O-N 3.39Å; L630-Y646 HydrophobicContact CD2-CD1 3.67Å; L630-Y646 HydrophobicContact CD2-CG 4.04Å; Y646-G648 VanDerWaalsContact CZ-CA 3.45Å; Y646-D649 HydrophobicContact CE2-CB 3.99Å; Y646-D649 WeakPolarHBondContact CE2-O 3.45Å; Y646-D649 PolarHBondContact OH-O 2.93Å; Y646-I654 HydrophobicContact CD2-CD1 4.2Å; Y646-I654 HydrophobicContact CE2-CD1 3.66Å
647	G	85.7	Confident	93.5	Very high	59 Å²	59	42.2 Å²	42.2	61%	0.608	24%	0.242	S	C	*	.			trans	-82.8	-10.9	-178.9	0	0	0	0	0	114.6	G645	G645-G647 PolarHBondContact O-N 2.95Å
648	G	86.2	Confident	93.5	Very high	50 Å²	50	42.3 Å²	42.3	52%	0.515	24%	0.242	S	C	.	.			trans	96.1	23.5	-165.6	0	0	0	0	0	113.3	Y646	Y646-G648 VanDerWaalsContact CZ-CA 3.45Å
649	D	89	Confident	93.4	Very high	89 Å²	89	42.2 Å²	42.2	48%	0.476	25%	0.247	S	C	.	.			trans	-55.7	151	175	-52.3	-62.3	0	0	0	111.6	Y646 P651	Y646-D649 HydrophobicContact CE2-CB 3.99Å; Y646-D649 WeakPolarHBondContact CE2-O 3.45Å; Y646-D649 PolarHBondContact OH-O 2.93Å; D649-P651 VanDerWaalsContact O-CD 3.31Å; D649-P651 WeakPolarHBondContact O-CD 3.02Å; D649-P651 VanDerWaalsContact O-N 3.16Å
650	D	91.5	Very high	93.4	Very high	100 Å²	100	44.4 Å²	44.4	54%	0.535	26%	0.256	S	S	.	.			trans	-56.6	121.6	175.8	179.1	6.5	0	0	0	110.7	Y652 H653 I654	D650-Y652 PolarHBondContact O-N 3.01Å; D650-Y652 VanDerWaalsContact O-N 3.08Å; D650-Y652 PolarHBondContact OD1-N 3.07Å; D650-H653 HydrophobicContact CB-CB 4.36Å; D650-H653 WeakPolarHBondContact O-CB 3.36Å; D650-H653 PolarHBondContact O-N 3.09Å; D650-I654 PolarHBondContact O-N 2.61Å
651	P	94.7	Very high	93.4	Very high	18 Å²	18	44.6 Å²	44.6	12%	0.117	26%	0.258	C	S	.	.	H	α-helix	trans	-53.4	-30.2	178.2	-28.8	37.3	0	0	0	113.7	L559 F563 L566 D649 I654 L655	L559-P651 HydrophobicContact CD2-CB 4.37Å; L559-P651 HydrophobicContact CD2-CG 4.05Å; F563-P651 HydrophobicContact CD1-CB 4.27Å; F563-P651 HydrophobicContact CE1-CB 3.83Å; F563-P651 HydrophobicContact CZ-CB 4.47Å; L566-P651 HydrophobicContact CD1-CB 3.85Å; D649-P651 VanDerWaalsContact O-CD 3.31Å; D649-P651 WeakPolarHBondContact O-CD 3.02Å; D649-P651 VanDerWaalsContact O-N 3.16Å; P651-I654 WeakPolarHBondContact O-CB 3.23Å; P651-I654 PolarHBondContact O-N 3.03Å; P651-L655 WeakPolarHBondContact O-CG 3.5Å; P651-L655 PolarHBondContact O-N 2.71Å; P651-L655 VanDerWaalsContact O-N 3.16Å
652	Y	93.5	Very high	93.4	Very high	82 Å²	82	43.1 Å²	43.1	32%	0.322	26%	0.257	S	S	.	.	H	α-helix	trans	-64.6	-40.2	174.7	-175	-89.5	0	0	0	112.5	R212 L213 L566 D650 I654 L655 A656	R212-Y652 WeakPolarHBondContact CB-OH 3.34Å; L213-Y652 HydrophobicContact CD1-CD2 3.97Å; L213-Y652 HydrophobicContact CD1-CE2 3.87Å; L213-Y652 HydrophobicContact CD2-CE2 4.25Å; L213-Y652 HydrophobicContact CG-CD2 4.42Å; L213-Y652 HydrophobicContact CG-CE2 3.89Å; L566-Y652 HydrophobicContact CD2-CD2 4.27Å; D650-Y652 PolarHBondContact O-N 3.01Å; D650-Y652 VanDerWaalsContact O-N 3.08Å; D650-Y652 PolarHBondContact OD1-N 3.07Å; Y652-I654 VanDerWaalsContact C-N 3.33Å; Y652-L655 PolarHBondContact O-N 3.14Å; Y652-A656 PolarHBondContact O-N 2.85Å
653	H	94.1	Very high	93.5	Very high	91 Å²	91	45.9 Å²	45.9	42%	0.421	27%	0.271	S	S	.	.	H	α-helix	trans	-68.6	-32.7	177.5	-178.5	-92.3	0	0	0	112.2	D650 A656 S657	D650-H653 HydrophobicContact CB-CB 4.36Å; D650-H653 WeakPolarHBondContact O-CB 3.36Å; D650-H653 PolarHBondContact O-N 3.09Å; H653-A656 PolarHBondContact O-N 3.47Å; H653-S657 WeakPolarHBondContact O-CB 3.41Å; H653-S657 PolarHBondContact O-N 2.86Å; H653-S657 PolarHBondContact O-OG 2.84Å
654	I	96.1	Very high	93.6	Very high	12 Å²	12	46 Å²	46	6%	0.062	27%	0.269	C	S	.	.	H	α-helix	trans	-60	-50.9	171.2	-58.1	175.7	0	0	0	109.6	L559 F563 L596 V628 Y646 D650 P651 Y652 A656 S657 V658	L559-I654 HydrophobicContact CD2-CD1 4.08Å; F563-I654 HydrophobicContact CZ-CD1 4.44Å; F563-I654 HydrophobicContact CZ-CG2 4.35Å; L596-I654 HydrophobicContact CD2-CG2 4.45Å; V628-I654 HydrophobicContact CG1-CD1 4.42Å; V628-I654 HydrophobicContact CG2-CD1 4.5Å; V628-I654 HydrophobicContact CG2-CG2 3.69Å; Y646-I654 HydrophobicContact CD2-CD1 4.2Å; Y646-I654 HydrophobicContact CE2-CD1 3.66Å; D650-I654 PolarHBondContact O-N 2.61Å; P651-I654 WeakPolarHBondContact O-CB 3.23Å; P651-I654 PolarHBondContact O-N 3.03Å; Y652-I654 VanDerWaalsContact C-N 3.33Å; I654-A656 PolarHBondContact O-N 3.32Å; I654-S657 WeakPolarHBondContact O-CB 3.35Å; I654-S657 PolarHBondContact O-N 3.06Å; I654-S657 VanDerWaalsContact O-N 3.11Å; I654-V658 WeakPolarHBondContact O-CG2 3.12Å; I654-V658 PolarHBondContact O-N 3.47Å
655	L	96.6	Very high	93.8	Very high	0 Å²	0	47 Å²	47	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60.4	-44.2	179	-64.8	176.8	0	0	0	111.7	L213 M216 L543 F563 L566 L567 L596 P651 Y652 S657 V658 D659	L213-L655 HydrophobicContact CD1-CD1 3.76Å; L213-L655 HydrophobicContact CD2-CB 3.87Å; M216-L655 WeakPolarHBondContact CE-O 3.49Å; M216-L655 HydrophobicContact SD-CB 3.97Å; M216-L655 HydrophobicContact SD-CD2 4.28Å; L543-L655 HydrophobicContact CD2-CD2 3.63Å; F563-L655 HydrophobicContact CD1-CD1 4.09Å; F563-L655 HydrophobicContact CD1-CD2 4.04Å; F563-L655 HydrophobicContact CD1-CG 4.15Å; F563-L655 HydrophobicContact CE1-CD1 4.24Å; F563-L655 HydrophobicContact CE1-CD2 3.8Å; F563-L655 HydrophobicContact CE1-CG 3.82Å; L566-L655 HydrophobicContact CB-CD1 3.93Å; L566-L655 HydrophobicContact CD1-CD1 4.01Å; L567-L655 HydrophobicContact CD1-CD1 4.35Å; L567-L655 HydrophobicContact CD1-CD2 4.04Å; L567-L655 HydrophobicContact CD2-CD1 3.98Å; L567-L655 HydrophobicContact CG-CD1 4.02Å; L596-L655 HydrophobicContact CD2-CD2 4.31Å; P651-L655 WeakPolarHBondContact O-CG 3.5Å; P651-L655 PolarHBondContact O-N 2.71Å; P651-L655 VanDerWaalsContact O-N 3.16Å; Y652-L655 PolarHBondContact O-N 3.14Å; L655-S657 VanDerWaalsContact C-N 3.28Å; L655-S657 PolarHBondContact O-N 2.95Å; L655-V658 WeakPolarHBondContact O-CB 3.18Å; L655-V658 PolarHBondContact O-N 3.32Å; L655-D659 PolarHBondContact O-N 3.09Å
656	A	94.7	Very high	94	Very high	7 Å²	7	46.2 Å²	46.2	6%	0.058	26%	0.259	C	S	.	.	H	α-helix	trans	-58.3	-40.9	174.5	0	0	0	0	0	112.3	Y652 H653 I654 V658 D659 E660	Y652-A656 PolarHBondContact O-N 2.85Å; H653-A656 PolarHBondContact O-N 3.47Å; I654-A656 PolarHBondContact O-N 3.32Å; A656-V658 VanDerWaalsContact C-N 3.28Å; A656-V658 PolarHBondContact O-N 2.91Å; A656-D659 WeakPolarHBondContact O-CB 3.38Å; A656-D659 PolarHBondContact O-N 2.81Å; A656-E660 WeakPolarHBondContact O-CG 3.22Å; A656-E660 PolarHBondContact O-N 3.13Å
657	S	95.5	Very high	94.2	Very high	9 Å²	9	45.9 Å²	45.9	6%	0.063	26%	0.258	C	S	.	.	H	α-helix	trans	-65.5	-29.7	175.6	-58.3	0	0	0	0	112.9	H653 I654 L655 A661	H653-S657 WeakPolarHBondContact O-CB 3.41Å; H653-S657 PolarHBondContact O-N 2.86Å; H653-S657 PolarHBondContact O-OG 2.84Å; I654-S657 WeakPolarHBondContact O-CB 3.35Å; I654-S657 PolarHBondContact O-N 3.06Å; I654-S657 VanDerWaalsContact O-N 3.11Å; L655-S657 VanDerWaalsContact C-N 3.28Å; L655-S657 PolarHBondContact O-N 2.95Å; S657-A661 WeakPolarHBondContact O-CB 3.4Å; S657-A661 PolarHBondContact O-N 3.05Å
658	V	96.8	Very high	94.6	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.006	23%	0.232	C	C	.	.	H	α-helix	trans	-75	-37.1	176.5	171.1	0	0	0	0	111.7	L543 R594 L596 W642 I654 L655 A656 E660 L867	L543-V658 HydrophobicContact CD1-CG1 3.87Å; L543-V658 HydrophobicContact CD2-CG1 4.23Å; R594-V658 PolarHBondContact NH1-O 3.36Å; R594-V658 VanDerWaalsContact NH1-O 3.07Å; L596-V658 HydrophobicContact CD1-CG2 3.83Å; L596-V658 HydrophobicContact CD2-CG2 4.27Å; W642-V658 HydrophobicContact CH2-CB 4.36Å; W642-V658 HydrophobicContact CH2-CG2 3.52Å; W642-V658 HydrophobicContact CZ2-CG2 4.32Å; W642-V658 HydrophobicContact CZ3-CG2 4.05Å; I654-V658 WeakPolarHBondContact O-CG2 3.12Å; I654-V658 PolarHBondContact O-N 3.47Å; L655-V658 WeakPolarHBondContact O-CB 3.18Å; L655-V658 PolarHBondContact O-N 3.32Å; A656-V658 VanDerWaalsContact C-N 3.28Å; A656-V658 PolarHBondContact O-N 2.91Å; V658-E660 VanDerWaalsContact C-N 3.31Å; V658-L867 HydrophobicContact CG1-CD1 3.98Å
659	D	94.1	Very high	95.1	Very high	62 Å²	62	41.4 Å²	41.4	33%	0.332	21%	0.207	S	C	.	.	H	α-helix	trans	-59.4	-46.5	172.8	-157.2	46.9	0	0	0	110.5	S215 M216 R594 L655 A656 A661	S215-D659 PolarHBondContact OG-OD1 2.77Å; M216-D659 HydrophobicContact CE-CB 3.38Å; R594-D659 PolarHBondContact NH1-O 3.05Å; L655-D659 PolarHBondContact O-N 3.09Å; A656-D659 WeakPolarHBondContact O-CB 3.38Å; A656-D659 PolarHBondContact O-N 2.81Å; D659-A661 VanDerWaalsContact C-N 3.35Å; D659-A661 PolarHBondContact O-N 3.45Å
660	E	94.4	Very high	95.3	Very high	91 Å²	91	38 Å²	38	43%	0.425	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-1.1	-174.2	-64.7	171.9	-166.3	0	0	114	R212 A656 V658 S870	R212-E660 IonicContact CZ-OE1 2.84Å; R212-E660 IonicContact NH2-OE1 3.97Å; R212-E660 PolarHBondContact NH2-OE1 3.04Å; A656-E660 WeakPolarHBondContact O-CG 3.22Å; A656-E660 PolarHBondContact O-N 3.13Å; V658-E660 VanDerWaalsContact C-N 3.31Å; E660-S870 WeakPolarHBondContact O-CB 3.5Å; E660-S870 PolarHBondContact O-OG 2.84Å
661	A	96.9	Very high	95.5	Very high	7 Å²	7	33.3 Å²	33.3	6%	0.058	16%	0.164	C	C	.	.	P	Polyproline II helix	trans	-70.7	145.1	-174.8	0	0	0	0	0	113.2	W642 S657 D659 L867	W642-A661 HydrophobicContact CH2-CB 4.48Å; W642-A661 HydrophobicContact CZ2-CB 4.18Å; S657-A661 WeakPolarHBondContact O-CB 3.4Å; S657-A661 PolarHBondContact O-N 3.05Å; D659-A661 VanDerWaalsContact C-N 3.35Å; D659-A661 PolarHBondContact O-N 3.45Å; A661-L867 HydrophobicContact CB-CB 3.96Å; A661-L867 HydrophobicContact CB-CD2 4.25Å
662	D	96.7	Very high	95.4	Very high	69 Å²	69	34.8 Å²	34.8	37%	0.369	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	141	172.7	-62.1	-38.6	0	0	0	110.2	L867 R868	D662-L867 CarbonylContact O-C 3.51Å; D662-L867 WeakPolarHBondContact O-CA 3.16Å; D662-R868 PolarHBondContact N-O 2.97Å; D662-R868 PolarHBondContact O-N 2.76Å; D662-R868 IonicContact OD2-NH2 2.89Å
663	E	96.6	Very high	95.2	Very high	85 Å²	85	30.9 Å²	30.9	40%	0.397	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	131	167.4	-67	179.1	-151.7	0	0	109.8	R594 P624 R865 M866 L867	R594-E663 IonicContact CZ-OE1 3.21Å; R594-E663 IonicContact NE-OE1 3.21Å; R594-E663 IonicContact NH2-OE1 3.14Å; R594-E663 PolarHBondContact NH2-OE1 3.36Å; P624-E663 HydrophobicContact CB-CG 4Å; P624-E663 HydrophobicContact CG-CG 3.86Å; P624-E663 WeakPolarHBondContact CG-OE2 3.43Å; E663-R865 IonicContact OE2-CZ 3.44Å; E663-R865 IonicContact OE2-NH1 2.77Å; E663-R865 PolarHBondContact OE2-NH1 3.4Å; E663-M866 WeakPolarHBondContact CA-O 3.24Å; E663-L867 HydrophobicContact CG-CD2 3.89Å
664	V	96.8	Very high	94.4	Very high	23 Å²	23	29.7 Å²	29.7	14%	0.139	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	156.1	175.4	-59.3	0	0	0	0	109.9	L640 R865 M866 R868	L640-V664 HydrophobicContact CD2-CG2 3.66Å; V664-R865 WeakPolarHBondContact O-CA 3.28Å; V664-M866 HydrophobicContact CG2-CB 4.02Å; V664-M866 PolarHBondContact N-O 3.44Å; V664-M866 PolarHBondContact O-N 2.99Å; V664-R868 HydrophobicContact CG1-CB 3.91Å; V664-R868 HydrophobicContact CG2-CB 4.04Å
665	Q	96.7	Very high	92.7	Very high	98 Å²	98	29.9 Å²	29.9	46%	0.458	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	156.6	173	-69.9	-173.1	-30.9	0	0	110.7	D797 K863 V864	Q665-D797 HydrophobicContact CB-CB 4.19Å; Q665-K863 HydrophobicContact CB-CB 4.09Å; Q665-K863 HydrophobicContact CB-CD 4Å; Q665-K863 HydrophobicContact CG-CB 4.42Å; Q665-V864 CarbonylContact C-O 3.54Å; Q665-V864 WeakPolarHBondContact CA-O 3.46Å
666	M	96.2	Very high	90.9	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	130.4	173.7	163.5	179.5	125.3	0	0	109.3	L608 L636 R668 N697 I796 K863 V864 M866	L608-M666 HydrophobicContact CD1-CE 4Å; L636-M666 HydrophobicContact CD1-SD 3.55Å; L636-M666 VanDerWaalsContact CD1-SD 3.55Å; L636-M666 HydrophobicContact CD2-CE 4.34Å; L636-M666 HydrophobicContact CD2-SD 4.13Å; L636-M666 HydrophobicContact CG-SD 4.49Å; M666-R668 HydrophobicContact CE-CG 4.04Å; M666-N697 HydrophobicContact CE-CB 3.84Å; M666-I796 CarbonylContact C-O 3.55Å; M666-I796 WeakPolarHBondContact CA-O 2.76Å; M666-I796 HydrophobicContact CB-CD1 3.96Å; M666-I796 HydrophobicContact CB-CG1 3.84Å; M666-I796 HydrophobicContact CG-CD1 3.64Å; M666-I796 HydrophobicContact CG-CG1 3.58Å; M666-I796 HydrophobicContact SD-CD1 3.75Å; M666-I796 HydrophobicContact SD-CG1 4.35Å; M666-K863 CarbonylContact O-C 3.58Å; M666-K863 VanDerWaalsContact O-CA 3.31Å; M666-K863 WeakPolarHBondContact O-CA 3.46Å; M666-K863 WeakPolarHBondContact O-CB 3.29Å; M666-V864 HydrophobicContact CB-CG2 3.95Å; M666-V864 HydrophobicContact CE-CG2 3.81Å; M666-V864 HydrophobicContact CG-CG2 4.11Å; M666-V864 PolarHBondContact N-O 3.13Å; M666-V864 PolarHBondContact O-N 3.21Å; M666-V864 HydrophobicContact SD-CG2 4.33Å; M666-M866 HydrophobicContact CB-CG 3.83Å; M666-M866 HydrophobicContact SD-CG 3.97Å; M666-M866 HydrophobicContact SD-SD 4.37Å
667	D	95.8	Very high	88.8	Confident	10 Å²	10	40 Å²	40	5%	0.053	20%	0.204	C	C	.	.			trans	-70.5	151.2	173.4	-61.8	-40.1	0	0	0	110.5	N772 I796 D797 D798 G799 K863	D667-N772 PolarHBondContact O-ND2 3.25Å; D667-I796 PolarHBondContact N-O 2.9Å; D667-D797 WeakPolarHBondContact OD2-CA 3.43Å; D667-D797 PolarHBondContact OD2-N 2.73Å; D667-D798 PolarHBondContact OD2-N 3.29Å; D667-G799 WeakPolarHBondContact OD2-CA 3.32Å; D667-G799 PolarHBondContact OD2-N 3.21Å; D667-K863 WeakPolarHBondContact OD1-CD 3.36Å; D667-K863 WeakPolarHBondContact OD1-CE 3.39Å; D667-K863 VanDerWaalsContact OD1-CG 3.26Å; D667-K863 WeakPolarHBondContact OD1-CG 3.48Å; D667-K863 IonicContact OD1-NZ 3.25Å; D667-K863 PolarHBondContact OD1-NZ 2.91Å
668	R	93.9	Very high	86.4	Confident	15 Å²	15	46.6 Å²	46.6	6%	0.057	24%	0.244	C	C	.	.			trans	-133.8	147.3	174.1	-70.2	-175.3	68.2	-141.9	-11	108.8	E612 M666 N697 A860 V864	E612-R668 IonicContact OE2-CZ 3.8Å; E612-R668 VanDerWaalsContact OE2-CZ 3.24Å; E612-R668 IonicContact OE2-NH1 3.53Å; E612-R668 PolarHBondContact OE2-NH1 2.86Å; E612-R668 IonicContact OE2-NH2 2.89Å; E612-R668 PolarHBondContact OE2-NH2 3.42Å; M666-R668 HydrophobicContact CE-CG 4.04Å; R668-N697 PolarHBondContact NE-OD1 3.18Å; R668-A860 HydrophobicContact CB-CB 4.09Å; R668-A860 WeakPolarHBondContact O-CB 3.28Å; R668-A860 PolarHBondContact O-N 2.65Å; R668-V864 VanDerWaalsContact CD-CG1 3.42Å; R668-V864 HydrophobicContact CG-CG1 4.3Å; R668-V864 HydrophobicContact CG-CG2 4.15Å
669	W	95.6	Very high	83.7	Confident	1 Å²	1	50.7 Å²	50.7	0%	0.004	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	135.9	-169.6	-61.6	84.3	0	0	0	111.1	Q695 M696 N772 G799 L801 S829 I857 S858	W669-Q695 WeakPolarHBondContact O-CA 3.39Å; W669-Q695 PolarHBondContact O-OE1 3.07Å; W669-M696 HydrophobicContact CB-CB 4.29Å; W669-M696 HydrophobicContact CB-CE 3.8Å; W669-M696 HydrophobicContact CG-CE 3.8Å; W669-M696 PolarHBondContact N-O 3.01Å; W669-M696 PolarHBondContact O-N 2.88Å; W669-N772 PolarHBondContact NE1-OD1 3.4Å; W669-G799 WeakPolarHBondContact CH2-O 3.42Å; W669-L801 HydrophobicContact CD2-CD1 3.74Å; W669-L801 HydrophobicContact CD2-CD2 3.72Å; W669-L801 HydrophobicContact CD2-CG 3.68Å; W669-L801 VanDerWaalsContact CE2-CD2 3.43Å; W669-L801 HydrophobicContact CE3-CD1 3.57Å; W669-L801 HydrophobicContact CE3-CD2 4.37Å; W669-L801 HydrophobicContact CE3-CG 3.83Å; W669-L801 HydrophobicContact CG-CD1 4.31Å; W669-L801 HydrophobicContact CG-CD2 3.95Å; W669-L801 HydrophobicContact CG-CG 4.38Å; W669-L801 HydrophobicContact CH2-CD1 4.27Å; W669-L801 HydrophobicContact CH2-CG 3.73Å; W669-L801 HydrophobicContact CZ2-CD1 4.43Å; W669-L801 HydrophobicContact CZ2-CD2 3.89Å; W669-L801 HydrophobicContact CZ2-CG 3.59Å; W669-L801 HydrophobicContact CZ3-CD1 3.84Å; W669-L801 HydrophobicContact CZ3-CG 3.83Å; W669-S829 VanDerWaalsContact CZ3-O 3.31Å; W669-S829 WeakPolarHBondContact CZ3-O 3.37Å; W669-I857 HydrophobicContact CB-CG2 4.16Å; W669-I857 HydrophobicContact CE3-CG2 4.14Å; W669-S858 CarbonylContact C-O 3.56Å; W669-S858 WeakPolarHBondContact CA-O 3.3Å; W669-S858 VanDerWaalsContact CE3-C 3.41Å
670	T	94.8	Very high	81.3	Confident	18 Å²	18	57.3 Å²	57.3	11%	0.11	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	128.9	171.5	-65.5	0	0	0	0	109	L672 I693 Q695 I857 S858 A860	T670-L672 HydrophobicContact CG2-CD2 3.94Å; T670-L672 HydrophobicContact CG2-CG 4.3Å; T670-I693 HydrophobicContact CG2-CG2 3.64Å; T670-Q695 PolarHBondContact OG1-NE2 3.05Å; T670-Q695 PolarHBondContact OG1-OE1 2.81Å; T670-Q695 VanDerWaalsContact OG1-OE1 3.04Å; T670-I857 WeakPolarHBondContact O-CA 2.94Å; T670-S858 PolarHBondContact N-O 2.82Å; T670-S858 PolarHBondContact O-N 2.98Å; T670-A860 VanDerWaalsContact OG1-CA 3.22Å; T670-A860 WeakPolarHBondContact OG1-CA 3.45Å; T670-A860 WeakPolarHBondContact OG1-CB 3.48Å
671	I	94.8	Very high	78.9	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	118.9	174.2	-56.4	169.8	0	0	0	107.2	L673 I693 V694 M696 F700 V843 I855 I856 I857	I671-L673 HydrophobicContact CG2-CD2 3.97Å; I671-L673 HydrophobicContact CG2-CG 4.16Å; I671-I693 WeakPolarHBondContact O-CA 3.25Å; I671-V694 HydrophobicContact CB-CB 4.39Å; I671-V694 PolarHBondContact N-O 3.38Å; I671-V694 PolarHBondContact O-N 2.78Å; I671-M696 HydrophobicContact CD1-CB 3.91Å; I671-M696 HydrophobicContact CD1-CG 4.49Å; I671-M696 HydrophobicContact CD1-SD 4.09Å; I671-M696 HydrophobicContact CG1-CB 4.46Å; I671-F700 HydrophobicContact CD1-CB 3.8Å; I671-F700 HydrophobicContact CD1-CD1 4.2Å; I671-F700 HydrophobicContact CD1-CD2 3.97Å; I671-F700 HydrophobicContact CD1-CG 3.76Å; I671-V843 HydrophobicContact CD1-CG1 4.29Å; I671-V843 HydrophobicContact CD1-CG2 3.54Å; I671-I855 HydrophobicContact CG2-CG2 3.67Å; I671-I856 CarbonylContact C-O 3.56Å; I671-I856 WeakPolarHBondContact CA-O 2.9Å; I671-I857 HydrophobicContact CG1-CG1 4.22Å; I671-I857 HydrophobicContact CG1-CG2 3.98Å; I671-I857 HydrophobicContact CG2-CG1 4.47Å
