A0A087YLI9_POEFO Loading...

Transmembrane serine protease 15

AlphaFold DB , UniProt , Accession A0A087YLI9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,049 aa.

						>A0A087YLI9_POEFO|A0A087YLI9
MSRRLSSVEVVLFVVSSLLFLCCGGLCVVSWLSLTSEGADEAAQLSGRLVITEGVEFSEELRNSSSHRFKSLAFDIQQLVYEAFSISDLWRFYQFCWVQDFSPGSVVVTFELRFSKLIDTKEVEQQLRAGLQVAGGGALVIDINSIQITGKSVMSHPDQGSGDTQPAALCVPAEKLEKTTPTAMTCPPGQTACSDGSGCVPSNWFCDGVPDCLDSSDESPFSCATPCDGKFVLEGPSGSFRSSQSDAYNNNVFCRWIIRVNRGLSAQVTFQQFETEANIDVLRLYEGVGPNKVLAAELSGSAPPGTVWLLTDQSTVEFTSDSFNSLPGFRASFRAADTAGLSNPEKLSCSFEDGVCFWRQQQDDEGDWIRTSGPTFPSSTGPNSDHTMGNSSGFYLVTPMSPGQWEKRFWLQSLPLTPSPHPTCLSFWYHMFGVDVHRLRVVLRPSLPDADAIVLFQKDGNYGDTWNYGQVTLNLTSDAMVEFEALKKGGMWNDIALDDITLTPEPCGPAPPEPTNVPPPTTIAPIPPDCGGPFDLWESNSTFSSPNYPHSYGNMANCLWTLHASAGQNIQLHFLDFDVEATYDMVEVRDGTGSNSTLLAVLTGSAGPAHDLFSTSNQMMVRFFTDSSGDGRGFKANFTCGVALGSPAPCAVAQFQCQTGACIPGNSQCDGALDCPDGSDEADCVKLQVNGSRRLRVQIGSTPHTVCSNGWTSHLSDFTCRYLGHRSGDASLLPALPQDSPFVYISLTRTRTGNGSLETNVSETCSSGEVVSLNCTNQPCGRRQVTWDQSEANTLDQSGEHRVVGGVNAAKGAWPWMVSLHWRGRHVCGASLIGSDWLLTAAHCVYGKNLHLESWSAVLGLHAQSQIYAAEVQTRLVDQIIIHREYNRLTKHGDIAMMRLQQPINFTQWVQPVCLAAEGQNFAAGRRCFIAGWGREAEAGSLPDVLQEATLPLLEQAECQLLLPEYTITSSILCAGYPEGGVDSCQGDSGGPLMCEEDGHWTQIGCVISFGVGCARPQKPGGYARVSAFASWIAQTRPWRTRGKFLDQS
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.6	Very low	58	Low	246 Å²	246	136.9 Å²	136.9	100%	1.212	70%	0.704	S	S	*	*				0	106.6	0	-79.6	172.9	164.9	0	0	107.8	R3	M1-R3 PolarHBondContact O-N 2.75Å
2	S	43.2	Very low	59	Low	113 Å²	113	135 Å²	135	79%	0.79	70%	0.695	S	S	*	*			trans	-75.1	116.5	179.2	67.5	0	0	0	0	109.6	R4	S2-R4 PolarHBondContact O-N 3.43Å
3	R	43	Very low	60.1	Low	247 Å²	247	136.9 Å²	136.9	93%	0.932	70%	0.696	S	S	*	*			trans	-80.4	108	172	-132.1	175.7	173.7	-174.1	-4.2	107.4	M1 L5	M1-R3 PolarHBondContact O-N 2.75Å; R3-L5 PolarHBondContact O-N 3.41Å
4	R	54	Low	61.2	Low	239 Å²	239	132.8 Å²	132.8	90%	0.902	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-70.4	116.7	170.5	-75.5	-174.5	176.2	-166.8	-1.3	107.4	S2	S2-R4 PolarHBondContact O-N 3.43Å
5	L	53.5	Low	62.3	Low	126 Å²	126	128.7 Å²	128.7	66%	0.66	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-62.4	142.7	172.7	-77.3	126.1	0	0	0	110	R3 E9 V10	R3-L5 PolarHBondContact O-N 3.41Å; L5-E9 HydrophobicContact CD2-CB 4.18Å; L5-V10 HydrophobicContact CB-CG2 4.38Å
6	S	66.6	Low	62.6	Low	68 Å²	68	124.9 Å²	124.9	48%	0.476	65%	0.652	S	S	.	*	P	Polyproline II helix	trans	-72.2	146.1	178.6	177.8	0	0	0	0	110.3	V8 E9 V10	S6-V8 PolarHBondContact O-N 3.48Å; S6-E9 PolarHBondContact N-OE2 3.18Å; S6-E9 PolarHBondContact O-N 2.92Å; S6-V10 PolarHBondContact O-N 2.02Å
7	S	62.8	Low	63.1	Low	98 Å²	98	120.9 Å²	120.9	69%	0.685	64%	0.637	S	S	*	*	H	α-helix	trans	-52.2	-27.1	-178.2	-41.4	0	0	0	0	113.5	V11	S7-V11 VanDerWaalsContact O-CG2 3.24Å; S7-V11 WeakPolarHBondContact O-CG2 2.96Å; S7-V11 PolarHBondContact O-N 3.26Å
8	V	65.4	Low	63.5	Low	97 Å²	97	119.9 Å²	119.9	59%	0.588	63%	0.631	S	S	*	*	H	α-helix	trans	-76.2	-36.2	-179.8	-176.6	0	0	0	0	112.4	S6 V10 V11 L12	S6-V8 PolarHBondContact O-N 3.48Å; V8-V10 VanDerWaalsContact C-N 3.34Å; V8-V11 PolarHBondContact O-N 3Å; V8-L12 HydrophobicContact CG1-CD1 4.21Å; V8-L12 PolarHBondContact O-N 3.3Å
9	E	66.3	Low	63.9	Low	106 Å²	106	119.2 Å²	119.2	50%	0.495	63%	0.628	S	S	.	*	H	α-helix	trans	-69.8	-35.2	177.3	-72	172.5	141.9	0	0	111.1	L5 S6 L12 F13	L5-E9 HydrophobicContact CD2-CB 4.18Å; S6-E9 PolarHBondContact N-OE2 3.18Å; S6-E9 PolarHBondContact O-N 2.92Å; E9-L12 PolarHBondContact O-N 3.36Å; E9-F13 PolarHBondContact O-N 3.25Å
10	V	71.8	Confident	64.2	Low	77 Å²	77	121.4 Å²	121.4	47%	0.467	63%	0.632	S	S	.	*	H	α-helix	trans	-66.1	-42.2	173.7	-178.8	0	0	0	0	110.6	L5 S6 V8 F13 V14	L5-V10 HydrophobicContact CB-CG2 4.38Å; S6-V10 PolarHBondContact O-N 2.02Å; V8-V10 VanDerWaalsContact C