672	L	93.4	Very high	76.4	Confident	49 Å²	49	63.5 Å²	63.5	26%	0.257	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	117.6	172.8	-56.9	174.6	0	0	0	108	T670 A675 I693 I855 I856	T670-L672 HydrophobicContact CG2-CD2 3.94Å; T670-L672 HydrophobicContact CG2-CG 4.3Å; L672-A675 HydrophobicContact CB-CB 4.5Å; L672-I693 HydrophobicContact CD2-CB 4.28Å; L672-I693 HydrophobicContact CD2-CD1 4Å; L672-I693 HydrophobicContact CD2-CG1 3.67Å; L672-I693 HydrophobicContact CD2-CG2 4.04Å; L672-I855 WeakPolarHBondContact O-CA 3.46Å; L672-I856 HydrophobicContact CB-CB 4.32Å; L672-I856 PolarHBondContact N-O 3.42Å; L672-I856 PolarHBondContact O-N 3.36Å
673	L	88.6	Confident	74	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	141.8	178.5	-56.7	156.6	0	0	0	108.9	I671 A675 P691 K692 V694 W848 Q850 I855	I671-L673 HydrophobicContact CG2-CD2 3.97Å; I671-L673 HydrophobicContact CG2-CG 4.16Å; L673-A675 VanDerWaalsContact C-N 3.3Å; L673-A675 PolarHBondContact O-N 3.01Å; L673-P691 WeakPolarHBondContact O-CA 3.09Å; L673-P691 WeakPolarHBondContact O-CB 3.2Å; L673-K692 HydrophobicContact CB-CB 4.19Å; L673-K692 HydrophobicContact CD1-CB 4.05Å; L673-K692 HydrophobicContact CD1-CD 3.71Å; L673-K692 HydrophobicContact CD1-CG 3.87Å; L673-K692 PolarHBondContact N-O 2.86Å; L673-K692 PolarHBondContact O-N 2.6Å; L673-V694 HydrophobicContact CD1-CG2 3.83Å; L673-W848 HydrophobicContact CD1-CH2 4.32Å; L673-W848 HydrophobicContact CD1-CZ2 3.47Å; L673-W848 VanDerWaalsContact CD1-CZ2 3.47Å; L673-W848 HydrophobicContact CD2-CZ2 4.31Å; L673-Q850 HydrophobicContact CD2-CG 4.45Å; L673-I855 HydrophobicContact CD2-CB 4.43Å; L673-I855 HydrophobicContact CD2-CD1 3.77Å; L673-I855 HydrophobicContact CD2-CG1 3.84Å; L673-I855 HydrophobicContact CD2-CG2 3.92Å
674	D	77.1	Confident	71.4	Confident	67 Å²	67	73.2 Å²	73.2	36%	0.358	40%	0.402	S	S	.	.	S	Bend	trans	61.6	36.2	-177.8	-52.5	-46.6	0	0	0	113.2	Q676 Q850 H854	D674-Q676 PolarHBondContact O-N 3.1Å; D674-Q850 PolarHBondContact OD1-NE2 3.15Å; D674-Q850 VanDerWaalsContact OD1-NE2 3.12Å; D674-Q850 PolarHBondContact OD2-NE2 3.32Å; D674-Q850 VanDerWaalsContact OD2-NE2 3.09Å; D674-H854 WeakPolarHBondContact CA-O 3.42Å; D674-H854 PolarHBondContact N-O 3.32Å
675	A	60.5	Low	68.9	Low	15 Å²	15	77.7 Å²	77.7	12%	0.124	43%	0.434	C	S	.	.			trans	-67.6	100.6	176.6	0	0	0	0	0	110.9	L672 L673 H854 I856	L672-A675 HydrophobicContact CB-CB 4.5Å; L673-A675 VanDerWaalsContact C-N 3.3Å; L673-A675 PolarHBondContact O-N 3.01Å; A675-H854 HydrophobicContact CB-CB 4.31Å; A675-H854 PolarHBondContact N-O 3.42Å; A675-H854 WeakPolarHBondContact O-CB 3.49Å; A675-H854 PolarHBondContact O-CD2 2.97Å; A675-I856 HydrophobicContact CB-CD1 3.59Å; A675-I856 HydrophobicContact CB-CG1 4.03Å
676	Q	60.1	Low	66.4	Low	130 Å²	130	75.6 Å²	75.6	61%	0.607	44%	0.439	S	S	*	.			trans	-64.9	138.9	173.1	-67.8	-177.4	4.5	0	0	110.6	D674 V678 L688	D674-Q676 PolarHBondContact O-N 3.1Å; Q676-V678 PolarHBondContact O-N 2.8Å; Q676-L688 VanDerWaalsContact NE2-CD2 3.3Å
677	D	49	Very low	64	Low	89 Å²	89	83 Å²	83	48%	0.476	48%	0.484	S	S	.	.			trans	-64.4	124.5	162.1	-83.4	-29.1	0	0	0	107.4	S679 R832	D677-S679 PolarHBondContact O-N 3.21Å; D677-R832 IonicContact OD1-CZ 3.73Å; D677-R832 IonicContact OD1-NH1 3.92Å; D677-R832 IonicContact OD1-NH2 2.7Å; D677-R832 PolarHBondContact OD1-NH2 3.1Å; D677-R832 IonicContact OD2-CZ 3.3Å; D677-R832 IonicContact OD2-NH1 2.74Å; D677-R832 IonicContact OD2-NH2 3.42Å; D677-R832 PolarHBondContact OD2-NH2 3.33Å
678	V	46	Very low	61.9	Low	149 Å²	149	87.9 Å²	87.9	90%	0.903	51%	0.509	S	S	*	.			trans	-67.3	87.4	166	-173.1	0	0	0	0	106.3	Q676	Q676-V678 PolarHBondContact O-N 2.8Å
679	S	40	Very low	60.2	Low	87 Å²	87	95.9 Å²	95.9	61%	0.608	55%	0.547	S	S	*	.			trans	-69.9	140.2	173	47.1	0	0	0	0	109.5	D677 D681	D677-S679 PolarHBondContact O-N 3.21Å; S679-D681 PolarHBondContact O-N 3.01Å; S679-D681 VanDerWaalsContact O-N 3.09Å
680	E	43.3	Very low	58.8	Low	200 Å²	200	101.2 Å²	101.2	94%	0.935	58%	0.582	S	S	*	*	S	Bend	trans	-66.4	-3.6	-179.5	-73.4	-173.4	141	0	0	114.4
681	D	45	Very low	57.9	Low	145 Å²	145	103.5 Å²	103.5	78%	0.775	60%	0.597	S	S	*	*	S	Bend	trans	-110.9	95.2	-178.9	-78.2	-39.3	0	0	0	111.6	S679 K683	S679-D681 PolarHBondContact O-N 3.01Å; S679-D681 VanDerWaalsContact O-N 3.09Å; D681-K683 VanDerWaalsContact C-N 3.3Å; D681-K683 PolarHBondContact O-N 3.16Å
682	G	44.4	Very low	57.4	Low	83 Å²	83	108.1 Å²	108.1	86%	0.856	62%	0.617	S	S	*	*			trans	-67.8	69.4	-176.6	0	0	0	0	0	115.5
683	K	46.1	Very low	57.2	Low	197 Å²	197	111 Å²	111	86%	0.857	63%	0.632	S	S	*	*			trans	-143.9	91.6	163.7	-77.8	-174.5	179.1	173.6	0	111.2	D681	D681-K683 VanDerWaalsContact C-N 3.3Å; D681-K683 PolarHBondContact O-N 3.16Å
684	D	41.7	Very low	57.4	Low	162 Å²	162	112.2 Å²	112.2	87%	0.866	64%	0.639	S	S	*	*				-155.5	140.7	126.4	-132.8	-18	0	0	0	112.3
685	S	44.4	Very low	58.1	Low	117 Å²	117	111.9 Å²	111.9	82%	0.818	64%	0.635	S	S	*	*			trans	-110.8	105.9	-174.2	49.2	0	0	0	0	109.7
686	G	44.1	Very low	59.7	Low	53 Å²	53	111.1 Å²	111.1	55%	0.546	63%	0.629	S	S	.	*	S	Bend	trans	-161.2	144	167.5	0	0	0	0	0	108	L688	G686-L688 VanDerWaalsContact C-N 3.35Å; G686-L688 WeakPolarHBondContact O-CG 3.14Å; G686-L688 PolarHBondContact O-N 2.72Å
687	V	44.8	Very low	61.4	Low	157 Å²	157	105.4 Å²	105.4	95%	0.952	60%	0.603	S	S	*	*			trans	-64.8	98.2	176.4	178.4	0	0	0	0	107.4
688	L	52.9	Low	63.6	Low	111 Å²	111	101.3 Å²	101.3	58%	0.581	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-79.8	128	-176.5	-72.4	168.4	0	0	0	109.6	Q676 G686	Q676-L688 VanDerWaalsContact NE2-CD2 3.3Å; G686-L688 VanDerWaalsContact C-N 3.35Å; G686-L688 WeakPolarHBondContact O-CG 3.14Å; G686-L688 PolarHBondContact O-N 2.72Å
689	E	57.1	Low	66	Low	184 Å²	184	95.3 Å²	95.3	86%	0.86	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-64.9	135.5	170.5	-70.9	-174.2	162.9	0	0	109.7
690	P	66.6	Low	68.7	Low	113 Å²	113	91.2 Å²	91.2	73%	0.734	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-64.8	147	178.3	25.3	-32.5	0	0	0	111.3	K692	P690-K692 PolarHBondContact O-N 2.98Å
691	P	75.7	Confident	71.2	Confident	66 Å²	66	81.7 Å²	81.7	43%	0.429	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-60.9	138.6	-177.9	24.9	-33.8	0	0	0	111.1	L673 I693	L673-P691 WeakPolarHBondContact O-CA 3.09Å; L673-P691 WeakPolarHBondContact O-CB 3.2Å; P691-I693 PolarHBondContact O-N 2.88Å
692	K	85.3	Confident	73.7	Confident	97 Å²	97	74.8 Å²	74.8	42%	0.422	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	122.2	177.9	178.2	-177.9	171.7	-173.2	0	109.4	L673 P690 V694	L673-K692 HydrophobicContact CB-CB 4.19Å; L673-K692 HydrophobicContact CD1-CB 4.05Å; L673-K692 HydrophobicContact CD1-CD 3.71Å; L673-K692 HydrophobicContact CD1-CG 3.87Å; L673-K692 PolarHBondContact N-O 2.86Å; L673-K692 PolarHBondContact O-N 2.6Å; P690-K692 PolarHBondContact O-N 2.98Å; K692-V694 HydrophobicContact CD-CG2 4.45Å; K692-V694 HydrophobicContact CG-CG2 4.12Å
693	I	89.3	Confident	76.1	Confident	109 Å²	109	71 Å²	71	56%	0.559	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	123.8	179.7	-51.5	-173.7	0	0	0	109.4	T670 I671 L672 P691	T670-I693 HydrophobicContact CG2-CG2 3.64Å; I671-I693 WeakPolarHBondContact O-CA 3.25Å; L672-I693 HydrophobicContact CD2-CB 4.28Å; L672-I693 HydrophobicContact CD2-CD1 4Å; L672-I693 HydrophobicContact CD2-CG1 3.67Å; L672-I693 HydrophobicContact CD2-CG2 4.04Å; P691-I693 PolarHBondContact O-N 2.88Å
694	V	91.3	Very high	78.3	Confident	25 Å²	25	61.7 Å²	61.7	15%	0.152	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	136.8	179	-171.4	0	0	0	0	110	I671 L673 K692 V843 W848	I671-V694 HydrophobicContact CB-CB 4.39Å; I671-V694 PolarHBondContact N-O 3.38Å; I671-V694 PolarHBondContact O-N 2.78Å; L673-V694 HydrophobicContact CD1-CG2 3.83Å; K692-V694 HydrophobicContact CD-CG2 4.45Å; K692-V694 HydrophobicContact CG-CG2 4.12Å; V694-V843 HydrophobicContact CG1-CB 4.01Å; V694-V843 HydrophobicContact CG1-CG1 3.88Å; V694-V843 HydrophobicContact CG1-CG2 3.99Å; V694-W848 HydrophobicContact CG2-CH2 4.33Å
695	Q	92.3	Very high	80.7	Confident	60 Å²	60	54.1 Å²	54.1	28%	0.28	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	132.6	174.1	-64.1	-62.2	-19.2	0	0	110.3	W669 T670	W669-Q695 WeakPolarHBondContact O-CA 3.39Å; W669-Q695 PolarHBondContact O-OE1 3.07Å; T670-Q695 PolarHBondContact OG1-NE2 3.05Å; T670-Q695 PolarHBondContact OG1-OE1 2.81Å; T670-Q695 VanDerWaalsContact OG1-OE1 3.04Å
696	M	94.5	Very high	83	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	134.6	-179.8	179.9	-171.7	89.5	0	0	110.8	W669 I671 F700 N772 L801 V843	W669-M696 HydrophobicContact CB-CB 4.29Å; W669-M696 HydrophobicContact CB-CE 3.8Å; W669-M696 HydrophobicContact CG-CE 3.8Å; W669-M696 PolarHBondContact N-O 3.01Å; W669-M696 PolarHBondContact O-N 2.88Å; I671-M696 HydrophobicContact CD1-CB 3.91Å; I671-M696 HydrophobicContact CD1-CG 4.49Å; I671-M696 HydrophobicContact CD1-SD 4.09Å; I671-M696 HydrophobicContact CG1-CB 4.46Å; M696-F700 HydrophobicContact SD-CB 3.38Å; M696-F700 WeakPolarHBondContact SD-CB 3.49Å; M696-F700 PolarHBondContact SD-N 2.99Å; M696-N772 HydrophobicContact CE-CB 4.03Å; M696-L801 HydrophobicContact CE-CD1 4.23Å; M696-L801 HydrophobicContact CE-CD2 3.45Å; M696-L801 VanDerWaalsContact CE-CD2 3.45Å; M696-V843 HydrophobicContact CB-CG1 3.78Å; M696-V843 HydrophobicContact CG-CG1 4.02Å
697	N	94.7	Very high	85.4	Confident	9 Å²	9	47.5 Å²	47.5	5%	0.048	25%	0.254	C	S	.	.	S	Bend	trans	-115.5	-32.5	179.7	-49.1	-75.4	0	0	0	112.4	M666 R668 N772 D844	M666-N697 HydrophobicContact CE-CB 3.84Å; R668-N697 PolarHBondContact NE-OD1 3.18Å; N697-N772 PolarHBondContact O-ND2 3.06Å; N697-D844 WeakPolarHBondContact CB-OD2 3.36Å; N697-D844 PolarHBondContact N-OD1 3.5Å; N697-D844 PolarHBondContact N-OD2 2.79Å; N697-D844 PolarHBondContact ND2-OD2 3.47Å
698	N	95.4	Very high	87.6	Confident	3 Å²	3	40.2 Å²	40.2	2%	0.016	21%	0.21	C	C	.	.	S	Bend	trans	-112.6	-64.7	-175.8	-63.3	-11.3	0	0	0	111.1	D601 N772 I773 D844	D601-N698 PolarHBondContact OD1-ND2 3.33Å; N698-N772 WeakPolarHBondContact O-CB 3.18Å; N698-N772 PolarHBondContact O-N 2.9Å; N698-I773 HydrophobicContact CB-CD1 3.76Å; N698-I773 HydrophobicContact CB-CG1 4.13Å; N698-I773 PolarHBondContact O-N 2.85Å; N698-D844 WeakPolarHBondContact CA-OD1 3.41Å; N698-D844 WeakPolarHBondContact CB-OD1 3.47Å; N698-D844 PolarHBondContact N-OD1 3.29Å
699	Y	96.4	Very high	89.4	Confident	24 Å²	24	35.7 Å²	35.7	9%	0.094	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.5	156.6	-175.6	52.8	-100.1	0	0	0	113.3	D635 F770 L771 W776 Q842 D844	D635-Y699 HydrophobicContact CB-CE1 4.45Å; Y699-F770 CarbonylContact C-O 3.54Å; Y699-F770 WeakPolarHBondContact CA-O 3.34Å; Y699-F770 WeakPolarHBondContact CB-O 3.47Å; Y699-L771 HydrophobicContact CG-CD2 4.34Å; Y699-W776 AromaticContact CD2-CD1 3.8Å; Y699-W776 HydrophobicContact CE1-CB 4.49Å; Y699-W776 AromaticContact CE2-CD1 3.7Å; Y699-W776 AromaticContact CZ-CD1 3.84Å; Y699-Q842 VanDerWaalsContact CD2-NE2 3.28Å; Y699-Q842 VanDerWaalsContact CE2-NE2 3.28Å; Y699-D844 PolarHBondContact N-OD1 3.38Å; Y699-D844 PolarHBondContact O-N 2.72Å
700	F	97.3	Very high	91	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	128.7	175.9	170	-126.2	0	0	0	109.4	I671 M696 L702 I769 F770 V841 Q842 V843 I855 I857	I671-F700 HydrophobicContact CD1-CB 3.8Å; I671-F700 HydrophobicContact CD1-CD1 4.2Å; I671-F700 HydrophobicContact CD1-CD2 3.97Å; I671-F700 HydrophobicContact CD1-CG 3.76Å; M696-F700 HydrophobicContact SD-CB 3.38Å; M696-F700 WeakPolarHBondContact SD-CB 3.49Å; M696-F700 PolarHBondContact SD-N 2.99Å; F700-L702 HydrophobicContact CD1-CD1 4.03Å; F700-L702 HydrophobicContact CE1-CD1 3.58Å; F700-L702 HydrophobicContact CE1-CD2 4.28Å; F700-L702 HydrophobicContact CE1-CG 4.06Å; F700-L702 HydrophobicContact CZ-CD1 3.96Å; F700-L702 HydrophobicContact CZ-CD2 4.08Å; F700-L702 HydrophobicContact CZ-CG 3.9Å; F700-I769 CarbonylContact O-C 3.5Å; F700-I769 WeakPolarHBondContact O-CA 3.26Å; F700-F770 HydrophobicContact CB-CB 4.38Å; F700-F770 AromaticContact CD1-CD2 3.55Å; F700-F770 HydrophobicContact CD1-CD2 3.55Å; F700-F770 HydrophobicContact CD1-CE2 4.05Å; F700-F770 HydrophobicContact CD1-CG 4.4Å; F700-F770 HydrophobicContact CE1-CD2 4.25Å; F700-F770 HydrophobicContact CE1-CE2 4.3Å; F700-F770 HydrophobicContact CG-CD2 4.4Å; F700-F770 PolarHBondContact N-O 3.3Å; F700-F770 PolarHBondContact O-N 2.95Å; F700-V841 HydrophobicContact CE2-CB 3.83Å; F700-V841 HydrophobicContact CE2-CG1 4.38Å; F700-V841 HydrophobicContact CE2-CG2 4.34Å; F700-V841 HydrophobicContact CZ-CB 4.27Å; F700-V841 HydrophobicContact CZ-CG1 4.32Å; F700-Q842 WeakPolarHBondContact CA-O 3.36Å; F700-Q842 WeakPolarHBondContact CD2-O 3.14Å; F700-V843 HydrophobicContact CB-CG2 4.37Å; F700-V843 HydrophobicContact CD2-CG2 3.36Å; F700-V843 HydrophobicContact CE2-CG2 3.95Å; F700-V843 HydrophobicContact CG-CG2 4.21Å; F700-I855 HydrophobicContact CE1-CG2 4.12Å; F700-I855 HydrophobicContact CZ-CD1 4.09Å; F700-I855 HydrophobicContact CZ-CG2 4.33Å; F700-I857 HydrophobicContact CD1-CD1 3.58Å; F700-I857 HydrophobicContact CE1-CD1 4.04Å
701	G	96.5	Very high	92.1	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	146.2	-177.3	0	0	0	0	0	112.6	L768 V841 Q842	G701-L768 CarbonylContact C-O 3.54Å; G701-L768 WeakPolarHBondContact CA-O 3.48Å; G701-V841 CarbonylContact O-C 3.57Å; G701-V841 VanDerWaalsContact O-CA 3.28Å; G701-V841 WeakPolarHBondContact O-CA 3.33Å; G701-Q842 PolarHBondContact N-O 3.42Å; G701-Q842 PolarHBondContact O-N 2.93Å
702	L	96.3	Very high	92.8	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	147.8	172.8	-52.6	93.9	0	0	0	110.4	F700 G767 L768 F770 L833 L839 V841 I855	F700-L702 HydrophobicContact CD1-CD1 4.03Å; F700-L702 HydrophobicContact CE1-CD1 3.58Å; F700-L702 HydrophobicContact CE1-CD2 4.28Å; F700-L702 HydrophobicContact CE1-CG 4.06Å; F700-L702 HydrophobicContact CZ-CD1 3.96Å; F700-L702 HydrophobicContact CZ-CD2 4.08Å; F700-L702 HydrophobicContact CZ-CG 3.9Å; L702-G767 WeakPolarHBondContact O-CA 3.18Å; L702-L768 HydrophobicContact CD1-CB 4.38Å; L702-L768 PolarHBondContact N-O 2.84Å; L702-L768 PolarHBondContact O-N 3.19Å; L702-F770 HydrophobicContact CD1-CD2 4.06Å; L702-F770 HydrophobicContact CD1-CE2 3.57Å; L702-L833 HydrophobicContact CD1-CD2 4.21Å; L702-L833 HydrophobicContact CD2-CD2 3.39Å; L702-L833 HydrophobicContact CG-CD2 4.48Å; L702-L839 HydrophobicContact CB-CD1 3.94Å; L702-L839 HydrophobicContact CD2-CD1 4Å; L702-L839 HydrophobicContact CG-CD1 4.43Å; L702-V841 HydrophobicContact CB-CG1 4.35Å; L702-V841 HydrophobicContact CD2-CG1 3.82Å; L702-V841 HydrophobicContact CG-CG1 3.88Å; L702-I855 HydrophobicContact CD2-CD1 4.19Å
703	G	94.9	Very high	92.8	Very high	5 Å²	5	20 Å²	20	5%	0.052	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	81.2	-134.5	176.5	0	0	0	0	0	112.8	D705 A706 E707 P840	G703-D705 VanDerWaalsContact C-N 3.31Å; G703-D705 PolarHBondContact O-N 2.86Å; G703-A706 PolarHBondContact O-N 3.28Å; G703-A706 VanDerWaalsContact O-N 3.13Å; G703-E707 PolarHBondContact O-N 2.99Å; G703-P840 PolarHBondContact N-O 2.73Å
704	I	92.4	Very high	92.7	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-56.5	-39.2	-170.7	-174.6	63.2	0	0	0	113.7	E707 L708 K740 R745 E766 V806 V809 M812	I704-E707 PolarHBondContact O-N 2.93Å; I704-L708 HydrophobicContact CD1-CD2 4.46Å; I704-L708 HydrophobicContact CD1-CG 4.3Å; I704-L708 VanDerWaalsContact O-CG 3.31Å; I704-L708 WeakPolarHBondContact O-CG 3.34Å; I704-L708 PolarHBondContact O-N 3.04Å; I704-L708 VanDerWaalsContact O-N 3.12Å; I704-K740 HydrophobicContact CD1-CB 4.32Å; I704-R745 VanDerWaalsContact CA-NH1 3.33Å; I704-E766 HydrophobicContact CB-CB 4.35Å; I704-E766 HydrophobicContact CG2-CB 4.06Å; I704-E766 PolarHBondContact N-O 3.28Å; I704-V806 HydrophobicContact CG2-CG2 3.76Å; I704-V809 HydrophobicContact CD1-CG2 3.69Å; I704-V809 HydrophobicContact CG1-CG2 3.96Å; I704-M812 HydrophobicContact CB-SD 4.42Å; I704-M812 HydrophobicContact CG1-SD 3.93Å; I704-M812 HydrophobicContact CG2-SD 3.64Å
705	D	91.8	Very high	92.5	Very high	3 Å²	3	20 Å²	20	2%	0.016	11%	0.107	C	C	.	.	H	α-helix	trans	-60.4	-48.8	176.4	175.6	53.3	0	0	0	112.3	G703 L708 S709 I769 W776 M812 Q842	G703-D705 VanDerWaalsContact C-N 3.31Å; G703-D705 PolarHBondContact O-N 2.86Å; D705-L708 PolarHBondContact O-N 2.73Å; D705-S709 PolarHBondContact O-N 3.16Å; D705-S709 VanDerWaalsContact O-N 3.16Å; D705-S709 PolarHBondContact O-OG 3.06Å; D705-S709 VanDerWaalsContact O-OG 3.07Å; D705-I769 HydrophobicContact CB-CD1 4.28Å; D705-I769 HydrophobicContact CB-CG1 4.15Å; D705-W776 WeakPolarHBondContact OD1-CZ2 3.4Å; D705-W776 PolarHBondContact OD1-NE1 3Å; D705-M812 HydrophobicContact CB-CE 4.09Å; D705-Q842 PolarHBondContact OD2-NE2 3.1Å
706	A	93.9	Very high	92.1	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-68.4	-36.1	179.1	0	0	0	0	0	113	G703 S709 L710 P840 Q842	G703-A706 PolarHBondContact O-N 3.28Å; G703-A706 VanDerWaalsContact O-N 3.13Å; A706-S709 WeakPolarHBondContact O-CB 3.12Å; A706-S709 PolarHBondContact O-N 3.46Å; A706-L710 WeakPolarHBondContact O-CB 3.42Å; A706-L710 PolarHBondContact O-N 3.15Å; A706-P840 VanDerWaalsContact CB-C 3.42Å; A706-P840 HydrophobicContact CB-CB 4.11Å; A706-P840 WeakPolarHBondContact CB-O 3.25Å; A706-Q842 HydrophobicContact CB-CB 4.1Å; A706-Q842 HydrophobicContact CB-CG 3.92Å
707	E	93.1	Very high	91.6	Very high	30 Å²	30	27.4 Å²	27.4	14%	0.14	14%	0.137	C	C	.	.	H	α-helix	trans	-64.6	-42.7	177.2	-167.2	177.1	145.6	0	0	111.8	G703 I704 S709 L710 D711 K740 R743 R745 P840	G703-E707 PolarHBondContact O-N 2.99Å; I704-E707 PolarHBondContact O-N 2.93Å; E707-S709 VanDerWaalsContact C-N 3.26Å; E707-S709 PolarHBondContact O-N 3.19Å; E707-L710 PolarHBondContact O-N 2.86Å; E707-D711 PolarHBondContact O-N 3.47Å; E707-K740 IonicContact OE1-NZ 2.82Å; E707-K740 PolarHBondContact OE1-NZ 2.92Å; E707-R743 IonicContact OE1-NH1 2.75Å; E707-R745 IonicContact OE1-CZ 2.78Å; E707-R745 IonicContact OE1-NH2 2.65Å; E707-R745 PolarHBondContact OE1-NH2 3.17Å; E707-R745 IonicContact OE2-CZ 2.8Å; E707-R745 IonicContact OE2-NE 3.83Å; E707-R745 IonicContact OE2-NH1 3.24Å; E707-R745 PolarHBondContact OE2-NH1 3.03Å; E707-R745 IonicContact OE2-NH2 3.95Å; E707-R745 PolarHBondContact OE2-NH2 3.35Å; E707-P840 HydrophobicContact CB-CB 4.24Å; E707-P840 HydrophobicContact CB-CG 3.73Å; E707-P840 HydrophobicContact CG-CG 4.27Å
708	L	91.1	Very high	91.2	Very high	5 Å²	5	29.9 Å²	29.9	3%	0.026	17%	0.166	C	C	.	.	H	α-helix	trans	-62.6	-38.4	175.2	-65.7	-179	0	0	0	111.4	I704 D705 F712 Y733 V736 K740 M812	I704-L708 HydrophobicContact CD1-CD2 4.46Å; I704-L708 HydrophobicContact CD1-CG 4.3Å; I704-L708 VanDerWaalsContact O-CG 3.31Å; I704-L708 WeakPolarHBondContact O-CG 3.34Å; I704-L708 PolarHBondContact O-N 3.04Å; I704-L708 VanDerWaalsContact O-N 3.12Å; D705-L708 PolarHBondContact O-N 2.73Å; L708-F712 WeakPolarHBondContact O-CB 3.42Å; L708-F712 PolarHBondContact O-N 3.33Å; L708-Y733 HydrophobicContact CB-CE2 4.23Å; L708-Y733 HydrophobicContact CD1-CE1 4.46Å; L708-V736 HydrophobicContact CD2-CG1 3.98Å; L708-K740 HydrophobicContact CD2-CG 4.24Å; L708-M812 HydrophobicContact CD1-CE 3.97Å; L708-M812 HydrophobicContact CD1-SD 4.39Å
709	S	91.6	Very high	90.6	Very high	16 Å²	16	34.6 Å²	34.6	11%	0.112	19%	0.187	C	C	.	.	H	α-helix	trans	-64.2	-43.2	174.5	-60.8	0	0	0	0	111.6	D705 A706 E707 F712 H713	D705-S709 PolarHBondContact O-N 3.16Å; D705-S709 VanDerWaalsContact O-N 3.16Å; D705-S709 PolarHBondContact O-OG 3.06Å; D705-S709 VanDerWaalsContact O-OG 3.07Å; A706-S709 WeakPolarHBondContact O-CB 3.12Å; A706-S709 PolarHBondContact O-N 3.46Å; E707-S709 VanDerWaalsContact C-N 3.26Å; E707-S709 PolarHBondContact O-N 3.19Å; S709-F712 PolarHBondContact O-N 2.78Å; S709-H713 WeakPolarHBondContact O-CB 3.04Å; S709-H713 PolarHBondContact O-N 3.42Å
710	L	91.3	Very high	89.8	Confident	26 Å²	26	37.2 Å²	37.2	14%	0.136	21%	0.208	C	C	.	.	H	α-helix	trans	-62.8	-49.9	178	-174.6	60.7	0	0	0	112	A706 E707 F712 H713 L714 P840 P847 L849	A706-L710 WeakPolarHBondContact O-CB 3.42Å; A706-L710 PolarHBondContact O-N 3.15Å; E707-L710 PolarHBondContact O-N 2.86Å; L710-F712 VanDerWaalsContact C-N 3.3Å; L710-F712 PolarHBondContact O-N 3.38Å; L710-H713 WeakPolarHBondContact O-CB 3.38Å; L710-H713 PolarHBondContact O-N 3.21Å; L710-H713 VanDerWaalsContact O-N 3.1Å; L710-L714 HydrophobicContact CD1-CD1 4.5Å; L710-L714 HydrophobicContact CD1-CG 4.45Å; L710-L714 HydrophobicContact CG-CD1 4.22Å; L710-L714 WeakPolarHBondContact O-CG 3.43Å; L710-L714 PolarHBondContact O-N 3.07Å; L710-P840 HydrophobicContact CD2-CB 4.39Å; L710-P847 HydrophobicContact CB-CB 3.92Å; L710-P847 HydrophobicContact CB-CG 4.23Å; L710-P847 HydrophobicContact CD1-CB 4.12Å; L710-P847 HydrophobicContact CD1-CG 4.06Å; L710-L849 HydrophobicContact CD2-CD2 4.08Å; L710-L849 HydrophobicContact CD2-CG 4.15Å
711	D	90.1	Very high	89	Confident	42 Å²	42	44.1 Å²	44.1	23%	0.225	24%	0.244	C	C	.	.	H	α-helix	trans	-61.4	-39.5	178.1	-75.6	-18.1	0	0	0	111.3	E707 A715 V736 K740	E707-D711 PolarHBondContact O-N 3.47Å; D711-A715 WeakPolarHBondContact O-CB 3.24Å; D711-A715 PolarHBondContact O-N 3.47Å; D711-A715 VanDerWaalsContact O-N 3.09Å; D711-V736 HydrophobicContact CB-CG1 3.34Å; D711-V736 HydrophobicContact CB-CG2 4.44Å; D711-K740 IonicContact OD1-NZ 3.79Å; D711-K740 WeakPolarHBondContact OD2-CE 3.33Å; D711-K740 IonicContact OD2-NZ 3.71Å; D711-K740 PolarHBondContact OD2-NZ 3.21Å
712	F	88.8	Confident	88.3	Confident	39 Å²	39	49.1 Å²	49.1	17%	0.171	27%	0.266	C	S	.	.	H	α-helix	trans	-64.8	-41.3	173.1	174.7	-94.6	0	0	0	112.2	L708 S709 L710 A715 R716 F723 N729 V732 Y733	L708-F712 WeakPolarHBondContact O-CB 3.42Å; L708-F712 PolarHBondContact O-N 3.33Å; S709-F712 PolarHBondContact O-N 2.78Å; L710-F712 VanDerWaalsContact C-N 3.3Å; L710-F712 PolarHBondContact O-N 3.38Å; F712-A715 PolarHBondContact O-N 3.13Å; F712-R716 WeakPolarHBondContact O-CB 3.5Å; F712-R716 PolarHBondContact O-N 3.27Å; F712-F723 HydrophobicContact CD2-CE1 4.18Å; F712-F723 AromaticContact CE2-CD1 3.89Å; F712-F723 HydrophobicContact CE2-CD1 3.89Å; F712-F723 AromaticContact CE2-CE1 3.62Å; F712-F723 HydrophobicContact CE2-CE1 3.62Å; F712-F723 AromaticContact CZ-CD1 3.85Å; F712-F723 HydrophobicContact CZ-CD1 3.85Å; F712-F723 HydrophobicContact CZ-CE1 4Å; F712-N729 HydrophobicContact CE2-CB 4.21Å; F712-N729 WeakPolarHBondContact CE2-O 2.99Å; F712-N729 HydrophobicContact CZ-CB 4.09Å; F712-V732 HydrophobicContact CD2-CB 4.39Å; F712-V732 HydrophobicContact CD2-CG1 4.07Å; F712-V732 HydrophobicContact CE2-CB 4.37Å; F712-V732 HydrophobicContact CE2-CG1 4.42Å; F712-Y733 HydrophobicContact CB-CD2 4.1Å; F712-Y733 HydrophobicContact CD2-CD2 4.25Å; F712-Y733 HydrophobicContact CG-CD2 4.16Å
713	H	86.6	Confident	87.4	Confident	24 Å²	24	50.3 Å²	50.3	11%	0.111	27%	0.271	C	S	.	.	H	α-helix	trans	-63.4	-48.3	178.6	-174.5	102.1	0	0	0	111.3	S709 L710 A715 R716 E717 E846 P847	S709-H713 WeakPolarHBondContact O-CB 3.04Å; S709-H713 PolarHBondContact O-N 3.42Å; L710-H713 WeakPolarHBondContact O-CB 3.38Å; L710-H713 PolarHBondContact O-N 3.21Å; L710-H713 VanDerWaalsContact O-N 3.1Å; H713-A715 VanDerWaalsContact C-N 3.31Å; H713-A715 PolarHBondContact O-N 3.32Å; H713-R716 PolarHBondContact ND1-NH2 2.85Å; H713-R716 CarbonylContact O-C 3.55Å; H713-R716 WeakPolarHBondContact O-CA 3.38Å; H713-R716 WeakPolarHBondContact O-CB 3.45Å; H713-R716 PolarHBondContact O-N 3.37Å; H713-E717 VanDerWaalsContact CD2-CD 3.41Å; H713-E717 IonicContact CD2-OE1 4Å; H713-E717 IonicContact CD2-OE2 2.78Å; H713-E717 IonicContact NE2-OE1 3.7Å; H713-E717 PolarHBondContact NE2-OE1 3.38Å; H713-E717 VanDerWaalsContact NE2-OE1 3.11Å; H713-E717 IonicContact NE2-OE2 3.77Å; H713-E717 PolarHBondContact O-N 2.81Å; H713-E846 IonicContact CE1-OE2 3.19Å; H713-E846 IonicContact ND1-OE2 2.86Å; H713-P847 HydrophobicContact CB-CG 3.5Å; H713-P847 VanDerWaalsContact CB-CG 3.5Å
714	L	87.5	Confident	86.4	Confident	95 Å²	95	54 Å²	54	50%	0.497	29%	0.293	S	S	.	.	H	α-helix	trans	-60.5	-40.3	176.7	-68	171.8	0	0	0	111.9	L710 R716 E717 G718	L710-L714 HydrophobicContact CD1-CD1 4.5Å; L710-L714 HydrophobicContact CD1-CG 4.45Å; L710-L714 HydrophobicContact CG-CD1 4.22Å; L710-L714 WeakPolarHBondContact O-CG 3.43Å; L710-L714 PolarHBondContact O-N 3.07Å; L714-R716 VanDerWaalsContact C-N 3.29Å; L714-R716 PolarHBondContact O-N 3.25Å; L714-E717 PolarHBondContact O-N 2.92Å; L714-G718 PolarHBondContact O-N 3.45Å
715	A	86.4	Confident	85.8	Confident	38 Å²	38	56.6 Å²	56.6	31%	0.314	31%	0.311	S	S	.	.	H	α-helix	trans	-63	-37.8	174.1	0	0	0	0	0	112	D711 F712 H713 E719 F723 V732	D711-A715 WeakPolarHBondContact O-CB 3.24Å; D711-A715 PolarHBondContact O-N 3.47Å; D711-A715 VanDerWaalsContact O-N 3.09Å; F712-A715 PolarHBondContact O-N 3.13Å; H713-A715 VanDerWaalsContact C-N 3.31Å; H713-A715 PolarHBondContact O-N 3.32Å; A715-E719 PolarHBondContact O-N 2.87Å; A715-F723 HydrophobicContact CB-CZ 3.9Å; A715-F723 WeakPolarHBondContact O-CE2 3.36Å; A715-F723 WeakPolarHBondContact O-CZ 3.46Å; A715-V732 HydrophobicContact CB-CG1 4.45Å
716	R	84.6	Confident	85.4	Confident	92 Å²	92	60.4 Å²	60.4	35%	0.347	33%	0.326	S	S	.	.	H	α-helix	trans	-70.7	-40.1	177.3	-176.7	179	68.6	147.9	-1.5	112.7	F712 H713 L714 G718 E719 P720 F723	F712-R716 WeakPolarHBondContact O-CB 3.5Å; F712-R716 PolarHBondContact O-N 3.27Å; H713-R716 PolarHBondContact ND1-NH2 2.85Å; H713-R716 CarbonylContact O-C 3.55Å; H713-R716 WeakPolarHBondContact O-CA 3.38Å; H713-R716 WeakPolarHBondContact O-CB 3.45Å; H713-R716 PolarHBondContact O-N 3.37Å; L714-R716 VanDerWaalsContact C-N 3.29Å; L714-R716 PolarHBondContact O-N 3.25Å; R716-G718 VanDerWaalsContact C-N 3.34Å; R716-E719 CarbonylContact O-C 3.48Å; R716-P720 VanDerWaalsContact O-CA 3.23Å; R716-P720 WeakPolarHBondContact O-CA 3.49Å; R716-P720 VanDerWaalsContact O-N 3.15Å; R716-F723 VanDerWaalsContact CA-CE2 3.48Å; R716-F723 HydrophobicContact CB-CD1 3.86Å; R716-F723 HydrophobicContact CB-CD2 4.14Å; R716-F723 HydrophobicContact CB-CE1 3.96Å; R716-F723 HydrophobicContact CB-CE2 4.26Å; R716-F723 HydrophobicContact CB-CG 3.94Å; R716-F723 HydrophobicContact CB-CZ 4.16Å; R716-F723 HydrophobicContact CG-CB 3.84Å; R716-F723 HydrophobicContact CG-CD1 3.96Å; R716-F723 HydrophobicContact CG-CD2 4.11Å; R716-F723 HydrophobicContact CG-CG 3.7Å
717	E	83.7	Confident	84.8	Confident	123 Å²	123	69 Å²	69	58%	0.575	36%	0.363	S	S	*	.	H	α-helix	trans	-67.6	-35.4	176.8	-73.2	-170.2	136	0	0	112.2	H713 L714 E719	H713-E717 VanDerWaalsContact CD2-CD 3.41Å; H713-E717 IonicContact CD2-OE1 4Å; H713-E717 IonicContact CD2-OE2 2.78Å; H713-E717 IonicContact NE2-OE1 3.7Å; H713-E717 PolarHBondContact NE2-OE1 3.38Å; H713-E717 VanDerWaalsContact NE2-OE1 3.11Å; H713-E717 IonicContact NE2-OE2 3.77Å; H713-E717 PolarHBondContact O-N 2.81Å; L714-E717 PolarHBondContact O-N 2.92Å; E717-E719 PolarHBondContact O-N 3.34Å
718	G	85.6	Confident	84.3	Confident	62 Å²	62	71.4 Å²	71.4	64%	0.639	37%	0.374	S	S	*	.	H	α-helix	trans	-65.1	-36	176.7	0	0	0	0	0	113.8	L714 R716	L714-G718 PolarHBondContact O-N 3.45Å; R716-G718 VanDerWaalsContact C-N 3.34Å
719	E	82.6	Confident	84	Confident	101 Å²	101	71.8 Å²	71.8	47%	0.472	38%	0.376	S	S	.	.			trans	-142.7	64	-175.6	-59	-166.9	100.3	0	0	113.4	A715 R716 E717 D721 K722 F723	A715-E719 PolarHBondContact O-N 2.87Å; R716-E719 CarbonylContact O-C 3.48Å; E717-E719 PolarHBondContact O-N 3.34Å; E719-D721 VanDerWaalsContact C-N 3.26Å; E719-D721 PolarHBondContact O-N 2.89Å; E719-D721 VanDerWaalsContact O-N 3.09Å; E719-K722 HydrophobicContact CB-CD 4.06Å; E719-K722 HydrophobicContact CB-CG 4.3Å; E719-K722 PolarHBondContact O-N 3.13Å; E719-K722 WeakPolarHBondContact OE1-CE 3.41Å; E719-K722 IonicContact OE1-NZ 2.76Å; E719-K722 PolarHBondContact OE1-NZ 2.94Å; E719-K722 WeakPolarHBondContact OE2-CD 3.09Å; E719-K722 IonicContact OE2-NZ 4Å; E719-K722 PolarHBondContact OE2-NZ 3.35Å; E719-F723 VanDerWaalsContact O-CD2 3.3Å; E719-F723 WeakPolarHBondContact O-CD2 3.43Å
720	P	80	Confident	83.7	Confident	80 Å²	80	75.5 Å²	75.5	52%	0.519	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-58.2	-32.6	-168.4	20.8	-33	0	0	0	114.4	R716 K722 F723	R716-P720 VanDerWaalsContact O-CA 3.23Å; R716-P720 WeakPolarHBondContact O-CA 3.49Å; R716-P720 VanDerWaalsContact O-N 3.15Å; P720-K722 PolarHBondContact O-N 2.85Å; P720-F723 PolarHBondContact O-N 3.45Å; P720-F723 VanDerWaalsContact O-N 3.08Å
721	D	80.3	Confident	83.3	Confident	145 Å²	145	76.2 Å²	76.2	78%	0.775	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-64.7	-24.2	-179.7	-65.9	-35.6	0	0	0	113.4	E719 F723 T724	E719-D721 VanDerWaalsContact C-N 3.26Å; E719-D721 PolarHBondContact O-N 2.89Å; E719-D721 VanDerWaalsContact O-N 3.09Å; D721-F723 VanDerWaalsContact C-N 3.33Å; D721-T724 WeakPolarHBondContact O-CG2 3.39Å
722	K	81	Confident	83.1	Confident	105 Å²	105	75.3 Å²	75.3	46%	0.457	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-77.7	-17.8	176.5	-65.5	-175.1	-178.1	171.8	0	112.9	E719 P720 T724 H728	E719-K722 HydrophobicContact CB-CD 4.06Å; E719-K722 HydrophobicContact CB-CG 4.3Å; E719-K722 PolarHBondContact O-N 3.13Å; E719-K722 WeakPolarHBondContact OE1-CE 3.41Å; E719-K722 IonicContact OE1-NZ 2.76Å; E719-K722 PolarHBondContact OE1-NZ 2.94Å; E719-K722 WeakPolarHBondContact OE2-CD 3.09Å; E719-K722 IonicContact OE2-NZ 4Å; E719-K722 PolarHBondContact OE2-NZ 3.35Å; P720-K722 PolarHBondContact O-N 2.85Å; K722-T724 VanDerWaalsContact C-N 3.32Å; K722-T724 PolarHBondContact O-N 3.14Å; K722-H728 PolarHBondContact O-CD2 3.48Å
723	F	79.1	Confident	82.9	Confident	24 Å²	24	75.8 Å²	75.8	11%	0.105	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-95.2	27.7	-172.7	-72.1	-101.8	0	0	0	114.2	F712 A715 R716 E719 P720 D721 N729 V732	F712-F723 HydrophobicContact CD2-CE1 4.18Å; F712-F723 AromaticContact CE2-CD1 3.89Å; F712-F723 HydrophobicContact CE2-CD1 3.89Å; F712-F723 AromaticContact CE2-CE1 3.62Å; F712-F723 HydrophobicContact CE2-CE1 3.62Å; F712-F723 AromaticContact CZ-CD1 3.85Å; F712-F723 HydrophobicContact CZ-CD1 3.85Å; F712-F723 HydrophobicContact CZ-CE1 4Å; A715-F723 HydrophobicContact CB-CZ 3.9Å; A715-F723 WeakPolarHBondContact O-CE2 3.36Å; A715-F723 WeakPolarHBondContact O-CZ 3.46Å; R716-F723 VanDerWaalsContact CA-CE2 3.48Å; R716-F723 HydrophobicContact CB-CD1 3.86Å; R716-F723 HydrophobicContact CB-CD2 4.14Å; R716-F723 HydrophobicContact CB-CE1 3.96Å; R716-F723 HydrophobicContact CB-CE2 4.26Å; R716-F723 HydrophobicContact CB-CG 3.94Å; R716-F723 HydrophobicContact CB-CZ 4.16Å; R716-F723 HydrophobicContact CG-CB 3.84Å; R716-F723 HydrophobicContact CG-CD1 3.96Å; R716-F723 HydrophobicContact CG-CD2 4.11Å; R716-F723 HydrophobicContact CG-CG 3.7Å; E719-F723 VanDerWaalsContact O-CD2 3.3Å; E719-F723 WeakPolarHBondContact O-CD2 3.43Å; P720-F723 PolarHBondContact O-N 3.45Å; P720-F723 VanDerWaalsContact O-N 3.08Å; D721-F723 VanDerWaalsContact C-N 3.33Å; F723-N729 WeakPolarHBondContact CA-OD1 3.3Å; F723-N729 WeakPolarHBondContact CB-OD1 3.47Å; F723-N729 VanDerWaalsContact CD1-OD1 3.31Å; F723-N729 WeakPolarHBondContact CD1-OD1 3.44Å; F723-N729 PolarHBondContact O-ND2 2.85Å; F723-N729 PolarHBondContact O-OD1 2.97Å; F723-V732 HydrophobicContact CE1-CB 4.28Å; F723-V732 HydrophobicContact CE1-CG1 4.02Å; F723-V732 HydrophobicContact CE1-CG2 4.24Å; F723-V732 HydrophobicContact CZ-CG1 4.14Å; F723-V732 HydrophobicContact CZ-CG2 4.37Å
724	T	72.7	Confident	82.9	Confident	82 Å²	82	78.5 Å²	78.5	50%	0.503	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-84.3	-19.5	-179	54.2	0	0	0	0	113.4	G553 D721 K722	G553-T724 VanDerWaalsContact CA-O 3.3Å; G553-T724 WeakPolarHBondContact CA-O 3.25Å; G553-T724 PolarHBondContact N-O 3.02Å; D721-T724 WeakPolarHBondContact O-CG2 3.39Å; K722-T724 VanDerWaalsContact C-N 3.32Å; K722-T724 PolarHBondContact O-N 3.14Å
725	S	80.3	Confident	82.8	Confident	57 Å²	57	80.5 Å²	80.5	40%	0.399	42%	0.424	S	S	.	.			trans	-103.4	126.8	-177.9	174.6	0	0	0	0	112.6	F727 H728 N729	S725-F727 VanDerWaalsContact C-N 3.29Å; S725-F727 PolarHBondContact O-N 3.34Å; S725-F727 PolarHBondContact OG-N 3.09Å; S725-H728 PolarHBondContact O-N 3.17Å; S725-N729 WeakPolarHBondContact O-CB 3.47Å; S725-N729 PolarHBondContact O-N 3.3Å; S725-N729 PolarHBondContact O-ND2 2.85Å; S725-N729 PolarHBondContact O-OD1 3.11Å
726	R	82.4	Confident	82.9	Confident	83 Å²	83	79.3 Å²	79.3	31%	0.313	41%	0.412	S	S	.	.	H	α-helix	trans	-58.7	-38.6	176.4	-63.6	-177.4	-61.2	179.5	0.6	112.9	G631 T632 G645 K730	G631-R726 WeakPolarHBondContact O-CD 3.26Å; T632-R726 HydrophobicContact CG2-CB 4.37Å; G645-R726 VanDerWaalsContact CA-NH1 3.35Å; R726-K730 WeakPolarHBondContact O-CG 3.5Å; R726-K730 PolarHBondContact O-N 2.9Å
727	F	82	Confident	82.8	Confident	179 Å²	179	75.1 Å²	75.1	79%	0.785	40%	0.398	S	S	*	.	H	α-helix	trans	-67.1	-44.2	179.7	-178	-94.1	0	0	0	110.8	S725 K730 G731	S725-F727 VanDerWaalsContact C-N 3.29Å; S725-F727 PolarHBondContact O-N 3.34Å; S725-F727 PolarHBondContact OG-N 3.09Å; F727-K730 PolarHBondContact O-N 2.74Å; F727-G731 PolarHBondContact O-N 2.83Å
728	H	83.2	Confident	82.9	Confident	82 Å²	82	74.7 Å²	74.7	38%	0.38	40%	0.399	S	S	.	.	H	α-helix	trans	-61.4	-48	175.8	-176.6	69.4	0	0	0	111.3	K722 S725 K730 G731 V732	K722-H728 PolarHBondContact O-CD2 3.48Å; S725-H728 PolarHBondContact O-N 3.17Å; H728-K730 VanDerWaalsContact C-N 3.3Å; H728-K730 PolarHBondContact O-N 3.2Å; H728-G731 WeakPolarHBondContact O-CA 3.06Å; H728-G731 PolarHBondContact O-N 3.32Å; H728-V732 WeakPolarHBondContact O-CG2 3.46Å; H728-V732 PolarHBondContact O-N 2.88Å
729	N	84.8	Confident	82.9	Confident	13 Å²	13	77.6 Å²	77.6	7%	0.07	40%	0.396	C	S	.	.	H	α-helix	trans	-56.9	-43.8	179.2	-65.4	-8	0	0	0	111.7	T632 F712 F723 S725 V732 Y733	T632-N729 HydrophobicContact CG2-CB 4Å; T632-N729 PolarHBondContact OG1-ND2 3.49Å; F712-N729 HydrophobicContact CE2-CB 4.21Å; F712-N729 WeakPolarHBondContact CE2-O 2.99Å; F712-N729 HydrophobicContact CZ-CB 4.09Å; F723-N729 WeakPolarHBondContact CA-OD1 3.3Å; F723-N729 WeakPolarHBondContact CB-OD1 3.47Å; F723-N729 VanDerWaalsContact CD1-OD1 3.31Å; F723-N729 WeakPolarHBondContact CD1-OD1 3.44Å; F723-N729 PolarHBondContact O-ND2 2.85Å; F723-N729 PolarHBondContact O-OD1 2.97Å; S725-N729 WeakPolarHBondContact O-CB 3.47Å; S725-N729 PolarHBondContact O-N 3.3Å; S725-N729 PolarHBondContact O-ND2 2.85Å; S725-N729 PolarHBondContact O-OD1 3.11Å; N729-V732 PolarHBondContact O-N 3.46Å; N729-Y733 PolarHBondContact O-N 3.08Å; N729-Y733 VanDerWaalsContact O-N 3.11Å
730	K	84.3	Confident	82.9	Confident	94 Å²	94	74 Å²	74	41%	0.409	38%	0.379	S	S	.	.	H	α-helix	trans	-63.3	-41.4	174.3	-73.2	-174.3	173.9	-154.6	0	112.5	T632 R726 F727 H728 Y733 V734 S778	T632-K730 HydrophobicContact CG2-CG 3.79Å; R726-K730 WeakPolarHBondContact O-CG 3.5Å; R726-K730 PolarHBondContact O-N 2.9Å; F727-K730 PolarHBondContact O-N 2.74Å; H728-K730 VanDerWaalsContact C-N 3.3Å; H728-K730 PolarHBondContact O-N 3.2Å; K730-Y733 WeakPolarHBondContact O-CB 3.31Å; K730-Y733 PolarHBondContact O-N 3.43Å; K730-V734 WeakPolarHBondContact O-CG2 3.3Å; K730-V734 PolarHBondContact O-N 3.24Å; K730-V734 VanDerWaalsContact O-N 3.08Å; K730-S778 PolarHBondContact NZ-OG 3Å
731	G	84.3	Confident	83	Confident	40 Å²	40	74.2 Å²	74.2	41%	0.412	38%	0.375	S	S	.	.	H	α-helix	trans	-62.8	-41.5	176.8	0	0	0	0	0	113.4	F727 H728 V734 K735	F727-G731 PolarHBondContact O-N 2.83Å; H728-G731 WeakPolarHBondContact O-CA 3.06Å; H728-G731 PolarHBondContact O-N 3.32Å; G731-V734 PolarHBondContact O-N 3.12Å; G731-K735 PolarHBondContact O-N 3.31Å
732	V	84.8	Confident	82.5	Confident	24 Å²	24	72.8 Å²	72.8	15%	0.145	38%	0.376	C	S	.	.	H	α-helix	trans	-61.9	-45	174.9	176.6	0	0	0	0	110.6	F712 A715 F723 H728 N729 V734 K735 V736	F712-V732 HydrophobicContact CD2-CB 4.39Å; F712-V732 HydrophobicContact CD2-CG1 4.07Å; F712-V732 HydrophobicContact CE2-CB 4.37Å; F712-V732 HydrophobicContact CE2-CG1 4.42Å; A715-V732 HydrophobicContact CB-CG1 4.45Å; F723-V732 HydrophobicContact CE1-CB 4.28Å; F723-V732 HydrophobicContact CE1-CG1 4.02Å; F723-V732 HydrophobicContact CE1-CG2 4.24Å; F723-V732 HydrophobicContact CZ-CG1 4.14Å; F723-V732 HydrophobicContact CZ-CG2 4.37Å; H728-V732 WeakPolarHBondContact O-CG2 3.46Å; H728-V732 PolarHBondContact O-N 2.88Å; N729-V732 PolarHBondContact O-N 3.46Å; V732-V734 VanDerWaalsContact C-N 3.33Å; V732-V734 PolarHBondContact O-N 3.25Å; V732-K735 WeakPolarHBondContact O-CB 3.33Å; V732-K735 PolarHBondContact O-N 3.29Å; V732-K735 VanDerWaalsContact O-N 3.14Å; V732-V736 HydrophobicContact CG1-CG2 4.41Å; V732-V736 WeakPolarHBondContact O-CG2 3.01Å; V732-V736 PolarHBondContact O-N 2.9Å
733	Y	85	Confident	82.1	Confident	48 Å²	48	74.5 Å²	74.5	19%	0.188	38%	0.38	C	S	.	.	H	α-helix	trans	-58	-44.3	177.5	-164.8	-89.9	0	0	0	112.1	L708 F712 N729 K730 V736 G737	L708-Y733 HydrophobicContact CB-CE2 4.23Å; L708-Y733 HydrophobicContact CD1-CE1 4.46Å; F712-Y733 HydrophobicContact CB-CD2 4.1Å; F712-Y733 HydrophobicContact CD2-CD2 4.25Å; F712-Y733 HydrophobicContact CG-CD2 4.16Å; N729-Y733 PolarHBondContact O-N 3.08Å; N729-Y733 VanDerWaalsContact O-N 3.11Å; K730-Y733 WeakPolarHBondContact O-CB 3.31Å; K730-Y733 PolarHBondContact O-N 3.43Å; Y733-V736 PolarHBondContact O-N 2.79Å; Y733-G737 PolarHBondContact O-N 3.05Å
734	V	85.7	Confident	81.5	Confident	81 Å²	81	78.6 Å²	78.6	49%	0.491	41%	0.411	S	S	.	.	H	α-helix	trans	-62.2	-44.8	175.2	172.6	0	0	0	0	111.3	K730 G731 V732 V736 G737 L738	K730-V734 WeakPolarHBondContact O-CG2 3.3Å; K730-V734 PolarHBondContact O-N 3.24Å; K730-V734 VanDerWaalsContact O-N 3.08Å; G731-V734 PolarHBondContact O-N 3.12Å; V732-V734 VanDerWaalsContact C-N 3.33Å; V732-V734 PolarHBondContact O-N 3.25Å; V734-V736 PolarHBondContact O-N 3.21Å; V734-G737 PolarHBondContact O-N 3.16Å; V734-L738 HydrophobicContact CG1-CD1 4.28Å; V734-L738 HydrophobicContact CG1-CG 4.38Å; V734-L738 WeakPolarHBondContact O-CG 3.34Å; V734-L738 PolarHBondContact O-N 2.99Å
735	K	87.1	Confident	81.8	Confident	137 Å²	137	76.9 Å²	76.9	60%	0.596	40%	0.396	S	S	*	.	H	α-helix	trans	-59.1	-46.9	179.4	-178.7	-176.1	175.7	-174.3	0	111.7	G731 V732 G737 L738 Q739	G731-K735 PolarHBondContact O-N 3.31Å; V732-K735 WeakPolarHBondContact O-CB 3.33Å; V732-K735 PolarHBondContact O-N 3.29Å; V732-K735 VanDerWaalsContact O-N 3.14Å; K735-G737 VanDerWaalsContact C-N 3.33Å; K735-L738 PolarHBondContact O-N 3.22Å; K735-Q739 WeakPolarHBondContact O-CG 3.35Å; K735-Q739 PolarHBondContact O-N 3.28Å
736	V	86.5	Confident	82.1	Confident	13 Å²	13	76.3 Å²	76.3	8%	0.079	39%	0.392	C	S	.	.	H	α-helix	trans	-60.5	-44.1	175.8	169.3	0	0	0	0	110.5	L708 D711 V732 Y733 V734 L738 Q739	L708-V736 HydrophobicContact CD2-CG1 3.98Å; D711-V736 HydrophobicContact CB-CG1 3.34Å; D711-V736 HydrophobicContact CB-CG2 4.44Å; V732-V736 HydrophobicContact CG1-CG2 4.41Å; V732-V736 WeakPolarHBondContact O-CG2 3.01Å; V732-V736 PolarHBondContact O-N 2.9Å; Y733-V736 PolarHBondContact O-N 2.79Å; V734-V736 PolarHBondContact O-N 3.21Å; V736-L738 PolarHBondContact O-N 3.07Å; V736-Q739 PolarHBondContact O-N 2.82Å
737	G	84	Confident	82.6	Confident	5 Å²	5	72.7 Å²	72.7	5%	0.052	38%	0.379	C	S	.	.	H	α-helix	trans	-54.9	-50.4	174.5	0	0	0	0	0	113.4	Y733 V734 K735 Q739 K740	Y733-G737 PolarHBondContact O-N 3.05Å; V734-G737 PolarHBondContact O-N 3.16Å; K735-G737 VanDerWaalsContact C-N 3.33Å; G737-Q739 PolarHBondContact O-N 2.88Å; G737-K740 PolarHBondContact O-N 3.48Å
738	L	84.8	Confident	83.1	Confident	114 Å²	114	66.3 Å²	66.3	60%	0.597	35%	0.351	S	S	*	.	H	α-helix	trans	-59	-31.7	-178.8	-69.2	177.3	0	0	0	112.9	V734 K735 V736 K740 I741	V734-L738 HydrophobicContact CG1-CD1 4.28Å; V734-L738 HydrophobicContact CG1-CG 4.38Å; V734-L738 WeakPolarHBondContact O-CG 3.34Å; V734-L738 PolarHBondContact O-N 2.99Å; K735-L738 PolarHBondContact O-N 3.22Å; V736-L738 PolarHBondContact O-N 3.07Å; L738-K740 PolarHBondContact O-N 2.75Å; L738-I741 HydrophobicContact CD2-CD1 3.61Å
739	Q	85.3	Confident	83.5	Confident	123 Å²	123	69.8 Å²	69.8	58%	0.575	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-13.9	178.8	-68.9	174.4	-26.6	0	0	113.7	K735 V736 G737	K735-Q739 WeakPolarHBondContact O-CG 3.35Å; K735-Q739 PolarHBondContact O-N 3.28Å; V736-Q739 PolarHBondContact O-N 2.82Å; G737-Q739 PolarHBondContact O-N 2.88Å
740	K	84.3	Confident	83.9	Confident	24 Å²	24	71.5 Å²	71.5	10%	0.104	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	-0.5	-173.9	-57.3	-69.1	175.5	126.8	0	113.9	I704 E707 L708 D711 G737 L738 S742 R743 V809	I704-K740 HydrophobicContact CD1-CB 4.32Å; E707-K740 IonicContact OE1-NZ 2.82Å; E707-K740 PolarHBondContact OE1-NZ 2.92Å; L708-K740 HydrophobicContact CD2-CG 4.24Å; D711-K740 IonicContact OD1-NZ 3.79Å; D711-K740 WeakPolarHBondContact OD2-CE 3.33Å; D711-K740 IonicContact OD2-NZ 3.71Å; D711-K740 PolarHBondContact OD2-NZ 3.21Å; G737-K740 PolarHBondContact O-N 3.48Å; L738-K740 PolarHBondContact O-N 2.75Å; K740-S742 PolarHBondContact O-N 2.68Å; K740-R743 PolarHBondContact O-N 2.92Å; K740-V809 HydrophobicContact CB-CG2 4.13Å
741	I	80.6	Confident	84.5	Confident	86 Å²	86	67.5 Å²	67.5	44%	0.441	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-32.2	-176.1	-71.5	173.2	0	0	0	113.3	L738 V809 V810	L738-I741 HydrophobicContact CD2-CD1 3.61Å; I741-V809 HydrophobicContact CD1-CG1 4.5Å; I741-V809 HydrophobicContact CG1-CB 3.94Å; I741-V809 HydrophobicContact CG1-CG1 3.89Å; I741-V810 HydrophobicContact CG1-CG2 4.46Å; I741-V810 HydrophobicContact CG2-CG2 4.02Å
742	S	70.4	Confident	85	Confident	114 Å²	114	71.3 Å²	71.3	80%	0.797	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-0.8	-175.1	56.4	0	0	0	0	114.9	K740	K740-S742 PolarHBondContact O-N 2.68Å
743	R	73.4	Confident	85.7	Confident	141 Å²	141	70.6 Å²	70.6	53%	0.532	36%	0.358	S	S	.	.			trans	-94.2	107	-179.1	-71.5	-177.3	172.2	-176.4	-4.2	110.4	E707 K740	E707-R743 IonicContact OE1-NH1 2.75Å; K740-R743 PolarHBondContact O-N 2.92Å
744	S	66.6	Low	86.3	Confident	110 Å²	110	70.9 Å²	70.9	77%	0.769	36%	0.361	S	S	*	.			trans	-78.3	132.8	172.8	177.5	0	0	0	0	110.8
745	R	78.4	Confident	86.8	Confident	46 Å²	46	67.5 Å²	67.5	17%	0.174	34%	0.341	C	S	.	.			trans	-126.1	156.9	179.9	-57.4	177	-168.5	163.2	2.7	110.8	I704 E707 E766	I704-R745 VanDerWaalsContact CA-NH1 3.33Å; E707-R745 IonicContact OE1-CZ 2.78Å; E707-R745 IonicContact OE1-NH2 2.65Å; E707-R745 PolarHBondContact OE1-NH2 3.17Å; E707-R745 IonicContact OE2-CZ 2.8Å; E707-R745 IonicContact OE2-NE 3.83Å; E707-R745 IonicContact OE2-NH1 3.24Å; E707-R745 PolarHBondContact OE2-NH1 3.03Å; E707-R745 IonicContact OE2-NH2 3.95Å; E707-R745 PolarHBondContact OE2-NH2 3.35Å; R745-E766 HydrophobicContact CB-CB 4.21Å; R745-E766 HydrophobicContact CB-CG 3.96Å; R745-E766 PolarHBondContact N-OE1 3.1Å
746	S	86.4	Confident	87.2	Confident	46 Å²	46	64 Å²	64	32%	0.322	33%	0.328	S	S	.	.			trans	-127.9	57.6	177.6	-67.9	0	0	0	0	110.5	H748 K749	S746-H748 PolarHBondContact O-N 3.32Å; S746-K749 WeakPolarHBondContact O-CB 3.48Å; S746-K749 PolarHBondContact O-N 2.86Å
747	L	92.1	Very high	87.4	Confident	7 Å²	7	71 Å²	71	4%	0.037	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-56.2	-37.1	-175.4	-177.8	68.4	0	0	0	112	K749 E750 L751 I765 L768 L839	L747-K749 PolarHBondContact O-N 3.48Å; L747-K749 VanDerWaalsContact O-N 3.08Å; L747-E750 PolarHBondContact O-N 2.91Å; L747-L751 HydrophobicContact CD1-CD1 3.91Å; L747-L751 HydrophobicContact CD1-CG 4.1Å; L747-L751 HydrophobicContact CD2-CD1 3.94Å; L747-L751 HydrophobicContact CG-CD1 3.64Å; L747-L751 HydrophobicContact CG-CG 4.15Å; L747-L751 PolarHBondContact O-N 3.25Å; L747-I765 WeakPolarHBondContact CB-O 3.09Å; L747-I765 PolarHBondContact N-O 3.2Å; L747-L768 HydrophobicContact CD2-CB 4.29Å; L747-L839 HydrophobicContact CD1-CD2 3.89Å
748	H	92.7	Very high	87.9	Confident	45 Å²	45	77 Å²	77	21%	0.208	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-56.8	-22	176.9	66	-79.7	0	0	0	115.1	S746 L762 P763 N764 I765	S746-H748 PolarHBondContact O-N 3.32Å; H748-L762 HydrophobicContact CB-CB 3.91Å; H748-P763 WeakPolarHBondContact CB-O 3.36Å; H748-N764 PolarHBondContact CE1-OD1 3.07Å; H748-N764 PolarHBondContact ND1-OD1 2.92Å; H748-I765 HydrophobicContact CB-CG1 4.11Å
749	K	92.9	Very high	88.5	Confident	154 Å²	154	76.5 Å²	76.5	67%	0.67	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-84.9	-14.8	176.6	-60.1	-176.3	-178.1	171.3	0	113	S746 L747	S746-K749 WeakPolarHBondContact O-CB 3.48Å; S746-K749 PolarHBondContact O-N 2.86Å; L747-K749 PolarHBondContact O-N 3.48Å; L747-K749 VanDerWaalsContact O-N 3.08Å
750	E	92.8	Very high	89	Confident	49 Å²	49	72.1 Å²	72.1	23%	0.229	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-6.6	-173	-57.6	-176.1	157.6	0	0	111.9	L747 S836 K837	L747-E750 PolarHBondContact O-N 2.91Å; E750-S836 WeakPolarHBondContact O-CB 3.39Å; E750-S836 PolarHBondContact O-N 3.33Å; E750-S836 PolarHBondContact O-OG 3.02Å; E750-S836 VanDerWaalsContact O-OG 3.08Å; E750-K837 WeakPolarHBondContact OE1-CD 3.5Å; E750-K837 IonicContact OE1-NZ 3.56Å; E750-K837 PolarHBondContact OE1-NZ 3.07Å
751	L	95.7	Very high	89.6	Confident	10 Å²	10	76.6 Å²	76.6	5%	0.052	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	139.8	-175.7	-63.9	-175.4	0	0	0	111.6	L747 L762 L768 L833 I834 V835 L839	L747-L751 HydrophobicContact CD1-CD1 3.91Å; L747-L751 HydrophobicContact CD1-CG 4.1Å; L747-L751 HydrophobicContact CD2-CD1 3.94Å; L747-L751 HydrophobicContact CG-CD1 3.64Å; L747-L751 HydrophobicContact CG-CG 4.15Å; L747-L751 PolarHBondContact O-N 3.25Å; L751-L762 HydrophobicContact CB-CD1 3.62Å; L751-L762 HydrophobicContact CD1-CD1 4.36Å; L751-L768 HydrophobicContact CD1-CB 4.4Å; L751-L768 HydrophobicContact CD1-CD2 3.94Å; L751-L833 HydrophobicContact CB-CD1 4.21Å; L751-L833 HydrophobicContact CD1-CD1 4.35Å; L751-L833 HydrophobicContact CD2-CD1 4.35Å; L751-L833 HydrophobicContact CD2-CD2 4.02Å; L751-L833 HydrophobicContact CD2-CG 4.23Å; L751-I834 WeakPolarHBondContact CA-O 3.48Å; L751-V835 HydrophobicContact CD2-CB 4.35Å; L751-V835 HydrophobicContact CD2-CG1 4.45Å; L751-V835 HydrophobicContact CD2-CG2 3.83Å; L751-L839 HydrophobicContact CD2-CD2 3.99Å
752	Q	96.5	Very high	90.3	Very high	121 Å²	121	73.9 Å²	73.9	57%	0.565	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.3	123.2	162.5	-54.9	-179.1	5	0	0	109	L833 I834	Q752-L833 WeakPolarHBondContact O-CA 3.34Å; Q752-I834 HydrophobicContact CB-CB 4.13Å; Q752-I834 PolarHBondContact N-O 3.15Å; Q752-I834 PolarHBondContact O-N 3.26Å
753	L	97.7	Very high	91.5	Very high	8 Å²	8	70.6 Å²	70.6	4%	0.042	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	131.9	-177.1	176.6	65.9	0	0	0	110.6	V755 V760 L762 F770 V803 I825 I831 L833	L753-V755 HydrophobicContact CD1-CG2 3.98Å; L753-V755 HydrophobicContact CD2-CG2 4.1Å; L753-V755 HydrophobicContact CG-CG2 3.95Å; L753-V760 HydrophobicContact CD2-CB 4Å; L753-V760 HydrophobicContact CD2-CG1 4.17Å; L753-V760 HydrophobicContact CG-CB 4.18Å; L753-V760 PolarHBondContact O-N 3.37Å; L753-L762 HydrophobicContact CB-CD1 4.37Å; L753-L762 HydrophobicContact CB-CD2 4.14Å; L753-L762 HydrophobicContact CB-CG 4.24Å; L753-L762 HydrophobicContact CD2-CD2 3.74Å; L753-F770 HydrophobicContact CD1-CE1 4.19Å; L753-F770 HydrophobicContact CD1-CZ 4.11Å; L753-V803 HydrophobicContact CD2-CG1 3.94Å; L753-I825 HydrophobicContact CD2-CG2 3.98Å; L753-I831 HydrophobicContact CD1-CG2 3.78Å; L753-L833 HydrophobicContact CB-CD1 4.19Å; L753-L833 HydrophobicContact CD1-CD1 4.08Å
754	Q	97.6	Very high	92.5	Very high	55 Å²	55	69.1 Å²	69.1	26%	0.257	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	131.1	168.3	-176	-177	27.9	0	0	109	K757 Q758 R832	Q754-K757 VanDerWaalsContact NE2-CA 3.28Å; Q754-K757 PolarHBondContact NE2-O 3.36Å; Q754-Q758 CarbonylContact C-O 3.44Å; Q754-Q758 VanDerWaalsContact CA-O 3.29Å; Q754-Q758 WeakPolarHBondContact CA-O 3.33Å; Q754-Q758 WeakPolarHBondContact CG-O 3.26Å; Q754-R832 HydrophobicContact CB-CB 4.22Å; Q754-R832 PolarHBondContact N-O 3.41Å; Q754-R832 PolarHBondContact O-N 3.25Å
755	V	96.9	Very high	93.9	Very high	9 Å²	9	63.9 Å²	63.9	6%	0.055	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	124.6	178.9	-178.3	0	0	0	0	108.3	L753 K757 Q758 V760 V803 A826 Y830 I831	L753-V755 HydrophobicContact CD1-CG2 3.98Å; L753-V755 HydrophobicContact CD2-CG2 4.1Å; L753-V755 HydrophobicContact CG-CG2 3.95Å; V755-K757 PolarHBondContact O-N 3.14Å; V755-K757 VanDerWaalsContact O-N 3.16Å; V755-Q758 PolarHBondContact N-O 3.49Å; V755-Q758 PolarHBondContact O-N 2.96Å; V755-V760 HydrophobicContact CB-CG2 3.93Å; V755-V760 HydrophobicContact CG2-CG2 3.83Å; V755-V803 HydrophobicContact CG2-CG2 4.36Å; V755-A826 HydrophobicContact CB-CB 4.31Å; V755-A826 HydrophobicContact CG1-CB 4.23Å; V755-A826 HydrophobicContact CG2-CB 3.88Å; V755-Y830 WeakPolarHBondContact CA-O 3.38Å; V755-I831 HydrophobicContact CB-CD1 4.22Å; V755-I831 HydrophobicContact CG1-CD1 3.85Å; V755-I831 HydrophobicContact CG2-CD1 3.74Å
756	D	95.1	Very high	94.7	Very high	63 Å²	63	63 Å²	63	34%	0.337	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.1	45.7	-177.4	-62.5	-36.2	0	0	0	112.7	Q758 G828 S829 Y830	D756-Q758 PolarHBondContact O-N 3.1Å; D756-G828 WeakPolarHBondContact OD2-CA 3.32Å; D756-S829 PolarHBondContact OD1-N 3.45Å; D756-S829 PolarHBondContact OD1-OG 3.09Å; D756-S829 PolarHBondContact OD2-N 3.01Å; D756-Y830 PolarHBondContact N-O 2.65Å; D756-Y830 PolarHBondContact OD1-N 3.21Å
757	K	91.3	Very high	95.2	Very high	162 Å²	162	60.8 Å²	60.8	70%	0.704	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.9	0	-177.5	-52.3	177.7	-179.2	179.3	0	116	Q754 V755	Q754-K757 VanDerWaalsContact NE2-CA 3.28Å; Q754-K757 PolarHBondContact NE2-O 3.36Å; V755-K757 PolarHBondContact O-N 3.14Å; V755-K757 VanDerWaalsContact O-N 3.16Å
758	Q	95	Very high	95.4	Very high	131 Å²	131	60.4 Å²	60.4	61%	0.612	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.6	129.2	176.4	-61.1	-58.5	-33	0	0	111.2	Q754 V755 D756 V760	Q754-Q758 CarbonylContact C-O 3.44Å; Q754-Q758 VanDerWaalsContact CA-O 3.29Å; Q754-Q758 WeakPolarHBondContact CA-O 3.33Å; Q754-Q758 WeakPolarHBondContact CG-O 3.26Å; V755-Q758 PolarHBondContact N-O 3.49Å; V755-Q758 PolarHBondContact O-N 2.96Å; D756-Q758 PolarHBondContact O-N 3.1Å; Q758-V760 PolarHBondContact O-N 2.63Å
759	P	96.4	Very high	95.7	Very high	102 Å²	102	58.3 Å²	58.3	66%	0.662	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.5	131.6	173.1	27.8	-32.3	0	0	0	109.8
760	V	97	Very high	95.9	Very high	32 Å²	32	51 Å²	51	19%	0.194	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	117.1	-178.2	-177.9	0	0	0	0	109.5	L753 V755 Q758 I825 A826	L753-V760 HydrophobicContact CD2-CB 4Å; L753-V760 HydrophobicContact CD2-CG1 4.17Å; L753-V760 HydrophobicContact CG-CB 4.18Å; L753-V760 PolarHBondContact O-N 3.37Å; V755-V760 HydrophobicContact CB-CG2 3.93Å; V755-V760 HydrophobicContact CG2-CG2 3.83Å; Q758-V760 PolarHBondContact O-N 2.63Å; V760-I825 HydrophobicContact CG1-CG2 3.59Å; V760-A826 HydrophobicContact CG1-CB 4.49Å
761	P	95.7	Very high	96.2	Very high	117 Å²	117	48.7 Å²	48.7	76%	0.76	26%	0.258	S	S	*	.			trans	-69.1	133.9	178.3	28	-33.3	0	0	0	111
762	L	96.6	Very high	96.2	Very high	29 Å²	29	48.2 Å²	48.2	15%	0.152	26%	0.255	C	S	.	.			trans	-90.1	131.3	179.4	-67.2	175.2	0	0	0	111.3	H748 L751 L753 I765 L768 I825	H748-L762 HydrophobicContact CB-CB 3.91Å; L751-L762 HydrophobicContact CB-CD1 3.62Å; L751-L762 HydrophobicContact CD1-CD1 4.36Å; L753-L762 HydrophobicContact CB-CD1 4.37Å; L753-L762 HydrophobicContact CB-CD2 4.14Å; L753-L762 HydrophobicContact CB-CG 4.24Å; L753-L762 HydrophobicContact CD2-CD2 3.74Å; L762-I765 HydrophobicContact CD2-CD1 4.21Å; L762-L768 HydrophobicContact CD2-CD1 4.12Å; L762-L768 HydrophobicContact CD2-CD2 4.48Å; L762-I825 HydrophobicContact CD2-CD1 4.05Å; L762-I825 HydrophobicContact CD2-CG2 4.33Å
763	P	95.1	Very high	96.2	Very high	46 Å²	46	42.5 Å²	42.5	30%	0.299	23%	0.228	S	C	.	.			trans	-71.2	174.4	171.3	27.5	-28.4	0	0	0	111	H748 I765 I823 I825	H748-P763 WeakPolarHBondContact CB-O 3.36Å; P763-I765 HydrophobicContact CG-CG2 3.9Å; P763-I765 WeakPolarHBondContact O-CG1 3.05Å; P763-I765 PolarHBondContact O-N 2.84Å; P763-I823 HydrophobicContact CG-CG2 3.98Å; P763-I825 HydrophobicContact CG-CD1 4.36Å; P763-I825 HydrophobicContact CG-CG1 4.3Å
764	N	94.7	Very high	96	Very high	110 Å²	110	44.1 Å²	44.1	59%	0.588	24%	0.24	S	C	*	.	S	Bend	trans	-66.5	92.8	177.1	-174.5	18.7	0	0	0	111.4	H748 T807	H748-N764 PolarHBondContact CE1-OD1 3.07Å; H748-N764 PolarHBondContact ND1-OD1 2.92Å; N764-T807 WeakPolarHBondContact O-CG2 3.39Å
765	I	95.6	Very high	95.9	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.229	C	C	.	.			trans	-120.3	155.9	-177.3	61.2	173.3	0	0	0	111.3	L747 H748 L762 P763 L768 V806 I823 I825	L747-I765 WeakPolarHBondContact CB-O 3.09Å; L747-I765 PolarHBondContact N-O 3.2Å; H748-I765 HydrophobicContact CB-CG1 4.11Å; L762-I765 HydrophobicContact CD2-CD1 4.21Å; P763-I765 HydrophobicContact CG-CG2 3.9Å; P763-I765 WeakPolarHBondContact O-CG1 3.05Å; P763-I765 PolarHBondContact O-N 2.84Å; I765-L768 HydrophobicContact CD1-CB 4.05Å; I765-L768 HydrophobicContact CD1-CD1 3.92Å; I765-V806 WeakPolarHBondContact CA-O 3.48Å; I765-V806 WeakPolarHBondContact CB-O 3.25Å; I765-I823 HydrophobicContact CG2-CD1 4.25Å; I765-I825 HydrophobicContact CD1-CD1 4.33Å
766	E	95.3	Very high	95.8	Very high	26 Å²	26	41.3 Å²	41.3	12%	0.121	23%	0.226	C	C	.	.	S	Bend	trans	-111.9	-12	172.3	-57.6	-165.1	162.8	0	0	112.3	I704 R745 V806 G808	I704-E766 HydrophobicContact CB-CB 4.35Å; I704-E766 HydrophobicContact CG2-CB 4.06Å; I704-E766 PolarHBondContact N-O 3.28Å; R745-E766 HydrophobicContact CB-CB 4.21Å; R745-E766 HydrophobicContact CB-CG 3.96Å; R745-E766 PolarHBondContact N-OE1 3.1Å; E766-V806 PolarHBondContact N-O 2.63Å; E766-G808 WeakPolarHBondContact OE2-CA 3.12Å
767	G	95.8	Very high	95.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	145.3	173.8	0	0	0	0	0	112	L702 G805 V806	L702-G767 WeakPolarHBondContact O-CA 3.18Å; G767-G805 WeakPolarHBondContact O-CA 3.4Å; G767-V806 PolarHBondContact N-O 3.37Å; G767-V806 PolarHBondContact O-N 3.36Å
768	L	97.8	Very high	95.3	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	126.2	176.9	-175	66.1	0	0	0	108.2	G701 L702 L747 L751 L762 I765 F770 V803 I825 L833	G701-L768 CarbonylContact C-O 3.54Å; G701-L768 WeakPolarHBondContact CA-O 3.48Å; L702-L768 HydrophobicContact CD1-CB 4.38Å; L702-L768 PolarHBondContact N-O 2.84Å; L702-L768 PolarHBondContact O-N 3.19Å; L747-L768 HydrophobicContact CD2-CB 4.29Å; L751-L768 HydrophobicContact CD1-CB 4.4Å; L751-L768 HydrophobicContact CD1-CD2 3.94Å; L762-L768 HydrophobicContact CD2-CD1 4.12Å; L762-L768 HydrophobicContact CD2-CD2 4.48Å; I765-L768 HydrophobicContact CD1-CB 4.05Å; I765-L768 HydrophobicContact CD1-CD1 3.92Å; L768-F770 HydrophobicContact CD2-CE2 3.94Å; L768-F770 HydrophobicContact CD2-CZ 3.77Å; L768-F770 HydrophobicContact CG-CE2 4.03Å; L768-F770 HydrophobicContact CG-CZ 4.12Å; L768-V803 HydrophobicContact CD1-CG1 3.71Å; L768-V803 HydrophobicContact CG-CG1 4.46Å; L768-I825 HydrophobicContact CD1-CD1 3.65Å; L768-L833 HydrophobicContact CD2-CD1 4.03Å
769	I	98.2	Very high	95.2	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	133.2	-175.1	-58.2	94	0	0	0	109.5	F700 D705 L771 L782 V804 V806	F700-I769 CarbonylContact O-C 3.5Å; F700-I769 WeakPolarHBondContact O-CA 3.26Å; D705-I769 HydrophobicContact CB-CD1 4.28Å; D705-I769 HydrophobicContact CB-CG1 4.15Å; I769-L771 HydrophobicContact CG2-CD2 3.55Å; I769-L771 HydrophobicContact CG2-CG 4.23Å; I769-L782 HydrophobicContact CB-CD2 3.88Å; I769-L782 HydrophobicContact CD1-CD2 4.11Å; I769-L782 HydrophobicContact CG1-CD2 4.2Å; I769-L782 HydrophobicContact CG2-CD2 3.99Å; I769-V804 PolarHBondContact N-O 3.22Å; I769-V804 PolarHBondContact O-N 3.37Å; I769-V806 HydrophobicContact CD1-CB 4.45Å; I769-V806 HydrophobicContact CD1-CG1 3.96Å; I769-V806 HydrophobicContact CD1-CG2 3.71Å
770	F	98.1	Very high	95	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	118.6	173.6	-59.2	-89.6	0	0	0	108.7	Y699 F700 L702 L753 L768 L801 E802 V803 I831 I857	Y699-F770 CarbonylContact C-O 3.54Å; Y699-F770 WeakPolarHBondContact CA-O 3.34Å; Y699-F770 WeakPolarHBondContact CB-O 3.47Å; F700-F770 HydrophobicContact CB-CB 4.38Å; F700-F770 AromaticContact CD1-CD2 3.55Å; F700-F770 HydrophobicContact CD1-CD2 3.55Å; F700-F770 HydrophobicContact CD1-CE2 4.05Å; F700-F770 HydrophobicContact CD1-CG 4.4Å; F700-F770 HydrophobicContact CE1-CD2 4.25Å; F700-F770 HydrophobicContact CE1-CE2 4.3Å; F700-F770 HydrophobicContact CG-CD2 4.4Å; F700-F770 PolarHBondContact N-O 3.3Å; F700-F770 PolarHBondContact O-N 2.95Å; L702-F770 HydrophobicContact CD1-CD2 4.06Å; L702-F770 HydrophobicContact CD1-CE2 3.57Å; L753-F770 HydrophobicContact CD1-CE1 4.19Å; L753-F770 HydrophobicContact CD1-CZ 4.11Å; L768-F770 HydrophobicContact CD2-CE2 3.94Å; L768-F770 HydrophobicContact CD2-CZ 3.77Å; L768-F770 HydrophobicContact CG-CE2 4.03Å; L768-F770 HydrophobicContact CG-CZ 4.12Å; F770-L801 HydrophobicContact CB-CD1 4.48Å; F770-E802 CarbonylContact C-O 3.59Å; F770-E802 VanDerWaalsContact CA-O 3.3Å; F770-E802 WeakPolarHBondContact CA-O 3.47Å; F770-V803 HydrophobicContact CD1-CB 4.41Å; F770-V803 HydrophobicContact CD1-CG1 4.18Å; F770-V803 HydrophobicContact CD1-CG2 3.77Å; F770-V803 HydrophobicContact CE1-CB 4.32Å; F770-V803 HydrophobicContact CE1-CG1 3.74Å; F770-V803 HydrophobicContact CE1-CG2 3.74Å; F770-V803 HydrophobicContact CZ-CG1 4.3Å; F770-I831 HydrophobicContact CD1-CD1 4.31Å; F770-I831 HydrophobicContact CD1-CG1 4.02Å; F770-I831 HydrophobicContact CD1-CG2 4.23Å; F770-I831 HydrophobicContact CE1-CB 4.26Å; F770-I831 HydrophobicContact CE1-CD1 4.09Å; F770-I831 HydrophobicContact CE1-CG1 3.96Å; F770-I831 HydrophobicContact CE1-CG2 3.41Å; F770-I831 VanDerWaalsContact CE1-CG2 3.41Å; F770-I831 HydrophobicContact CZ-CG2 3.76Å; F770-I857 HydrophobicContact CB-CD1 4.38Å; F770-I857 HydrophobicContact CD1-CD1 4.07Å; F770-I857 HydrophobicContact CD2-CD1 3.92Å; F770-I857 HydrophobicContact CE1-CD1 4.37Å; F770-I857 HydrophobicContact CE2-CD1 4.19Å; F770-I857 HydrophobicContact CG-CD1 3.85Å; F770-I857 HydrophobicContact CZ-CD1 4.41Å
771	L	97.8	Very high	94.8	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.01	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	132.2	-177.4	-47.1	166	0	0	0	110.2	Y699 I769 W776 L782 L801 E802 V804	Y699-L771 HydrophobicContact CG-CD2 4.34Å; I769-L771 HydrophobicContact CG2-CD2 3.55Å; I769-L771 HydrophobicContact CG2-CG 4.23Å; L771-W776 HydrophobicContact CD2-CB 4.05Å; L771-W776 HydrophobicContact CD2-CG 4.44Å; L771-L782 HydrophobicContact CD1-CB 4.08Å; L771-L782 HydrophobicContact CD1-CD2 4.32Å; L771-L782 HydrophobicContact CD2-CD2 4.26Å; L771-L801 WeakPolarHBondContact O-CA 3.49Å; L771-L801 VanDerWaalsContact O-CD2 3.27Å; L771-L801 WeakPolarHBondContact O-CD2 3.5Å; L771-E802 HydrophobicContact CB-CB 4.08Å; L771-E802 HydrophobicContact CD1-CB 4.23Å; L771-E802 HydrophobicContact CG-CB 4.45Å; L771-E802 PolarHBondContact N-O 2.83Å; L771-E802 PolarHBondContact O-N 3.48Å; L771-V804 HydrophobicContact CD1-CG2 3.9Å
772	N	96.7	Very high	94.7	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	13%	0.131	C	C	.	.	S	Bend	trans	-95.4	-20.5	163.3	-177.7	50.6	0	0	0	111.6	D667 W669 M696 N697 N698 L801	D667-N772 PolarHBondContact O-ND2 3.25Å; W669-N772 PolarHBondContact NE1-OD1 3.4Å; M696-N772 HydrophobicContact CE-CB 4.03Å; N697-N772 PolarHBondContact O-ND2 3.06Å; N698-N772 WeakPolarHBondContact O-CB 3.18Å; N698-N772 PolarHBondContact O-N 2.9Å; N772-L801 HydrophobicContact CB-CD2 3.99Å
773	I	95.8	Very high	94.6	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	13%	0.125	C	C	.	.	S	Bend	trans	-127.6	145.7	-179.3	69.3	174	0	0	0	110.4	D635 L636 I639 N698 S775 I796	D635-I773 HydrophobicContact CB-CD1 3.84Å; L636-I773 HydrophobicContact CB-CD1 4.49Å; L636-I773 HydrophobicContact CD1-CG2 4.48Å; I639-I773 HydrophobicContact CG1-CB 4.17Å; I639-I773 HydrophobicContact CG1-CD1 4.27Å; N698-I773 HydrophobicContact CB-CD1 3.76Å; N698-I773 HydrophobicContact CB-CG1 4.13Å; N698-I773 PolarHBondContact O-N 2.85Å; I773-S775 WeakPolarHBondContact CG1-O 3.25Å; I773-S775 PolarHBondContact O-N 3.31Å; I773-I796 HydrophobicContact CB-CD1 4.44Å; I773-I796 HydrophobicContact CG2-CB 4.47Å; I773-I796 HydrophobicContact CG2-CD1 3.37Å; I773-I796 HydrophobicContact CG2-CG1 3.72Å
774	P	93.9	Very high	94.3	Very high	43 Å²	43	17.9 Å²	17.9	28%	0.279	12%	0.118	S	C	.	.	S	Bend	trans	-78.7	50.7	177.5	31.6	-34.2	0	0	0	111.9	I639 P794	I639-P774 HydrophobicContact CD1-CG 3.82Å; P774-P794 HydrophobicContact CB-CB 4.16Å
775	S	94.6	Very high	93.7	Very high	4 Å²	4	18.3 Å²	18.3	3%	0.028	13%	0.13	C	C	.	.			trans	-154.6	126.5	178.1	-173.1	0	0	0	0	109.4	D635 I773 G779	D635-S775 WeakPolarHBondContact CB-OG 3.3Å; D635-S775 PolarHBondContact OD1-OG 3.14Å; I773-S775 WeakPolarHBondContact CG1-O 3.25Å; I773-S775 PolarHBondContact O-N 3.31Å; S775-G779 WeakPolarHBondContact OG-CA 3.26Å
776	W	94.7	Very high	92.9	Very high	1 Å²	1	25.8 Å²	25.8	0%	0.004	16%	0.164	C	C	.	.	B	Isolated β-bridge	trans	-137	144.5	179.1	170.4	85.2	0	0	0	110.7	D635 Y699 D705 L771 S778 G779 A780 L782 M812 Q816	D635-W776 PolarHBondContact OD1-N 2.91Å; Y699-W776 AromaticContact CD2-CD1 3.8Å; Y699-W776 HydrophobicContact CE1-CB 4.49Å; Y699-W776 AromaticContact CE2-CD1 3.7Å; Y699-W776 AromaticContact CZ-CD1 3.84Å; D705-W776 WeakPolarHBondContact OD1-CZ2 3.4Å; D705-W776 PolarHBondContact OD1-NE1 3Å; L771-W776 HydrophobicContact CD2-CB 4.05Å; L771-W776 HydrophobicContact CD2-CG 4.44Å; W776-S778 PolarHBondContact O-N 3.47Å; W776-G779 PolarHBondContact O-N 3.1Å; W776-A780 HydrophobicContact CE3-CB 4.12Å; W776-A780 PolarHBondContact N-O 3.5Å; W776-A780 WeakPolarHBondContact O-CA 3.4Å; W776-A780 VanDerWaalsContact O-CB 3.31Å; W776-A780 WeakPolarHBondContact O-CB 3.44Å; W776-A780 PolarHBondContact O-N 3.46Å; W776-L782 HydrophobicContact CB-CB 4.18Å; W776-L782 HydrophobicContact CD2-CD1 4.48Å; W776-L782 HydrophobicContact CD2-CD2 4.3Å; W776-L782 HydrophobicContact CE3-CB 4.49Å; W776-L782 HydrophobicContact CE3-CD1 4.12Å; W776-L782 HydrophobicContact CG-CB 4.5Å; W776-L782 HydrophobicContact CG-CD2 4.24Å; W776-L782 HydrophobicContact CZ3-CD1 4.34Å; W776-M812 HydrophobicContact CH2-CB 4.27Å; W776-M812 HydrophobicContact CH2-CE 3.52Å; W776-M812 HydrophobicContact CH2-CG 4.33Å; W776-M812 HydrophobicContact CZ2-CE 3.55Å; W776-Q816 HydrophobicContact CZ3-CG 4.04Å
777	G	88.6	Confident	91.9	Very high	19 Å²	19	29.8 Å²	29.8	20%	0.196	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	49.9	168.1	0	0	0	0	0	114.4
778	S	89.1	Confident	91.2	Very high	32 Å²	32	31.9 Å²	31.9	22%	0.224	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.6	34.8	-176.8	-178	0	0	0	0	114.8	D635 K730 W776	D635-S778 PolarHBondContact OD1-N 3.14Å; D635-S778 PolarHBondContact OD2-N 3.21Å; D635-S778 VanDerWaalsContact OD2-N 3.1Å; K730-S778 PolarHBondContact NZ-OG 3Å; W776-S778 PolarHBondContact O-N 3.47Å
779	G	91.3	Very high	90.4	Very high	38 Å²	38	36.3 Å²	36.3	39%	0.392	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	102	10.1	169.1	0	0	0	0	0	116.2	D635 R638 S775 W776	D635-G779 PolarHBondContact OD1-N 2.82Å; R638-G779 VanDerWaalsContact CD-CA 3.49Å; S775-G779 WeakPolarHBondContact OG-CA 3.26Å; W776-G779 PolarHBondContact O-N 3.1Å
780	A	92.3	Very high	89.9	Confident	12 Å²	12	44.9 Å²	44.9	10%	0.099	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-75.4	143.3	175.2	0	0	0	0	0	110.5	W776 L782 V815 Q816	W776-A780 HydrophobicContact CE3-CB 4.12Å; W776-A780 PolarHBondContact N-O 3.5Å; W776-A780 WeakPolarHBondContact O-CA 3.4Å; W776-A780 VanDerWaalsContact O-CB 3.31Å; W776-A780 WeakPolarHBondContact O-CB 3.44Å; W776-A780 PolarHBondContact O-N 3.46Å; A780-L782 PolarHBondContact O-N 3.03Å; A780-V815 HydrophobicContact CB-CG1 4.33Å; A780-Q816 HydrophobicContact CB-CG 4.33Å
781	D	93.6	Very high	89.6	Confident	65 Å²	65	47 Å²	47	35%	0.348	30%	0.3	S	S	.	.			trans	-92.7	93.8	175	-179.9	9	0	0	0	109	W783 G784	D781-W783 VanDerWaalsContact C-N 3.3Å; D781-W783 PolarHBondContact OD1-N 3.5Å; D781-G784 VanDerWaalsContact CG-N 3.29Å; D781-G784 PolarHBondContact OD1-N 3.5Å; D781-G784 VanDerWaalsContact OD2-C 3.28Å; D781-G784 VanDerWaalsContact OD2-CA 3.29Å; D781-G784 WeakPolarHBondContact OD2-CA 3.47Å; D781-G784 PolarHBondContact OD2-N 3.27Å
782	L	93.9	Very high	89.3	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	32%	0.317	C	S	.	.	S	Bend	trans	-71.3	-27.9	-179.3	-167.5	68.8	0	0	0	111.6	I769 L771 W776 A780 V804 V806 V815 G822	I769-L782 HydrophobicContact CB-CD2 3.88Å; I769-L782 HydrophobicContact CD1-CD2 4.11Å; I769-L782 HydrophobicContact CG1-CD2 4.2Å; I769-L782 HydrophobicContact CG2-CD2 3.99Å; L771-L782 HydrophobicContact CD1-CB 4.08Å; L771-L782 HydrophobicContact CD1-CD2 4.32Å; L771-L782 HydrophobicContact CD2-CD2 4.26Å; W776-L782 HydrophobicContact CB-CB 4.18Å; W776-L782 HydrophobicContact CD2-CD1 4.48Å; W776-L782 HydrophobicContact CD2-CD2 4.3Å; W776-L782 HydrophobicContact CE3-CB 4.49Å; W776-L782 HydrophobicContact CE3-CD1 4.12Å; W776-L782 HydrophobicContact CG-CB 4.5Å; W776-L782 HydrophobicContact CG-CD2 4.24Å; W776-L782 HydrophobicContact CZ3-CD1 4.34Å; A780-L782 PolarHBondContact O-N 3.03Å; L782-V804 HydrophobicContact CD2-CB 3.94Å; L782-V804 HydrophobicContact CD2-CG1 4Å; L782-V804 HydrophobicContact CG-CB 4.21Å; L782-V804 HydrophobicContact CG-CG1 3.76Å; L782-V806 HydrophobicContact CD1-CG1 3.8Å; L782-V815 HydrophobicContact CD1-CB 4.41Å; L782-V815 HydrophobicContact CD1-CG1 3.74Å; L782-V815 HydrophobicContact CD1-CG2 4.25Å; L782-G822 WeakPolarHBondContact O-CA 3.12Å; L782-G822 PolarHBondContact O-N 2.98Å
783	W	94.2	Very high	89	Confident	8 Å²	8	59.8 Å²	59.8	3%	0.03	36%	0.356	C	S	.	.	S	Bend	trans	-77.3	-37.1	178.1	-169.7	-99.4	0	0	0	112.1	D781 F791 P794 E802 V804 R824 Q827	D781-W783 VanDerWaalsContact C-N 3.3Å; D781-W783 PolarHBondContact OD1-N 3.5Å; W783-F791 HydrophobicContact CH2-CB 4.3Å; W783-F791 HydrophobicContact CH2-CD1 4.24Å; W783-F791 HydrophobicContact CH2-CD2 4.2Å; W783-F791 AromaticContact CH2-CG 3.99Å; W783-F791 HydrophobicContact CH2-CG 3.99Å; W783-F791 HydrophobicContact CZ2-CB 3.58Å; W783-F791 HydrophobicContact CZ2-CD1 4.35Å; W783-F791 AromaticContact CZ2-CD2 3.96Å; W783-F791 HydrophobicContact CZ2-CD2 3.96Å; W783-F791 AromaticContact CZ2-CG 3.71Å; W783-F791 HydrophobicContact CZ2-CG 3.71Å; W783-P794 HydrophobicContact CB-CG 4.08Å; W783-P794 HydrophobicContact CD2-CG 3.94Å; W783-P794 HydrophobicContact CG-CG 3.49Å; W783-P794 VanDerWaalsContact CG-CG 3.49Å; W783-E802 HydrophobicContact CD2-CB 4.22Å; W783-E802 HydrophobicContact CD2-CG 3.66Å; W783-E802 HydrophobicContact CE3-CB 3.41Å; W783-E802 VanDerWaalsContact CE3-CB 3.41Å; W783-E802 HydrophobicContact CE3-CG 3.35Å; W783-E802 HydrophobicContact CG-CG 4.36Å; W783-E802 HydrophobicContact CH2-CB 4.34Å; W783-E802 HydrophobicContact CH2-CG 4.05Å; W783-E802 HydrophobicContact CZ2-CG 4.3Å; W783-E802 HydrophobicContact CZ3-CB 3.48Å; W783-E802 VanDerWaalsContact CZ3-CB 3.48Å; W783-E802 HydrophobicContact CZ3-CG 3.57Å; W783-V804 HydrophobicContact CE3-CG2 3.48Å; W783-V804 VanDerWaalsContact CE3-CG2 3.48Å; W783-V804 HydrophobicContact CZ3-CG2 3.85Å; W783-R824 HydrophobicContact CD2-CG 4.06Å; W783-R824 HydrophobicContact CE3-CG 4.08Å; W783-R824 HydrophobicContact CH2-CB 4.02Å; W783-R824 HydrophobicContact CH2-CG 4.15Å; W783-R824 HydrophobicContact CZ2-CB 4.34Å; W783-R824 HydrophobicContact CZ2-CG 4.12Å; W783-R824 HydrophobicContact CZ3-CB 4.16Å; W783-R824 HydrophobicContact CZ3-CG 4.14Å; W783-R824 VanDerWaalsContact O-CZ 3.28Å; W783-R824 PolarHBondContact O-NE 3.32Å; W783-R824 PolarHBondContact O-NH2 3Å; W783-Q827 HydrophobicContact CH2-CG 3.67Å; W783-Q827 HydrophobicContact CZ2-CG 4.01Å; W783-Q827 HydrophobicContact CZ3-CG 4.44Å
784	G	89.4	Confident	88.9	Confident	14 Å²	14	60.6 Å²	60.6	14%	0.144	36%	0.362	C	S	.	.			trans	84.5	160.5	-178.6	0	0	0	0	0	113.4	D781 R824	D781-G784 VanDerWaalsContact CG-N 3.29Å; D781-G784 PolarHBondContact OD1-N 3.5Å; D781-G784 VanDerWaalsContact OD2-C 3.28Å; D781-G784 VanDerWaalsContact OD2-CA 3.29Å; D781-G784 WeakPolarHBondContact OD2-CA 3.47Å; D781-G784 PolarHBondContact OD2-N 3.27Å; G784-R824 PolarHBondContact O-NH2 3.14Å
785	S	80.3	Confident	88.9	Confident	120 Å²	120	65.1 Å²	65.1	84%	0.839	37%	0.373	S	S	*	.	S	Bend	trans	-94.1	-9.1	-172.4	58.6	0	0	0	0	115.2
786	E	78.9	Confident	88.8	Confident	157 Å²	157	65.9 Å²	65.9	73%	0.734	38%	0.377	S	S	*	.	S	Bend	trans	-69.1	136.2	179.9	-64	-171	169	0	0	111.3	D788 R824	E786-D788 PolarHBondContact O-N 2.83Å; E786-R824 VanDerWaalsContact O-CZ 3.27Å; E786-R824 PolarHBondContact O-NH1 3.02Å; E786-R824 PolarHBondContact O-NH2 3.44Å
787	A	75.8	Confident	88.9	Confident	110 Å²	110	69 Å²	69	91%	0.909	39%	0.393	S	S	*	.			trans	-71.3	127.3	176	0	0	0	0	0	110.3
788	D	79.4	Confident	89.2	Confident	44 Å²	44	69.6 Å²	69.6	24%	0.235	39%	0.392	C	S	.	.			trans	-123.1	121.9	172.1	-179.1	-20.1	0	0	0	107.3	E786 R790 F791	E786-D788 PolarHBondContact O-N 2.83Å; D788-R790 PolarHBondContact O-N 2.88Å; D788-R790 WeakPolarHBondContact OD1-CB 3.2Å; D788-R790 WeakPolarHBondContact OD1-CG 3.31Å; D788-R790 PolarHBondContact OD1-N 2.96Å; D788-R790 IonicContact OD1-NE 3.86Å; D788-R790 PolarHBondContact OD1-NE 3.27Å; D788-R790 VanDerWaalsContact OD1-NE 3.15Å; D788-R790 IonicContact OD2-CZ 3.66Å; D788-R790 IonicContact OD2-NE 3.75Å; D788-R790 PolarHBondContact OD2-NE 3.48Å; D788-R790 IonicContact OD2-NH2 3.31Å; D788-R790 PolarHBondContact OD2-NH2 3.49Å; D788-F791 PolarHBondContact O-N 3.43Å; D788-F791 VanDerWaalsContact O-N 3.16Å; D788-F791 VanDerWaalsContact O-O 3.04Å
789	G	81.8	Confident	89.4	Confident	92 Å²	92	69.2 Å²	69.2	95%	0.948	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-11.7	-176.9	0	0	0	0	0	114.4
790	R	87.6	Confident	89.6	Confident	180 Å²	180	69.7 Å²	69.7	68%	0.679	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-20.8	177.6	-62.4	178.6	-65.2	167.2	4.5	113.7	D788	D788-R790 PolarHBondContact O-N 2.88Å; D788-R790 WeakPolarHBondContact OD1-CB 3.2Å; D788-R790 WeakPolarHBondContact OD1-CG 3.31Å; D788-R790 PolarHBondContact OD1-N 2.96Å; D788-R790 IonicContact OD1-NE 3.86Å; D788-R790 PolarHBondContact OD1-NE 3.27Å; D788-R790 VanDerWaalsContact OD1-NE 3.15Å; D788-R790 IonicContact OD2-CZ 3.66Å; D788-R790 IonicContact OD2-NE 3.75Å; D788-R790 PolarHBondContact OD2-NE 3.48Å; D788-R790 IonicContact OD2-NH2 3.31Å; D788-R790 PolarHBondContact OD2-NH2 3.49Å
791	F	92.3	Very high	89.9	Confident	46 Å²	46	69.1 Å²	69.1	20%	0.202	38%	0.382	C	S	.	.	S	Bend	trans	-134.3	150.6	-171	-56.6	-64.7	0	0	0	112.8	W783 D788 R824 Q827	W783-F791 HydrophobicContact CH2-CB 4.3Å; W783-F791 HydrophobicContact CH2-CD1 4.24Å; W783-F791 HydrophobicContact CH2-CD2 4.2Å; W783-F791 AromaticContact CH2-CG 3.99Å; W783-F791 HydrophobicContact CH2-CG 3.99Å; W783-F791 HydrophobicContact CZ2-CB 3.58Å; W783-F791 HydrophobicContact CZ2-CD1 4.35Å; W783-F791 AromaticContact CZ2-CD2 3.96Å; W783-F791 HydrophobicContact CZ2-CD2 3.96Å; W783-F791 AromaticContact CZ2-CG 3.71Å; W783-F791 HydrophobicContact CZ2-CG 3.71Å; D788-F791 PolarHBondContact O-N 3.43Å; D788-F791 VanDerWaalsContact O-N 3.16Å; D788-F791 VanDerWaalsContact O-O 3.04Å; F791-R824 HydrophobicContact CD2-CB 4.09Å; F791-R824 HydrophobicContact CE2-CB 3.76Å; F791-Q827 HydrophobicContact CD1-CB 4.44Å; F791-Q827 HydrophobicContact CD1-CG 4.28Å
792	S	91	Very high	90.1	Very high	51 Å²	51	66 Å²	66	36%	0.357	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-80.2	162.3	174.2	70.2	0	0	0	0	111.2	Q827	S792-Q827 PolarHBondContact O-NE2 3.22Å; S792-Q827 VanDerWaalsContact O-NE2 3.15Å; S792-Q827 PolarHBondContact O-OE1 2.83Å; S792-Q827 PolarHBondContact OG-NE2 3.31Å; S792-Q827 PolarHBondContact OG-OE1 2.88Å
793	R	91.7	Very high	90.2	Very high	218 Å²	218	66 Å²	66	82%	0.823	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-70.5	128.2	174.7	-177.9	178.7	-178.2	160.3	6.2	109.3	R795	R793-R795 PolarHBondContact O-N 3.09Å
794	P	92.9	Very high	90.4	Very high	18 Å²	18	65.6 Å²	65.6	12%	0.117	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-55.8	136.3	178.9	-28.9	36.3	0	0	0	113.2	P774 W783 E802	P774-P794 HydrophobicContact CB-CB 4.16Å; W783-P794 HydrophobicContact CB-CG 4.08Å; W783-P794 HydrophobicContact CD2-CG 3.94Å; W783-P794 HydrophobicContact CG-CG 3.49Å; W783-P794 VanDerWaalsContact CG-CG 3.49Å; P794-E802 WeakPolarHBondContact CA-OE1 3.45Å; P794-E802 HydrophobicContact CB-CG 4.07Å; P794-E802 WeakPolarHBondContact CB-OE1 3.48Å; P794-E802 HydrophobicContact CG-CG 3.77Å
795	R	92.8	Very high	90.7	Very high	138 Å²	138	65 Å²	65	52%	0.521	36%	0.357	S	S	.	.			trans	-137.9	155.7	171.2	-60.7	177	-68.8	-159.7	3.8	109.6	R793 D797 D798	R793-R795 PolarHBondContact O-N 3.09Å; R795-D797 PolarHBondContact O-N 2.92Å; R795-D798 HydrophobicContact CB-CB 4.21Å; R795-D798 WeakPolarHBondContact CB-OD2 3.31Å; R795-D798 IonicContact CZ-OD2 3.15Å; R795-D798 PolarHBondContact N-OD2 3.11Å; R795-D798 IonicContact NE-OD2 3.54Å; R795-D798 PolarHBondContact NE-OD2 3.19Å; R795-D798 IonicContact NH2-OD2 3.99Å
796	I	94.3	Very high	91.5	Very high	20 Å²	20	59.2 Å²	59.2	10%	0.103	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-6.2	-179.8	-170.9	165.4	0	0	0	112.7	L636 I639 M666 D667 I773	L636-I796 HydrophobicContact CD1-CD1 3.88Å; I639-I796 HydrophobicContact CG2-CD1 4.16Å; M666-I796 CarbonylContact C-O 3.55Å; M666-I796 WeakPolarHBondContact CA-O 2.76Å; M666-I796 HydrophobicContact CB-CD1 3.96Å; M666-I796 HydrophobicContact CB-CG1 3.84Å; M666-I796 HydrophobicContact CG-CD1 3.64Å; M666-I796 HydrophobicContact CG-CG1 3.58Å; M666-I796 HydrophobicContact SD-CD1 3.75Å; M666-I796 HydrophobicContact SD-CG1 4.35Å; D667-I796 PolarHBondContact N-O 2.9Å; I773-I796 HydrophobicContact CB-CD1 4.44Å; I773-I796 HydrophobicContact CG2-CB 4.47Å; I773-I796 HydrophobicContact CG2-CD1 3.37Å; I773-I796 HydrophobicContact CG2-CG1 3.72Å
797	D	95.1	Very high	92.2	Very high	65 Å²	65	54.6 Å²	54.6	35%	0.348	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.7	25.5	-167.1	68.3	-24.5	0	0	0	113	Q665 D667 R795 K863	Q665-D797 HydrophobicContact CB-CB 4.19Å; D667-D797 WeakPolarHBondContact OD2-CA 3.43Å; D667-D797 PolarHBondContact OD2-N 2.73Å; R795-D797 PolarHBondContact O-N 2.92Å; D797-K863 VanDerWaalsContact C-NZ 3.34Å; D797-K863 PolarHBondContact O-NZ 2.9Å
798	D	94.9	Very high	92.9	Very high	32 Å²	32	49.6 Å²	49.6	17%	0.171	26%	0.259	C	S	.	.	S	Bend	trans	-106.6	-0.7	179.6	62	13.9	0	0	0	115.3	D667 R795 L800	D667-D798 PolarHBondContact OD2-N 3.29Å; R795-D798 HydrophobicContact CB-CB 4.21Å; R795-D798 WeakPolarHBondContact CB-OD2 3.31Å; R795-D798 IonicContact CZ-OD2 3.15Å; R795-D798 PolarHBondContact N-OD2 3.11Å; R795-D798 IonicContact NE-OD2 3.54Å; R795-D798 PolarHBondContact NE-OD2 3.19Å; R795-D798 IonicContact NH2-OD2 3.99Å; D798-L800 VanDerWaalsContact C-N 3.31Å; D798-L800 PolarHBondContact OD1-N 3.09Å; D798-L800 VanDerWaalsContact OD1-N 3.15Å
799	G	94.7	Very high	93.4	Very high	25 Å²	25	48.6 Å²	48.6	26%	0.258	25%	0.254	S	S	.	.	S	Bend	trans	74.3	21.3	178.9	0	0	0	0	0	113.5	D667 W669 S829	D667-G799 WeakPolarHBondContact OD2-CA 3.32Å; D667-G799 PolarHBondContact OD2-N 3.21Å; W669-G799 WeakPolarHBondContact CH2-O 3.42Å; G799-S829 WeakPolarHBondContact O-CB 3.33Å
800	L	95.7	Very high	93.9	Very high	47 Å²	47	48.2 Å²	48.2	25%	0.246	23%	0.233	C	C	.	.			trans	-120	150.5	178.1	-57.5	175.9	0	0	0	111	D798	D798-L800 VanDerWaalsContact C-N 3.31Å; D798-L800 PolarHBondContact OD1-N 3.09Å; D798-L800 VanDerWaalsContact OD1-N 3.15Å
801	L	97.4	Very high	94.1	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	136.8	166	-70.4	174.2	0	0	0	109.9	W669 M696 F770 L771 N772 Q827 G828 I831 I857	W669-L801 HydrophobicContact CD2-CD1 3.74Å; W669-L801 HydrophobicContact CD2-CD2 3.72Å; W669-L801 HydrophobicContact CD2-CG 3.68Å; W669-L801 VanDerWaalsContact CE2-CD2 3.43Å; W669-L801 HydrophobicContact CE3-CD1 3.57Å; W669-L801 HydrophobicContact CE3-CD2 4.37Å; W669-L801 HydrophobicContact CE3-CG 3.83Å; W669-L801 HydrophobicContact CG-CD1 4.31Å; W669-L801 HydrophobicContact CG-CD2 3.95Å; W669-L801 HydrophobicContact CG-CG 4.38Å; W669-L801 HydrophobicContact CH2-CD1 4.27Å; W669-L801 HydrophobicContact CH2-CG 3.73Å; W669-L801 HydrophobicContact CZ2-CD1 4.43Å; W669-L801 HydrophobicContact CZ2-CD2 3.89Å; W669-L801 HydrophobicContact CZ2-CG 3.59Å; W669-L801 HydrophobicContact CZ3-CD1 3.84Å; W669-L801 HydrophobicContact CZ3-CG 3.83Å; M696-L801 HydrophobicContact CE-CD1 4.23Å; M696-L801 HydrophobicContact CE-CD2 3.45Å; M696-L801 VanDerWaalsContact CE-CD2 3.45Å; F770-L801 HydrophobicContact CB-CD1 4.48Å; L771-L801 WeakPolarHBondContact O-CA 3.49Å; L771-L801 VanDerWaalsContact O-CD2 3.27Å; L771-L801 WeakPolarHBondContact O-CD2 3.5Å; N772-L801 HydrophobicContact CB-CD2 3.99Å; L801-Q827 VanDerWaalsContact O-CA 3.28Å; L801-Q827 WeakPolarHBondContact O-CA 3.45Å; L801-G828 PolarHBondContact N-O 2.84Å; L801-G828 PolarHBondContact O-N 2.79Å; L801-G828 VanDerWaalsContact O-N 3.15Å; L801-I831 HydrophobicContact CD1-CG1 4.19Å; L801-I857 HydrophobicContact CD1-CB 4.3Å; L801-I857 HydrophobicContact CD1-CG2 3.56Å
802	E	97.3	Very high	94.1	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	126.5	166.3	-75	72.7	-139.8	0	0	110.9	F770 L771 W783 P794 V804 Q827	F770-E802 CarbonylContact C-O 3.59Å; F770-E802 VanDerWaalsContact CA-O 3.3Å; F770-E802 WeakPolarHBondContact CA-O 3.47Å; L771-E802 HydrophobicContact CB-CB 4.08Å; L771-E802 HydrophobicContact CD1-CB 4.23Å; L771-E802 HydrophobicContact CG-CB 4.45Å; L771-E802 PolarHBondContact N-O 2.83Å; L771-E802 PolarHBondContact O-N 3.48Å; W783-E802 HydrophobicContact CD2-CB 4.22Å; W783-E802 HydrophobicContact CD2-CG 3.66Å; W783-E802 HydrophobicContact CE3-CB 3.41Å; W783-E802 VanDerWaalsContact CE3-CB 3.41Å; W783-E802 HydrophobicContact CE3-CG 3.35Å; W783-E802 HydrophobicContact CG-CG 4.36Å; W783-E802 HydrophobicContact CH2-CB 4.34Å; W783-E802 HydrophobicContact CH2-CG 4.05Å; W783-E802 HydrophobicContact CZ2-CG 4.3Å; W783-E802 HydrophobicContact CZ3-CB 3.48Å; W783-E802 VanDerWaalsContact CZ3-CB 3.48Å; W783-E802 HydrophobicContact CZ3-CG 3.57Å; P794-E802 WeakPolarHBondContact CA-OE1 3.45Å; P794-E802 HydrophobicContact CB-CG 4.07Å; P794-E802 WeakPolarHBondContact CB-OE1 3.48Å; P794-E802 HydrophobicContact CG-CG 3.77Å; E802-V804 HydrophobicContact CB-CG2 4.35Å; E802-Q827 HydrophobicContact CG-CG 4.21Å; E802-Q827 PolarHBondContact OE1-NE2 3.38Å
803	V	97.6	Very high	94	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	118.3	175.1	-168.8	0	0	0	0	109.6	L753 V755 L768 F770 I825 A826 I831	L753-V803 HydrophobicContact CD2-CG1 3.94Å; V755-V803 HydrophobicContact CG2-CG2 4.36Å; L768-V803 HydrophobicContact CD1-CG1 3.71Å; L768-V803 HydrophobicContact CG-CG1 4.46Å; F770-V803 HydrophobicContact CD1-CB 4.41Å; F770-V803 HydrophobicContact CD1-CG1 4.18Å; F770-V803 HydrophobicContact CD1-CG2 3.77Å; F770-V803 HydrophobicContact CE1-CB 4.32Å; F770-V803 HydrophobicContact CE1-CG1 3.74Å; F770-V803 HydrophobicContact CE1-CG2 3.74Å; F770-V803 HydrophobicContact CZ-CG1 4.3Å; V803-I825 HydrophobicContact CB-CB 4.35Å; V803-I825 HydrophobicContact CG1-CB 4.16Å; V803-I825 HydrophobicContact CG1-CG2 4.22Å; V803-I825 WeakPolarHBondContact O-CB 3.44Å; V803-I825 PolarHBondContact O-N 3.16Å; V803-A826 HydrophobicContact CB-CB 4.08Å; V803-A826 HydrophobicContact CG2-CB 4.02Å; V803-A826 PolarHBondContact N-O 2.9Å; V803-A826 PolarHBondContact O-N 3.35Å; V803-I831 HydrophobicContact CG2-CD1 3.99Å
804	V	97.4	Very high	94.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	134.5	-172.3	-165.6	0	0	0	0	112	I769 L771 L782 W783 E802 I823	I769-V804 PolarHBondContact N-O 3.22Å; I769-V804 PolarHBondContact O-N 3.37Å; L771-V804 HydrophobicContact CD1-CG2 3.9Å; L782-V804 HydrophobicContact CD2-CB 3.94Å; L782-V804 HydrophobicContact CD2-CG1 4Å; L782-V804 HydrophobicContact CG-CB 4.21Å; L782-V804 HydrophobicContact CG-CG1 3.76Å; W783-V804 HydrophobicContact CE3-CG2 3.48Å; W783-V804 VanDerWaalsContact CE3-CG2 3.48Å; W783-V804 HydrophobicContact CZ3-CG2 3.85Å; E802-V804 HydrophobicContact CB-CG2 4.35Å; V804-I823 WeakPolarHBondContact CA-O 3.45Å; V804-I823 WeakPolarHBondContact CG1-O 3.43Å
805	G	96.9	Very high	94	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	143.8	176.3	0	0	0	0	0	113.3	G767 I823	G767-G805 WeakPolarHBondContact O-CA 3.4Å; G805-I823 PolarHBondContact N-O 2.96Å; G805-I823 PolarHBondContact O-N 2.85Å
806	V	95.6	Very high	93.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	149.5	170.2	-63.7	0	0	0	0	110.8	I704 I765 E766 G767 I769 L782 M812	I704-V806 HydrophobicContact CG2-CG2 3.76Å; I765-V806 WeakPolarHBondContact CA-O 3.48Å; I765-V806 WeakPolarHBondContact CB-O 3.25Å; E766-V806 PolarHBondContact N-O 2.63Å; G767-V806 PolarHBondContact N-O 3.37Å; G767-V806 PolarHBondContact O-N 3.36Å; I769-V806 HydrophobicContact CD1-CB 4.45Å; I769-V806 HydrophobicContact CD1-CG1 3.96Å; I769-V806 HydrophobicContact CD1-CG2 3.71Å; L782-V806 HydrophobicContact CD1-CG1 3.8Å; V806-M812 HydrophobicContact CB-CG 3.98Å; V806-M812 HydrophobicContact CG1-CG 4.15Å; V806-M812 HydrophobicContact CG2-CG 4.05Å; V806-M812 HydrophobicContact CG2-SD 4.16Å
807	T	93.9	Very high	93.6	Very high	59 Å²	59	29.7 Å²	29.7	36%	0.362	18%	0.181	S	C	.	.			trans	-108.9	15.2	-169.7	63	0	0	0	0	113.2	N764 H811 I823	N764-T807 WeakPolarHBondContact O-CG2 3.39Å; T807-H811 PolarHBondContact N-ND1 3.17Å; T807-H811 VanDerWaalsContact OG1-CB 3.31Å; T807-H811 WeakPolarHBondContact OG1-CB 3.31Å; T807-H811 PolarHBondContact OG1-ND1 2.9Å; T807-I823 HydrophobicContact CG2-CD1 3.62Å
808	G	91	Very high	93.4	Very high	6 Å²	6	29.7 Å²	29.7	6%	0.062	20%	0.197	C	C	.	.	S	Bend	trans	127.8	178.7	178.5	0	0	0	0	0	114	E766 V810 H811 M812	E766-G808 WeakPolarHBondContact OE2-CA 3.12Å; G808-V810 PolarHBondContact O-N 2.97Å; G808-H811 PolarHBondContact O-N 3.39Å; G808-M812 WeakPolarHBondContact O-CG 3.35Å; G808-M812 PolarHBondContact O-N 3.49Å
809	V	90.2	Very high	93.1	Very high	22 Å²	22	34.6 Å²	34.6	13%	0.133	22%	0.222	C	C	.	.	H	α-helix	trans	-60.3	-41	-170.7	-179.6	0	0	0	0	113	I704 K740 I741 H811 M812 G813	I704-V809 HydrophobicContact CD1-CG2 3.69Å; I704-V809 HydrophobicContact CG1-CG2 3.96Å; K740-V809 HydrophobicContact CB-CG2 4.13Å; I741-V809 HydrophobicContact CD1-CG1 4.5Å; I741-V809 HydrophobicContact CG1-CB 3.94Å; I741-V809 HydrophobicContact CG1-CG1 3.89Å; V809-H811 VanDerWaalsContact C-N 3.35Å; V809-H811 PolarHBondContact O-N 2.88Å; V809-M812 PolarHBondContact O-N 3.42Å; V809-G813 PolarHBondContact O-N 2.97Å
810	V	90.8	Very high	93	Very high	85 Å²	85	40.9 Å²	40.9	52%	0.515	24%	0.238	S	C	.	.	H	α-helix	trans	-63.6	-43.6	-179.3	178.1	0	0	0	0	110.8	I741 G808 G813 Q814	I741-V810 HydrophobicContact CG1-CG2 4.46Å; I741-V810 HydrophobicContact CG2-CG2 4.02Å; G808-V810 PolarHBondContact O-N 2.97Å; V810-G813 PolarHBondContact O-N 3.08Å; V810-Q814 WeakPolarHBondContact O-CG 3.34Å; V810-Q814 PolarHBondContact O-N 3.33Å
811	H	92.8	Very high	92.9	Very high	16 Å²	16	40.7 Å²	40.7	7%	0.074	24%	0.241	C	C	.	.	H	α-helix	trans	-64.1	-45.1	176.4	-179.3	-165	0	0	0	110.8	T807 G808 V809 G813 Q814 V815 S821	T807-H811 PolarHBondContact N-ND1 3.17Å; T807-H811 VanDerWaalsContact OG1-CB 3.31Å; T807-H811 WeakPolarHBondContact OG1-CB 3.31Å; T807-H811 PolarHBondContact OG1-ND1 2.9Å; G808-H811 PolarHBondContact O-N 3.39Å; V809-H811 VanDerWaalsContact C-N 3.35Å; V809-H811 PolarHBondContact O-N 2.88Å; H811-G813 VanDerWaalsContact C-N 3.28Å; H811-G813 PolarHBondContact O-N 3.08Å; H811-Q814 WeakPolarHBondContact O-CB 3.36Å; H811-Q814 PolarHBondContact O-N 3.15Å; H811-Q814 VanDerWaalsContact O-N 3.08Å; H811-V815 WeakPolarHBondContact O-CG2 3.46Å; H811-V815 PolarHBondContact O-N 3.31Å; H811-S821 PolarHBondContact NE2-O 3.25Å; H811-S821 VanDerWaalsContact NE2-O 3.08Å
812	M	91.4	Very high	92.8	Very high	6 Å²	6	40.9 Å²	40.9	3%	0.03	24%	0.243	C	C	.	.	H	α-helix	trans	-58.6	-39.6	174.8	-66.8	168.6	74	0	0	112.4	I704 D705 L708 W776 V806 G808 V809 V815 Q816	I704-M812 HydrophobicContact CB-SD 4.42Å; I704-M812 HydrophobicContact CG1-SD 3.93Å; I704-M812 HydrophobicContact CG2-SD 3.64Å; D705-M812 HydrophobicContact CB-CE 4.09Å; L708-M812 HydrophobicContact CD1-CE 3.97Å; L708-M812 HydrophobicContact CD1-SD 4.39Å; W776-M812 HydrophobicContact CH2-CB 4.27Å; W776-M812 HydrophobicContact CH2-CE 3.52Å; W776-M812 HydrophobicContact CH2-CG 4.33Å; W776-M812 HydrophobicContact CZ2-CE 3.55Å; V806-M812 HydrophobicContact CB-CG 3.98Å; V806-M812 HydrophobicContact CG1-CG 4.15Å; V806-M812 HydrophobicContact CG2-CG 4.05Å; V806-M812 HydrophobicContact CG2-SD 4.16Å; G808-M812 WeakPolarHBondContact O-CG 3.35Å; G808-M812 PolarHBondContact O-N 3.49Å; V809-M812 PolarHBondContact O-N 3.42Å; M812-V815 PolarHBondContact O-N 3.04Å; M812-Q816 PolarHBondContact O-N 2.94Å
813	G	89.8	Confident	92.7	Very high	37 Å²	37	43.7 Å²	43.7	38%	0.381	26%	0.257	S	S	.	.	H	α-helix	trans	-63.5	-37.8	174.5	0	0	0	0	0	113.2	V809 V810 H811 V815 Q816 S817	V809-G813 PolarHBondContact O-N 2.97Å; V810-G813 PolarHBondContact O-N 3.08Å; H811-G813 VanDerWaalsContact C-N 3.28Å; H811-G813 PolarHBondContact O-N 3.08Å; G813-V815 VanDerWaalsContact C-N 3.35Å; G813-Q816 PolarHBondContact O-N 2.81Å; G813-S817 PolarHBondContact O-N 3.16Å; G813-S817 VanDerWaalsContact O-N 3.1Å; G813-S817 PolarHBondContact O-OG 3.48Å
814	Q	92.9	Very high	92.6	Very high	59 Å²	59	45.3 Å²	45.3	28%	0.276	26%	0.263	S	S	.	.	H	α-helix	trans	-67.5	-33.6	172.9	-69.5	171.9	-24.1	0	0	112.5	V810 H811 S817 G818 L819 R820	V810-Q814 WeakPolarHBondContact O-CG 3.34Å; V810-Q814 PolarHBondContact O-N 3.33Å; H811-Q814 WeakPolarHBondContact O-CB 3.36Å; H811-Q814 PolarHBondContact O-N 3.15Å; H811-Q814 VanDerWaalsContact O-N 3.08Å; Q814-S817 WeakPolarHBondContact CA-OG 3.45Å; Q814-S817 PolarHBondContact O-OG 2.87Å; Q814-G818 PolarHBondContact O-N 3.45Å; Q814-L819 HydrophobicContact CB-CB 4.36Å; Q814-L819 PolarHBondContact O-N 3.35Å; Q814-R820 HydrophobicContact CB-CB 4.19Å; Q814-R820 HydrophobicContact CB-CG 4.25Å; Q814-R820 PolarHBondContact O-N 2.97Å
815	V	91.9	Very high	92.5	Very high	3 Å²	3	46.4 Å²	46.4	2%	0.018	27%	0.269	C	S	.	.	H	α-helix	trans	-67.5	-46.4	172.4	176.2	0	0	0	0	110.9	A780 L782 H811 M812 G813 S817 G818 R820	A780-V815 HydrophobicContact CB-CG1 4.33Å; L782-V815 HydrophobicContact CD1-CB 4.41Å; L782-V815 HydrophobicContact CD1-CG1 3.74Å; L782-V815 HydrophobicContact CD1-CG2 4.25Å; H811-V815 WeakPolarHBondContact O-CG2 3.46Å; H811-V815 PolarHBondContact O-N 3.31Å; M812-V815 PolarHBondContact O-N 3.04Å; G813-V815 VanDerWaalsContact C-N 3.35Å; V815-S817 PolarHBondContact O-N 2.84Å; V815-G818 PolarHBondContact O-N 2.91Å; V815-R820 WeakPolarHBondContact CA-O 3.44Å
816	Q	89.1	Confident	92.5	Very high	86 Å²	86	46.8 Å²	46.8	40%	0.402	27%	0.272	S	S	.	.	H	α-helix	trans	-61.5	-29.6	178.5	-74.8	-172	-3.4	0	0	113.3	W776 A780 M812 G813 G818	W776-Q816 HydrophobicContact CZ3-CG 4.04Å; A780-Q816 HydrophobicContact CB-CG 4.33Å; M812-Q816 PolarHBondContact O-N 2.94Å; G813-Q816 PolarHBondContact O-N 2.81Å; Q816-G818 VanDerWaalsContact C-N 3.34Å
817	S	89.1	Confident	92.6	Very high	75 Å²	75	48.2 Å²	48.2	52%	0.524	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-5.5	174.3	65	0	0	0	0	114.2	G813 Q814 V815 L819	G813-S817 PolarHBondContact O-N 3.16Å; G813-S817 VanDerWaalsContact O-N 3.1Å; G813-S817 PolarHBondContact O-OG 3.48Å; Q814-S817 WeakPolarHBondContact CA-OG 3.45Å; Q814-S817 PolarHBondContact O-OG 2.87Å; V815-S817 PolarHBondContact O-N 2.84Å; S817-L819 VanDerWaalsContact C-N 3.3Å; S817-L819 WeakPolarHBondContact OG-CD1 3.15Å; S817-L819 WeakPolarHBondContact OG-CG 3.34Å
818	G	89.9	Confident	92.7	Very high	65 Å²	65	45.4 Å²	45.4	67%	0.67	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.7	13.2	-177.3	0	0	0	0	0	114.5	Q814 V815 Q816	Q814-G818 PolarHBondContact O-N 3.45Å; V815-G818 PolarHBondContact O-N 2.91Å; Q816-G818 VanDerWaalsContact C-N 3.34Å
819	L	90.2	Very high	92.8	Very high	134 Å²	134	47.9 Å²	47.9	70%	0.702	28%	0.278	S	S	*	.	S	Bend	trans	-79.7	-23	178.1	-67.9	175	0	0	0	113.1	Q814 S817	Q814-L819 HydrophobicContact CB-CB 4.36Å; Q814-L819 PolarHBondContact O-N 3.35Å; S817-L819 VanDerWaalsContact C-N 3.3Å; S817-L819 WeakPolarHBondContact OG-CD1 3.15Å; S817-L819 WeakPolarHBondContact OG-CG 3.34Å
820	R	92.6	Very high	93.1	Very high	157 Å²	157	50.8 Å²	50.8	59%	0.592	29%	0.287	S	S	*	.			trans	-143.5	165.1	176.7	-70.1	-164.2	175.1	-174.8	-4.5	110.7	Q814 V815	Q814-R820 HydrophobicContact CB-CB 4.19Å; Q814-R820 HydrophobicContact CB-CG 4.25Å; Q814-R820 PolarHBondContact O-N 2.97Å; V815-R820 WeakPolarHBondContact CA-O 3.44Å
821	S	93.3	Very high	93.4	Very high	44 Å²	44	46.7 Å²	46.7	31%	0.308	26%	0.262	S	S	.	.			trans	-107.4	165.5	164.2	62.3	0	0	0	0	110.1	H811	H811-S821 PolarHBondContact NE2-O 3.25Å; H811-S821 VanDerWaalsContact NE2-O 3.08Å
822	G	94.4	Very high	93.6	Very high	4 Å²	4	48.4 Å²	48.4	4%	0.041	27%	0.268	C	S	.	.			trans	-66.7	170.7	167.7	0	0	0	0	0	112.5	L782 R824	L782-G822 WeakPolarHBondContact O-CA 3.12Å; L782-G822 PolarHBondContact O-N 2.98Å; G822-R824 PolarHBondContact O-N 2.76Å
823	I	95	Very high	93.8	Very high	60 Å²	60	48.2 Å²	48.2	31%	0.308	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	110.5	177.6	-55.7	173.2	0	0	0	108.3	P763 I765 V804 G805 T807 I825	P763-I823 HydrophobicContact CG-CG2 3.98Å; I765-I823 HydrophobicContact CG2-CD1 4.25Å; V804-I823 WeakPolarHBondContact CA-O 3.45Å; V804-I823 WeakPolarHBondContact CG1-O 3.43Å; G805-I823 PolarHBondContact N-O 2.96Å; G805-I823 PolarHBondContact O-N 2.85Å; T807-I823 HydrophobicContact CG2-CD1 3.62Å; I823-I825 PolarHBondContact O-N 3.37Å
824	R	95.9	Very high	94.1	Very high	34 Å²	34	48.8 Å²	48.8	13%	0.128	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	118.2	175.7	-58.6	173.6	-172.6	173.6	-5.3	109.8	W783 G784 E786 F791 G822	W783-R824 HydrophobicContact CD2-CG 4.06Å; W783-R824 HydrophobicContact CE3-CG 4.08Å; W783-R824 HydrophobicContact CH2-CB 4.02Å; W783-R824 HydrophobicContact CH2-CG 4.15Å; W783-R824 HydrophobicContact CZ2-CB 4.34Å; W783-R824 HydrophobicContact CZ2-CG 4.12Å; W783-R824 HydrophobicContact CZ3-CB 4.16Å; W783-R824 HydrophobicContact CZ3-CG 4.14Å; W783-R824 VanDerWaalsContact O-CZ 3.28Å; W783-R824 PolarHBondContact O-NE 3.32Å; W783-R824 PolarHBondContact O-NH2 3Å; G784-R824 PolarHBondContact O-NH2 3.14Å; E786-R824 VanDerWaalsContact O-CZ 3.27Å; E786-R824 PolarHBondContact O-NH1 3.02Å; E786-R824 PolarHBondContact O-NH2 3.44Å; F791-R824 HydrophobicContact CD2-CB 4.09Å; F791-R824 HydrophobicContact CE2-CB 3.76Å; G822-R824 PolarHBondContact O-N 2.76Å
825	I	96.6	Very high	94.1	Very high	23 Å²	23	46.1 Å²	46.1	12%	0.118	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	-53.3	-176.1	-67.1	168	0	0	0	110.5	L753 V760 L762 P763 I765 L768 V803 I823	L753-I825 HydrophobicContact CD2-CG2 3.98Å; V760-I825 HydrophobicContact CG1-CG2 3.59Å; L762-I825 HydrophobicContact CD2-CD1 4.05Å; L762-I825 HydrophobicContact CD2-CG2 4.33Å; P763-I825 HydrophobicContact CG-CD1 4.36Å; P763-I825 HydrophobicContact CG-CG1 4.3Å; I765-I825 HydrophobicContact CD1-CD1 4.33Å; L768-I825 HydrophobicContact CD1-CD1 3.65Å; V803-I825 HydrophobicContact CB-CB 4.35Å; V803-I825 HydrophobicContact CG1-CB 4.16Å; V803-I825 HydrophobicContact CG1-CG2 4.22Å; V803-I825 WeakPolarHBondContact O-CB 3.44Å; V803-I825 PolarHBondContact O-N 3.16Å; I823-I825 PolarHBondContact O-N 3.37Å
826	A	96.9	Very high	94.1	Very high	8 Å²	8	49.2 Å²	49.2	7%	0.066	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	166.6	-176.4	0	0	0	0	0	112	V755 V760 V803	V755-A826 HydrophobicContact CB-CB 4.31Å; V755-A826 HydrophobicContact CG1-CB 4.23Å; V755-A826 HydrophobicContact CG2-CB 3.88Å; V760-A826 HydrophobicContact CG1-CB 4.49Å; V803-A826 HydrophobicContact CB-CB 4.08Å; V803-A826 HydrophobicContact CG2-CB 4.02Å; V803-A826 PolarHBondContact N-O 2.9Å; V803-A826 PolarHBondContact O-N 3.35Å
827	Q	96.4	Very high	94.2	Very high	30 Å²	30	50.7 Å²	50.7	14%	0.14	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	139.1	159.8	-80.1	-178.5	-46.5	0	0	108.1	W783 F791 S792 L801 E802	W783-Q827 HydrophobicContact CH2-CG 3.67Å; W783-Q827 HydrophobicContact CZ2-CG 4.01Å; W783-Q827 HydrophobicContact CZ3-CG 4.44Å; F791-Q827 HydrophobicContact CD1-CB 4.44Å; F791-Q827 HydrophobicContact CD1-CG 4.28Å; S792-Q827 PolarHBondContact O-NE2 3.22Å; S792-Q827 VanDerWaalsContact O-NE2 3.15Å; S792-Q827 PolarHBondContact O-OE1 2.83Å; S792-Q827 PolarHBondContact OG-NE2 3.31Å; S792-Q827 PolarHBondContact OG-OE1 2.88Å; L801-Q827 VanDerWaalsContact O-CA 3.28Å; L801-Q827 WeakPolarHBondContact O-CA 3.45Å; E802-Q827 HydrophobicContact CG-CG 4.21Å; E802-Q827 PolarHBondContact OE1-NE2 3.38Å
828	G	95.6	Very high	94.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.5	169.7	177.3	0	0	0	0	0	115.4	D756 L801	D756-G828 WeakPolarHBondContact OD2-CA 3.32Å; L801-G828 PolarHBondContact N-O 2.84Å; L801-G828 PolarHBondContact O-N 2.79Å; L801-G828 VanDerWaalsContact O-N 3.15Å
829	S	94.9	Very high	94.5	Very high	58 Å²	58	50.4 Å²	50.4	41%	0.406	25%	0.249	S	C	.	.	S	Bend	trans	-102.1	-13.6	-173.6	67.4	0	0	0	0	114.4	W669 D756 G799	W669-S829 VanDerWaalsContact CZ3-O 3.31Å; W669-S829 WeakPolarHBondContact CZ3-O 3.37Å; D756-S829 PolarHBondContact OD1-N 3.45Å; D756-S829 PolarHBondContact OD1-OG 3.09Å; D756-S829 PolarHBondContact OD2-N 3.01Å; G799-S829 WeakPolarHBondContact O-CB 3.33Å
830	Y	96.1	Very high	94.7	Very high	82 Å²	82	45 Å²	45	32%	0.322	22%	0.221	S	C	.	.			trans	-138.9	120.1	177.9	-177.4	-89.6	0	0	0	109.5	V755 D756 R832 I856	V755-Y830 WeakPolarHBondContact CA-O 3.38Å; D756-Y830 PolarHBondContact N-O 2.65Å; D756-Y830 PolarHBondContact OD1-N 3.21Å; Y830-R832 HydrophobicContact CE1-CB 4.12Å; Y830-I856 HydrophobicContact CE2-CG2 3.66Å
831	I	97.4	Very high	94.9	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	132	178.6	-50.5	-62.2	0	0	0	108.6	L753 V755 F770 L801 V803 I856 I857	L753-I831 HydrophobicContact CD1-CG2 3.78Å; V755-I831 HydrophobicContact CB-CD1 4.22Å; V755-I831 HydrophobicContact CG1-CD1 3.85Å; V755-I831 HydrophobicContact CG2-CD1 3.74Å; F770-I831 HydrophobicContact CD1-CD1 4.31Å; F770-I831 HydrophobicContact CD1-CG1 4.02Å; F770-I831 HydrophobicContact CD1-CG2 4.23Å; F770-I831 HydrophobicContact CE1-CB 4.26Å; F770-I831 HydrophobicContact CE1-CD1 4.09Å; F770-I831 HydrophobicContact CE1-CG1 3.96Å; F770-I831 HydrophobicContact CE1-CG2 3.41Å; F770-I831 VanDerWaalsContact CE1-CG2 3.41Å; F770-I831 HydrophobicContact CZ-CG2 3.76Å; L801-I831 HydrophobicContact CD1-CG1 4.19Å; V803-I831 HydrophobicContact CG2-CD1 3.99Å; I831-I856 CarbonylContact O-C 3.58Å; I831-I856 WeakPolarHBondContact O-CA 3.39Å; I831-I857 HydrophobicContact CB-CB 3.91Å; I831-I857 HydrophobicContact CB-CD1 4.17Å; I831-I857 HydrophobicContact CB-CG1 4.09Å; I831-I857 HydrophobicContact CG1-CB 4.22Å; I831-I857 HydrophobicContact CG1-CD1 4.42Å; I831-I857 HydrophobicContact CG2-CD1 4.21Å; I831-I857 HydrophobicContact CG2-CG1 4.44Å; I831-I857 PolarHBondContact N-O 2.81Å; I831-I857 PolarHBondContact O-N 2.89Å
832	R	96.2	Very high	95	Very high	51 Å²	51	35.4 Å²	35.4	19%	0.192	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	126.3	165.6	-176.8	-179.7	-169	-169.1	-4.6	108.9	D677 Q754 Y830 H854	D677-R832 IonicContact OD1-CZ 3.73Å; D677-R832 IonicContact OD1-NH1 3.92Å; D677-R832 IonicContact OD1-NH2 2.7Å; D677-R832 PolarHBondContact OD1-NH2 3.1Å; D677-R832 IonicContact OD2-CZ 3.3Å; D677-R832 IonicContact OD2-NH1 2.74Å; D677-R832 IonicContact OD2-NH2 3.42Å; D677-R832 PolarHBondContact OD2-NH2 3.33Å; Q754-R832 HydrophobicContact CB-CB 4.22Å; Q754-R832 PolarHBondContact N-O 3.41Å; Q754-R832 PolarHBondContact O-N 3.25Å; Y830-R832 HydrophobicContact CE1-CB 4.12Å; R832-H854 PolarHBondContact NH2-CE1 2.88Å; R832-H854 PolarHBondContact NH2-ND1 2.82Å
833	L	95.5	Very high	95	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.01	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	134.2	179.1	-168.7	77.2	0	0	0	109.3	L702 L751 Q752 L753 L768 V835 H854 I855	L702-L833 HydrophobicContact CD1-CD2 4.21Å; L702-L833 HydrophobicContact CD2-CD2 3.39Å; L702-L833 HydrophobicContact CG-CD2 4.48Å; L751-L833 HydrophobicContact CB-CD1 4.21Å; L751-L833 HydrophobicContact CD1-CD1 4.35Å; L751-L833 HydrophobicContact CD2-CD1 4.35Å; L751-L833 HydrophobicContact CD2-CD2 4.02Å; L751-L833 HydrophobicContact CD2-CG 4.23Å; Q752-L833 WeakPolarHBondContact O-CA 3.34Å; L753-L833 HydrophobicContact CB-CD1 4.19Å; L753-L833 HydrophobicContact CD1-CD1 4.08Å; L768-L833 HydrophobicContact CD2-CD1 4.03Å; L833-V835 HydrophobicContact CD2-CG2 3.94Å; L833-V835 HydrophobicContact CG-CG2 4.3Å; L833-H854 WeakPolarHBondContact O-CA 3.35Å; L833-I855 HydrophobicContact CB-CB 4.23Å; L833-I855 HydrophobicContact CD2-CD1 4.4Å; L833-I855 PolarHBondContact N-O 2.79Å; L833-I855 PolarHBondContact O-N 3.03Å
834	I	95.2	Very high	94.9	Very high	50 Å²	50	33.9 Å²	33.9	26%	0.256	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	121.3	170.6	-54.9	176.9	0	0	0	107.5	L751 Q752	L751-I834 WeakPolarHBondContact CA-O 3.48Å; Q752-I834 HydrophobicContact CB-CB 4.13Å; Q752-I834 PolarHBondContact N-O 3.15Å; Q752-I834 PolarHBondContact O-N 3.26Å
835	V	93.8	Very high	94.6	Very high	3 Å²	3	33.8 Å²	33.8	2%	0.018	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	116	-179.5	178.5	0	0	0	0	108.5	L751 L833 K837 L839 P852 G853 I855	L751-V835 HydrophobicContact CD2-CB 4.35Å; L751-V835 HydrophobicContact CD2-CG1 4.45Å; L751-V835 HydrophobicContact CD2-CG2 3.83Å; L833-V835 HydrophobicContact CD2-CG2 3.94Å; L833-V835 HydrophobicContact CG-CG2 4.3Å; V835-K837 WeakPolarHBondContact CG1-O 3.37Å; V835-L839 HydrophobicContact CG1-CD2 3.54Å; V835-L839 HydrophobicContact CG1-CG 3.94Å; V835-P852 CarbonylContact O-C 3.56Å; V835-P852 VanDerWaalsContact O-CA 3.26Å; V835-P852 WeakPolarHBondContact O-CA 3.44Å; V835-P852 WeakPolarHBondContact O-CB 3.17Å; V835-G853 PolarHBondContact N-O 2.93Å; V835-G853 PolarHBondContact O-N 3.21Å; V835-I855 HydrophobicContact CG2-CD1 3.8Å; V835-I855 HydrophobicContact CG2-CG1 4.19Å
836	S	92.1	Very high	94.3	Very high	68 Å²	68	37.2 Å²	37.2	48%	0.476	20%	0.195	S	C	.	.			trans	-88.9	-16.1	-173.2	-49.7	0	0	0	0	113.9	E750	E750-S836 WeakPolarHBondContact O-CB 3.39Å; E750-S836 PolarHBondContact O-N 3.33Å; E750-S836 PolarHBondContact O-OG 3.02Å; E750-S836 VanDerWaalsContact O-OG 3.08Å
837	K	91.3	Very high	94.2	Very high	117 Å²	117	37.5 Å²	37.5	51%	0.509	20%	0.197	S	C	.	.	S	Bend	trans	-142.8	153.5	-179	-70	-168.5	-163	155.9	0	110.7	E750 V835 L839	E750-K837 WeakPolarHBondContact OE1-CD 3.5Å; E750-K837 IonicContact OE1-NZ 3.56Å; E750-K837 PolarHBondContact OE1-NZ 3.07Å; V835-K837 WeakPolarHBondContact CG1-O 3.37Å; K837-L839 PolarHBondContact O-N 2.9Å
838	E	91.4	Very high	94	Very high	126 Å²	126	38.2 Å²	38.2	59%	0.589	20%	0.198	S	C	*	.			trans	-57.2	130.7	172.5	-175	-177.1	18.2	0	0	110.5	L849 Q850	E838-L849 HydrophobicContact CG-CB 4.37Å; E838-Q850 VanDerWaalsContact CA-O 3.24Å; E838-Q850 WeakPolarHBondContact CA-O 3Å
839	L	93.4	Very high	93.9	Very high	8 Å²	8	42.8 Å²	42.8	4%	0.042	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	155.5	-178.7	65.2	85.6	0	0	0	112.1	L702 L747 L751 V835 K837 V841 Q850	L702-L839 HydrophobicContact CB-CD1 3.94Å; L702-L839 HydrophobicContact CD2-CD1 4Å; L702-L839 HydrophobicContact CG-CD1 4.43Å; L747-L839 HydrophobicContact CD1-CD2 3.89Å; L751-L839 HydrophobicContact CD2-CD2 3.99Å; V835-L839 HydrophobicContact CG1-CD2 3.54Å; V835-L839 HydrophobicContact CG1-CG 3.94Å; K837-L839 PolarHBondContact O-N 2.9Å; L839-V841 HydrophobicContact CD1-CG1 3.53Å; L839-Q850 PolarHBondContact N-O 3.47Å; L839-Q850 PolarHBondContact O-N 3.04Å
840	P	95.1	Very high	93.8	Very high	19 Å²	19	40.4 Å²	40.4	12%	0.123	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	136.2	176.4	27.2	-32.5	0	0	0	111.3	G703 A706 E707 L710 W848 L849	G703-P840 PolarHBondContact N-O 2.73Å; A706-P840 VanDerWaalsContact CB-C 3.42Å; A706-P840 HydrophobicContact CB-CB 4.11Å; A706-P840 WeakPolarHBondContact CB-O 3.25Å; E707-P840 HydrophobicContact CB-CB 4.24Å; E707-P840 HydrophobicContact CB-CG 3.73Å; E707-P840 HydrophobicContact CG-CG 4.27Å; L710-P840 HydrophobicContact CD2-CB 4.39Å; P840-W848 WeakPolarHBondContact CA-O 3.5Å; P840-L849 HydrophobicContact CB-CD2 4.16Å
841	V	95.9	Very high	93.5	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	158.4	172.8	-56	0	0	0	0	110.7	F700 G701 L702 L839 P847 W848 Q850	F700-V841 HydrophobicContact CE2-CB 3.83Å; F700-V841 HydrophobicContact CE2-CG1 4.38Å; F700-V841 HydrophobicContact CE2-CG2 4.34Å; F700-V841 HydrophobicContact CZ-CB 4.27Å; F700-V841 HydrophobicContact CZ-CG1 4.32Å; G701-V841 CarbonylContact O-C 3.57Å; G701-V841 VanDerWaalsContact O-CA 3.28Å; G701-V841 WeakPolarHBondContact O-CA 3.33Å; L702-V841 HydrophobicContact CB-CG1 4.35Å; L702-V841 HydrophobicContact CD2-CG1 3.82Å; L702-V841 HydrophobicContact CG-CG1 3.88Å; L839-V841 HydrophobicContact CD1-CG1 3.53Å; V841-P847 CarbonylContact O-C 3.49Å; V841-P847 VanDerWaalsContact O-CA 3.26Å; V841-P847 WeakPolarHBondContact O-CA 3.39Å; V841-W848 HydrophobicContact CG2-CD2 3.59Å; V841-W848 HydrophobicContact CG2-CE3 4.12Å; V841-W848 HydrophobicContact CG2-CG 4.11Å; V841-W848 HydrophobicContact CG2-CH2 3.89Å; V841-W848 HydrophobicContact CG2-CZ2 3.29Å; V841-W848 HydrophobicContact CG2-CZ3 4.26Å; V841-W848 PolarHBondContact N-O 3.34Å; V841-W848 PolarHBondContact O-N 2.76Å; V841-W848 VanDerWaalsContact O-O 3.13Å; V841-Q850 HydrophobicContact CB-CB 4.42Å; V841-Q850 HydrophobicContact CG1-CB 3.74Å; V841-Q850 HydrophobicContact CG1-CG 4.48Å; V841-Q850 HydrophobicContact CG2-CB 3.76Å
842	Q	95.2	Very high	93.2	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	142.1	174.3	68.9	79.1	20.7	0	0	111.4	Y699 F700 G701 D705 A706 E846 P847	Y699-Q842 VanDerWaalsContact CD2-NE2 3.28Å; Y699-Q842 VanDerWaalsContact CE2-NE2 3.28Å; F700-Q842 WeakPolarHBondContact CA-O 3.36Å; F700-Q842 WeakPolarHBondContact CD2-O 3.14Å; G701-Q842 PolarHBondContact N-O 3.42Å; G701-Q842 PolarHBondContact O-N 2.93Å; D705-Q842 PolarHBondContact OD2-NE2 3.1Å; A706-Q842 HydrophobicContact CB-CB 4.1Å; A706-Q842 HydrophobicContact CB-CG 3.92Å; Q842-E846 WeakPolarHBondContact CA-O 3.48Å; Q842-P847 HydrophobicContact CB-CB 3.96Å
843	V	94.9	Very high	93	Very high	6 Å²	6	40.7 Å²	40.7	4%	0.036	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	124.8	171.9	177.1	0	0	0	0	108.8	I671 V694 M696 F700 G845 E846 W848	I671-V843 HydrophobicContact CD1-CG1 4.29Å; I671-V843 HydrophobicContact CD1-CG2 3.54Å; V694-V843 HydrophobicContact CG1-CB 4.01Å; V694-V843 HydrophobicContact CG1-CG1 3.88Å; V694-V843 HydrophobicContact CG1-CG2 3.99Å; M696-V843 HydrophobicContact CB-CG1 3.78Å; M696-V843 HydrophobicContact CG-CG1 4.02Å; F700-V843 HydrophobicContact CB-CG2 4.37Å; F700-V843 HydrophobicContact CD2-CG2 3.36Å; F700-V843 HydrophobicContact CE2-CG2 3.95Å; F700-V843 HydrophobicContact CG-CG2 4.21Å; V843-G845 PolarHBondContact O-N 2.93Å; V843-E846 PolarHBondContact N-O 3.44Å; V843-E846 PolarHBondContact O-N 2.96Å; V843-W848 HydrophobicContact CB-CH2 4.3Å; V843-W848 HydrophobicContact CB-CZ3 4.25Å; V843-W848 HydrophobicContact CG2-CH2 3.59Å; V843-W848 HydrophobicContact CG2-CZ3 4.01Å
844	D	93.4	Very high	92.8	Very high	27 Å²	27	42.6 Å²	42.6	14%	0.144	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	29.2	178.5	-67	-10.1	0	0	0	114.1	N697 N698 Y699	N697-D844 WeakPolarHBondContact CB-OD2 3.36Å; N697-D844 PolarHBondContact N-OD1 3.5Å; N697-D844 PolarHBondContact N-OD2 2.79Å; N697-D844 PolarHBondContact ND2-OD2 3.47Å; N698-D844 WeakPolarHBondContact CA-OD1 3.41Å; N698-D844 WeakPolarHBondContact CB-OD1 3.47Å; N698-D844 PolarHBondContact N-OD1 3.29Å; Y699-D844 PolarHBondContact N-OD1 3.38Å; Y699-D844 PolarHBondContact O-N 2.72Å
845	G	88.6	Confident	92.8	Very high	32 Å²	32	40.3 Å²	40.3	33%	0.33	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.3	2.2	-179	0	0	0	0	0	116.1	V843 P847	V843-G845 PolarHBondContact O-N 2.93Å; G845-P847 WeakPolarHBondContact O-CD 3.08Å
846	E	91.2	Very high	92.9	Very high	95 Å²	95	41.5 Å²	41.5	44%	0.444	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	110.1	171.9	-62.3	-58.7	151.5	0	0	110.1	H713 Q842 V843 W848	H713-E846 IonicContact CE1-OE2 3.19Å; H713-E846 IonicContact ND1-OE2 2.86Å; Q842-E846 WeakPolarHBondContact CA-O 3.48Å; V843-E846 PolarHBondContact N-O 3.44Å; V843-E846 PolarHBondContact O-N 2.96Å; E846-W848 VanDerWaalsContact O-CZ3 3.32Å; E846-W848 WeakPolarHBondContact O-CZ3 3.48Å
847	P	94	Very high	93.1	Very high	14 Å²	14	38.3 Å²	38.3	9%	0.091	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	154.2	-172.2	38.3	-34.1	0	0	0	114.1	L710 H713 V841 Q842 G845	L710-P847 HydrophobicContact CB-CB 3.92Å; L710-P847 HydrophobicContact CB-CG 4.23Å; L710-P847 HydrophobicContact CD1-CB 4.12Å; L710-P847 HydrophobicContact CD1-CG 4.06Å; H713-P847 HydrophobicContact CB-CG 3.5Å; H713-P847 VanDerWaalsContact CB-CG 3.5Å; V841-P847 CarbonylContact O-C 3.49Å; V841-P847 VanDerWaalsContact O-CA 3.26Å; V841-P847 WeakPolarHBondContact O-CA 3.39Å; Q842-P847 HydrophobicContact CB-CB 3.96Å; G845-P847 WeakPolarHBondContact O-CD 3.08Å
848	W	93.7	Very high	93.2	Very high	45 Å²	45	34.3 Å²	34.3	17%	0.17	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	171.7	169	67.8	101.6	0	0	0	111.5	L673 V694 P840 V841 V843 E846	L673-W848 HydrophobicContact CD1-CH2 4.32Å; L673-W848 HydrophobicContact CD1-CZ2 3.47Å; L673-W848 VanDerWaalsContact CD1-CZ2 3.47Å; L673-W848 HydrophobicContact CD2-CZ2 4.31Å; V694-W848 HydrophobicContact CG2-CH2 4.33Å; P840-W848 WeakPolarHBondContact CA-O 3.5Å; V841-W848 HydrophobicContact CG2-CD2 3.59Å; V841-W848 HydrophobicContact CG2-CE3 4.12Å; V841-W848 HydrophobicContact CG2-CG 4.11Å; V841-W848 HydrophobicContact CG2-CH2 3.89Å; V841-W848 HydrophobicContact CG2-CZ2 3.29Å; V841-W848 HydrophobicContact CG2-CZ3 4.26Å; V841-W848 PolarHBondContact N-O 3.34Å; V841-W848 PolarHBondContact O-N 2.76Å; V841-W848 VanDerWaalsContact O-O 3.13Å; V843-W848 HydrophobicContact CB-CH2 4.3Å; V843-W848 HydrophobicContact CB-CZ3 4.25Å; V843-W848 HydrophobicContact CG2-CH2 3.59Å; V843-W848 HydrophobicContact CG2-CZ3 4.01Å; E846-W848 VanDerWaalsContact O-CZ3 3.32Å; E846-W848 WeakPolarHBondContact O-CZ3 3.48Å
849	L	92.6	Very high	93.1	Very high	95 Å²	95	31.4 Å²	31.4	50%	0.497	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	122	168.5	-69.1	173.7	0	0	0	109.7	L710 E838 P840	L710-L849 HydrophobicContact CD2-CD2 4.08Å; L710-L849 HydrophobicContact CD2-CG 4.15Å; E838-L849 HydrophobicContact CG-CB 4.37Å; P840-L849 HydrophobicContact CB-CD2 4.16Å
850	Q	92.1	Very high	92.3	Very high	8 Å²	8	32.1 Å²	32.1	4%	0.037	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	130.1	178.6	-177.8	55.7	49.2	0	0	110.1	L673 D674 E838 L839 V841 I855	L673-Q850 HydrophobicContact CD2-CG 4.45Å; D674-Q850 PolarHBondContact OD1-NE2 3.15Å; D674-Q850 VanDerWaalsContact OD1-NE2 3.12Å; D674-Q850 PolarHBondContact OD2-NE2 3.32Å; D674-Q850 VanDerWaalsContact OD2-NE2 3.09Å; E838-Q850 VanDerWaalsContact CA-O 3.24Å; E838-Q850 WeakPolarHBondContact CA-O 3Å; L839-Q850 PolarHBondContact N-O 3.47Å; L839-Q850 PolarHBondContact O-N 3.04Å; V841-Q850 HydrophobicContact CB-CB 4.42Å; V841-Q850 HydrophobicContact CG1-CB 3.74Å; V841-Q850 HydrophobicContact CG1-CG 4.48Å; V841-Q850 HydrophobicContact CG2-CB 3.76Å; Q850-I855 HydrophobicContact CG-CD1 4.19Å
851	A	90.6	Very high	91.3	Very high	47 Å²	47	33.5 Å²	33.5	39%	0.388	22%	0.22	S	C	.	.	P	Polyproline II helix	trans	-67.3	160.4	174.6	0	0	0	0	0	111.7	G853	A851-G853 PolarHBondContact O-N 3.5Å
852	P	91.3	Very high	90.7	Very high	72 Å²	72	36.4 Å²	36.4	47%	0.468	24%	0.239	S	C	.	.	S	Bend	trans	-56.7	138	170.8	-18.8	29.9	0	0	0	111.3	V835	V835-P852 CarbonylContact O-C 3.56Å; V835-P852 VanDerWaalsContact O-CA 3.26Å; V835-P852 WeakPolarHBondContact O-CA 3.44Å; V835-P852 WeakPolarHBondContact O-CB 3.17Å
853	G	91.3	Very high	90.5	Very high	20 Å²	20	39.5 Å²	39.5	21%	0.206	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.7	-167.9	-175.8	0	0	0	0	0	113.6	V835 A851	V835-G853 PolarHBondContact N-O 2.93Å; V835-G853 PolarHBondContact O-N 3.21Å; A851-G853 PolarHBondContact O-N 3.5Å
854	H	92.5	Very high	90.5	Very high	43 Å²	43	40.2 Å²	40.2	20%	0.199	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	136.5	177.1	-65.5	-89.9	0	0	0	111	D674 A675 R832 L833	D674-H854 WeakPolarHBondContact CA-O 3.42Å; D674-H854 PolarHBondContact N-O 3.32Å; A675-H854 HydrophobicContact CB-CB 4.31Å; A675-H854 PolarHBondContact N-O 3.42Å; A675-H854 WeakPolarHBondContact O-CB 3.49Å; A675-H854 PolarHBondContact O-CD2 2.97Å; R832-H854 PolarHBondContact NH2-CE1 2.88Å; R832-H854 PolarHBondContact NH2-ND1 2.82Å; L833-H854 WeakPolarHBondContact O-CA 3.35Å
855	I	95	Very high	90.7	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.01	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	126.6	171.4	-52.4	-176.9	0	0	0	108.2	I671 L672 L673 F700 L702 L833 V835 Q850 I857	I671-I855 HydrophobicContact CG2-CG2 3.67Å; L672-I855 WeakPolarHBondContact O-CA 3.46Å; L673-I855 HydrophobicContact CD2-CB 4.43Å; L673-I855 HydrophobicContact CD2-CD1 3.77Å; L673-I855 HydrophobicContact CD2-CG1 3.84Å; L673-I855 HydrophobicContact CD2-CG2 3.92Å; F700-I855 HydrophobicContact CE1-CG2 4.12Å; F700-I855 HydrophobicContact CZ-CD1 4.09Å; F700-I855 HydrophobicContact CZ-CG2 4.33Å; L702-I855 HydrophobicContact CD2-CD1 4.19Å; L833-I855 HydrophobicContact CB-CB 4.23Å; L833-I855 HydrophobicContact CD2-CD1 4.4Å; L833-I855 PolarHBondContact N-O 2.79Å; L833-I855 PolarHBondContact O-N 3.03Å; V835-I855 HydrophobicContact CG2-CD1 3.8Å; V835-I855 HydrophobicContact CG2-CG1 4.19Å; Q850-I855 HydrophobicContact CG-CD1 4.19Å; I855-I857 HydrophobicContact CG2-CG1 4.4Å
856	I	95.5	Very high	91.2	Very high	27 Å²	27	41.2 Å²	41.2	14%	0.138	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	130.3	176.2	-59.9	174.5	0	0	0	108.6	I671 L672 A675 Y830 I831	I671-I856 CarbonylContact C-O 3.56Å; I671-I856 WeakPolarHBondContact CA-O 2.9Å; L672-I856 HydrophobicContact CB-CB 4.32Å; L672-I856 PolarHBondContact N-O 3.42Å; L672-I856 PolarHBondContact O-N 3.36Å; A675-I856 HydrophobicContact CB-CD1 3.59Å; A675-I856 HydrophobicContact CB-CG1 4.03Å; Y830-I856 HydrophobicContact CE2-CG2 3.66Å; I831-I856 CarbonylContact O-C 3.58Å; I831-I856 WeakPolarHBondContact O-CA 3.39Å
857	I	95.9	Very high	91.5	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.01	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	126.5	174.4	-40.2	175.9	0	0	0	108.5	W669 T670 I671 F700 F770 L801 I831 I855	W669-I857 HydrophobicContact CB-CG2 4.16Å; W669-I857 HydrophobicContact CE3-CG2 4.14Å; T670-I857 WeakPolarHBondContact O-CA 2.94Å; I671-I857 HydrophobicContact CG1-CG1 4.22Å; I671-I857 HydrophobicContact CG1-CG2 3.98Å; I671-I857 HydrophobicContact CG2-CG1 4.47Å; F700-I857 HydrophobicContact CD1-CD1 3.58Å; F700-I857 HydrophobicContact CE1-CD1 4.04Å; F770-I857 HydrophobicContact CB-CD1 4.38Å; F770-I857 HydrophobicContact CD1-CD1 4.07Å; F770-I857 HydrophobicContact CD2-CD1 3.92Å; F770-I857 HydrophobicContact CE1-CD1 4.37Å; F770-I857 HydrophobicContact CE2-CD1 4.19Å; F770-I857 HydrophobicContact CG-CD1 3.85Å; F770-I857 HydrophobicContact CZ-CD1 4.41Å; L801-I857 HydrophobicContact CD1-CB 4.3Å; L801-I857 HydrophobicContact CD1-CG2 3.56Å; I831-I857 HydrophobicContact CB-CB 3.91Å; I831-I857 HydrophobicContact CB-CD1 4.17Å; I831-I857 HydrophobicContact CB-CG1 4.09Å; I831-I857 HydrophobicContact CG1-CB 4.22Å; I831-I857 HydrophobicContact CG1-CD1 4.42Å; I831-I857 HydrophobicContact CG2-CD1 4.21Å; I831-I857 HydrophobicContact CG2-CG1 4.44Å; I831-I857 PolarHBondContact N-O 2.81Å; I831-I857 PolarHBondContact O-N 2.89Å; I855-I857 HydrophobicContact CG2-CG1 4.4Å
858	S	94.5	Very high	91.7	Very high	32 Å²	32	39.8 Å²	39.8	22%	0.224	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	166.9	179.8	62.2	0	0	0	0	110.9	W669 T670 A860	W669-S858 CarbonylContact C-O 3.56Å; W669-S858 WeakPolarHBondContact CA-O 3.3Å; W669-S858 VanDerWaalsContact CE3-C 3.41Å; T670-S858 PolarHBondContact N-O 2.82Å; T670-S858 PolarHBondContact O-N 2.98Å; S858-A860 PolarHBondContact O-N 2.92Å
859	A	89.5	Confident	91.7	Very high	66 Å²	66	40.4 Å²	40.4	55%	0.545	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	133.7	179.5	0	0	0	0	0	111.8	G861	A859-G861 VanDerWaalsContact C-N 3.32Å; A859-G861 PolarHBondContact O-N 2.81Å
860	A	76.3	Confident	91.7	Very high	22 Å²	22	37.4 Å²	37.4	18%	0.182	23%	0.228	C	C	.	.			trans	-77.7	-11.6	-175.2	0	0	0	0	0	114.9	R668 T670 S858	R668-A860 HydrophobicContact CB-CB 4.09Å; R668-A860 WeakPolarHBondContact O-CB 3.28Å; R668-A860 PolarHBondContact O-N 2.65Å; T670-A860 VanDerWaalsContact OG1-CA 3.22Å; T670-A860 WeakPolarHBondContact OG1-CA 3.45Å; T670-A860 WeakPolarHBondContact OG1-CB 3.48Å; S858-A860 PolarHBondContact O-N 2.92Å
861	G	74.3	Confident	91.1	Very high	49 Å²	49	44.6 Å²	44.6	51%	0.505	26%	0.259	S	S	.	.	S	Bend	trans	139.7	-147.9	-172.7	0	0	0	0	0	112.1	A859	A859-G861 VanDerWaalsContact C-N 3.32Å; A859-G861 PolarHBondContact O-N 2.81Å
862	P	82.7	Confident	89.6	Confident	61 Å²	61	48.2 Å²	48.2	40%	0.396	27%	0.271	S	S	.	.	S	Bend	trans	-69.1	147.5	-179.7	30.7	-34.5	0	0	0	111.3
863	K	91.6	Very high	87.4	Confident	65 Å²	65	53.9 Å²	53.9	28%	0.283	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-59.1	146.3	173.5	-53.3	-170	-172.4	-165.4	0	110.4	Q665 M666 D667 D797	Q665-K863 HydrophobicContact CB-CB 4.09Å; Q665-K863 HydrophobicContact CB-CD 4Å; Q665-K863 HydrophobicContact CG-CB 4.42Å; M666-K863 CarbonylContact O-C 3.58Å; M666-K863 VanDerWaalsContact O-CA 3.31Å; M666-K863 WeakPolarHBondContact O-CA 3.46Å; M666-K863 WeakPolarHBondContact O-CB 3.29Å; D667-K863 WeakPolarHBondContact OD1-CD 3.36Å; D667-K863 WeakPolarHBondContact OD1-CE 3.39Å; D667-K863 VanDerWaalsContact OD1-CG 3.26Å; D667-K863 WeakPolarHBondContact OD1-CG 3.48Å; D667-K863 IonicContact OD1-NZ 3.25Å; D667-K863 PolarHBondContact OD1-NZ 2.91Å; D797-K863 VanDerWaalsContact C-NZ 3.34Å; D797-K863 PolarHBondContact O-NZ 2.9Å
864	V	94.5	Very high	84.7	Confident	21 Å²	21	61.1 Å²	61.1	13%	0.127	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	147	175.4	-63.2	0	0	0	0	110.7	L608 Q665 M666 R668 M866	L608-V864 HydrophobicContact CD2-CB 4.16Å; L608-V864 HydrophobicContact CD2-CG1 4.08Å; L608-V864 HydrophobicContact CD2-CG2 4.09Å; Q665-V864 CarbonylContact C-O 3.54Å; Q665-V864 WeakPolarHBondContact CA-O 3.46Å; M666-V864 HydrophobicContact CB-CG2 3.95Å; M666-V864 HydrophobicContact CE-CG2 3.81Å; M666-V864 HydrophobicContact CG-CG2 4.11Å; M666-V864 PolarHBondContact N-O 3.13Å; M666-V864 PolarHBondContact O-N 3.21Å; M666-V864 HydrophobicContact SD-CG2 4.33Å; R668-V864 VanDerWaalsContact CD-CG1 3.42Å; R668-V864 HydrophobicContact CG-CG1 4.3Å; R668-V864 HydrophobicContact CG-CG2 4.15Å; V864-M866 HydrophobicContact CG2-CG 4.24Å; V864-M866 HydrophobicContact CG2-SD 3.96Å
865	R	97.2	Very high	82	Confident	80 Å²	80	70.3 Å²	70.3	30%	0.302	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	122.9	174.1	-68.2	-164.1	-67.9	172.1	-13.3	110	E622 P624 I625 E663 V664	E622-R865 PolarHBondContact O-NE 3.04Å; E622-R865 PolarHBondContact O-NH2 3.46Å; P624-R865 WeakPolarHBondContact CA-O 3.29Å; P624-R865 HydrophobicContact CB-CB 4.24Å; P624-R865 HydrophobicContact CG-CB 4.26Å; I625-R865 PolarHBondContact N-O 2.72Å; E663-R865 IonicContact OE2-CZ 3.44Å; E663-R865 IonicContact OE2-NH1 2.77Å; E663-R865 PolarHBondContact OE2-NH1 3.4Å; V664-R865 WeakPolarHBondContact O-CA 3.28Å
866	M	97.9	Very high	78.9	Confident	0 Å²	0	79.3 Å²	79.3	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	149.9	177.6	-56.7	-58.6	-69.7	0	0	110	V604 L608 I625 I627 L636 L640 E663 V664 M666 V864	V604-M866 HydrophobicContact CG1-CE 4.48Å; L608-M866 HydrophobicContact CD2-SD 4.5Å; I625-M866 HydrophobicContact CB-CE 4.24Å; I625-M866 HydrophobicContact CB-SD 4.05Å; I625-M866 HydrophobicContact CG2-CE 4.48Å; I625-M866 CarbonylContact O-C 2.98Å; I625-M866 WeakPolarHBondContact O-CA 3.37Å; I627-M866 HydrophobicContact CD1-CE 4.06Å; I627-M866 HydrophobicContact CG1-CE 4.46Å; L636-M866 HydrophobicContact CD2-CE 4.04Å; L640-M866 HydrophobicContact CD1-CB 3.86Å; L640-M866 HydrophobicContact CD1-CE 3.64Å; L640-M866 HydrophobicContact CD1-CG 4.3Å; L640-M866 HydrophobicContact CD2-CB 3.84Å; E663-M866 WeakPolarHBondContact CA-O 3.24Å; V664-M866 HydrophobicContact CG2-CB 4.02Å; V664-M866 PolarHBondContact N-O 3.44Å; V664-M866 PolarHBondContact O-N 2.99Å; M666-M866 HydrophobicContact CB-CG 3.83Å; M666-M866 HydrophobicContact SD-CG 3.97Å; M666-M866 HydrophobicContact SD-SD 4.37Å; V864-M866 HydrophobicContact CG2-CG 4.24Å; V864-M866 HydrophobicContact CG2-SD 3.96Å
867	L	98.3	Very high	75.7	Confident	0 Å²	0	82.8 Å²	82.8	0%	0	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	122.1	171	-63.8	176.3	0	0	0	108.7	R594 P624 I625 W642 V658 A661 D662 E663	R594-L867 HydrophobicContact CB-CD1 4.42Å; P624-L867 HydrophobicContact CB-CD2 3.59Å; P624-L867 HydrophobicContact CB-CG 3.87Å; I625-L867 PolarHBondContact O-N 2.78Å; W642-L867 HydrophobicContact CZ2-CB 4.27Å; W642-L867 PolarHBondContact NE1-O 3.48Å; V658-L867 HydrophobicContact CG1-CD1 3.98Å; A661-L867 HydrophobicContact CB-CB 3.96Å; A661-L867 HydrophobicContact CB-CD2 4.25Å; D662-L867 CarbonylContact O-C 3.51Å; D662-L867 WeakPolarHBondContact O-CA 3.16Å; E663-L867 HydrophobicContact CG-CD2 3.89Å
868	R	97.4	Very high	72.5	Confident	78 Å²	78	88.6 Å²	88.6	29%	0.294	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	127.6	173.6	-176.6	177.5	68.5	-165.7	-4.4	109	L640 R641 D662 V664 S870	L640-R868 HydrophobicContact CD2-CB 4.2Å; L640-R868 WeakPolarHBondContact O-CA 3.48Å; L640-R868 WeakPolarHBondContact O-CG 3.48Å; R641-R868 HydrophobicContact CG-CG 4.33Å; D662-R868 PolarHBondContact N-O 2.97Å; D662-R868 PolarHBondContact O-N 2.76Å; D662-R868 IonicContact OD2-NH2 2.89Å; V664-R868 HydrophobicContact CG1-CB 3.91Å; V664-R868 HydrophobicContact CG2-CB 4.04Å; R868-S870 PolarHBondContact O-N 2.86Å
869	K	95.4	Very high	69.4	Low	59 Å²	59	92.1 Å²	92.1	26%	0.257	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-61.1	124	178.8	-169.7	176.2	-177.7	176.7	0	110.3	L640 R641 W642	L640-K869 PolarHBondContact O-N 2.91Å; R641-K869 HydrophobicContact CB-CB 4.16Å; R641-K869 WeakPolarHBondContact O-CB 3.46Å; R641-K869 WeakPolarHBondContact O-CD 3.49Å; W642-K869 HydrophobicContact CD2-CB 4.07Å; W642-K869 HydrophobicContact CE3-CB 4.21Å; W642-K869 HydrophobicContact CE3-CD 4.09Å; W642-K869 HydrophobicContact CE3-CG 4.43Å; W642-K869 HydrophobicContact CH2-CB 4.39Å; W642-K869 HydrophobicContact CZ2-CB 4.27Å; W642-K869 HydrophobicContact CZ3-CB 4.37Å; W642-K869 HydrophobicContact CZ3-CD 4.26Å; W642-K869 HydrophobicContact CZ3-CG 4.33Å
870	S	92.1	Very high	66.8	Low	31 Å²	31	94.3 Å²	94.3	22%	0.217	49%	0.49	C	S	.	.	P	Polyproline II helix	trans	-62.6	140.5	-179.7	-67.4	0	0	0	0	111.1	E660 R868 L872	E660-S870 WeakPolarHBondContact O-CB 3.5Å; E660-S870 PolarHBondContact O-OG 2.84Å; R868-S870 PolarHBondContact O-N 2.86Å; S870-L872 PolarHBondContact O-N 2.83Å; S870-L872 VanDerWaalsContact O-N 3.11Å
871	K	79.4	Confident	64.6	Low	160 Å²	160	98.4 Å²	98.4	70%	0.696	52%	0.517	S	S	*	.			trans	-70.1	107	166.9	-76.8	179	177.7	-176.7	0	105.9	K873	K871-K873 PolarHBondContact O-N 3.01Å
872	L	59.1	Low	62.5	Low	122 Å²	122	103.3 Å²	103.3	64%	0.639	53%	0.531	S	S	*	.			trans	-50.8	113.1	168.3	-105.4	104.4	0	0	0	107.4	S870 Q874	S870-L872 PolarHBondContact O-N 2.83Å; S870-L872 VanDerWaalsContact O-N 3.11Å; L872-Q874 VanDerWaalsContact C-N 3.3Å; L872-Q874 PolarHBondContact O-N 3.15Å
873	K	44.1	Very low	60	Low	191 Å²	191	104.3 Å²	104.3	83%	0.83	55%	0.553	S	S	*	*			trans	-57.6	109.1	150.2	-86.1	-179.2	176.7	176.1	0	103	K871 R875	K871-K873 PolarHBondContact O-N 3.01Å; K873-R875 PolarHBondContact O-N 3.07Å
874	Q	35	Very low	57	Low	173 Å²	173	112 Å²	112	81%	0.808	58%	0.58	S	S	*	*			trans	-53.8	98.4	163.9	-77.3	-176.8	-12.5	0	0	105.9	L872 K876	L872-Q874 VanDerWaalsContact C-N 3.3Å; L872-Q874 PolarHBondContact O-N 3.15Å; Q874-K876 PolarHBondContact O-N 3.13Å
875	R	37.1	Very low	54.1	Low	236 Å²	236	116.3 Å²	116.3	89%	0.891	61%	0.611	S	S	*	*			trans	-62.2	100.7	157	-85.3	175.1	81.7	168.1	3.5	102.4	K873 S877	K873-R875 PolarHBondContact O-N 3.07Å; R875-S877 VanDerWaalsContact C-N 3.3Å; R875-S877 PolarHBondContact O-N 3.1Å
876	K	29.6	Very low	50.7	Low	191 Å²	191	120 Å²	120	83%	0.83	64%	0.637	S	S	*	*			trans	-47.2	106.9	162.2	-76.5	-177.9	175.1	-178.6	0	105	Q874	Q874-K876 PolarHBondContact O-N 3.13Å
877	S	27.5	Very low	47.3	Very low	99 Å²	99	125.2 Å²	125.2	69%	0.692	67%	0.673	S	S	*	*			trans	-54.8	137	157.2	38.3	0	0	0	0	105.8	R875 S879	R875-S877 VanDerWaalsContact C-N 3.3Å; R875-S877 PolarHBondContact O-N 3.1Å; S877-S879 PolarHBondContact O-N 3.46Å
878	P	29.5	Very low	44	Very low	125 Å²	125	131.6 Å²	131.6	81%	0.812	72%	0.715	S	S	*	*			trans	-61	112.8	169.9	26.3	-28.7	0	0	0	105.7	S880	P878-S880 PolarHBondContact O-N 2.85Å
879	S	29.3	Very low	40.8	Very low	105 Å²	105	133.3 Å²	133.3	73%	0.734	74%	0.739	S	S	*	*			trans	-51.7	115.7	167.8	48.1	0	0	0	0	107.1	S877 S881	S877-S879 PolarHBondContact O-N 3.46Å; S879-S881 PolarHBondContact O-N 3.17Å
880	S	34.1	Very low	37.7	Very low	113 Å²	113	135.9 Å²	135.9	79%	0.79	76%	0.764	S	S	*	*			trans	-58.1	97.7	160	50.1	0	0	0	0	106.3	P878 D882	P878-S880 PolarHBondContact O-N 2.85Å; S880-D882 PolarHBondContact O-N 3.01Å
881	S	30.8	Very low	34.8	Very low	107 Å²	107	145.9 Å²	145.9	75%	0.748	80%	0.797	S	S	*	*			trans	-62.9	129.9	171.9	52.6	0	0	0	0	108.2	S879 G883	S879-S881 PolarHBondContact O-N 3.17Å; S881-G883 PolarHBondContact O-N 2.73Å
882	D	31	Very low	32.6	Very low	152 Å²	152	146.3 Å²	146.3	81%	0.813	81%	0.807	S	S	*	*			trans	-43.2	119.4	174.4	-66.9	-52	0	0	0	112.3	S880 R884	S880-D882 PolarHBondContact O-N 3.01Å; D882-R884 VanDerWaalsContact C-N 3.3Å; D882-R884 PolarHBondContact O-N 3.18Å
883	G	28.5	Very low	31	Very low	82 Å²	82	144.3 Å²	144.3	85%	0.845	82%	0.816	S	S	*	*			trans	-73	88.5	159.8	0	0	0	0	0	108.7	S881	S881-G883 PolarHBondContact O-N 2.73Å
884	R	30.4	Very low	30.4	Very low	228 Å²	228	138.5 Å²	138.5	86%	0.86	81%	0.81	S	S	*	*			trans	-66.1	130	159.3	-88.4	-178	173	178.1	-2.1	108.4	D882 D886	D882-R884 VanDerWaalsContact C-N 3.3Å; D882-R884 PolarHBondContact O-N 3.18Å; R884-D886 PolarHBondContact O-N 2.67Å
885	S	32.4	Very low	30.3	Very low	111 Å²	111	143.3 Å²	143.3	78%	0.776	83%	0.832	S	S	*	*			trans	-63.5	110.2	169.4	48.4	0	0	0	0	110.6
886	D	26.1	Very low	29.9	Very low	157 Å²	157	138.7 Å²	138.7	84%	0.84	83%	0.829	S	S	*	*			trans	-113.9	125.5	158.4	-82.2	-32.3	0	0	0	109.1	R884	R884-D886 PolarHBondContact O-N 2.67Å
887	S	27.4	Very low	30	Very low	110 Å²	110	135.9 Å²	135.9	77%	0.769	83%	0.829	S	S	*	*			trans	-74.6	144.2	178.5	-57.7	0	0	0	0	109.6	S889	S887-S889 PolarHBondContact O-N 3.28Å
888	P	28.5	Very low	30.1	Very low	133 Å²	133	137.9 Å²	137.9	86%	0.864	84%	0.837	S	S	*	*			trans	-79.4	115.5	179.2	30.5	-29.5	0	0	0	109.8
889	S	28.7	Very low	30.1	Very low	114 Å²	114	138.7 Å²	138.7	80%	0.797	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-77.2	151.7	165.3	53.3	0	0	0	0	111.1	S887	S887-S889 PolarHBondContact O-N 3.28Å
890	S	30.5	Very low	30.2	Very low	114 Å²	114	140.8 Å²	140.8	80%	0.797	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-54	143.2	-172.7	45.2	0	0	0	0	116
891	R	31.6	Very low	29.9	Very low	241 Å²	241	142.7 Å²	142.7	91%	0.909	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-56.5	141.1	160.7	-75.4	172.8	157	177	-7.8	111.7
892	D	32.4	Very low	29.9	Very low	169 Å²	169	145.2 Å²	145.2	90%	0.904	86%	0.855	S	S	*	*				-160	143.4	129.5	-111.6	-15.6	0	0	0	113.3
893	G	27.4	Very low	29.8	Very low	80 Å²	80	144.7 Å²	144.7	83%	0.825	86%	0.859	S	S	*	*			trans	91.8	119.5	169.7	0	0	0	0	0	115.2
894	G	31.7	Very low	29.9	Very low	69 Å²	69	149.9 Å²	149.9	71%	0.711	86%	0.86	S	S	*	*			cis	144.6	102.1	11.2	0	0	0	0	0	107.8
895	H	31.6	Very low	29.8	Very low	273 Å²	273	142.8 Å²	142.8	100%	1.264	86%	0.86	S	S	*	*			trans	167	0	145.5	-91.1	-52.1	0	0	0	111.1

Retrieved 895 of 895 residues in 1873.3 ms (Link to these results)

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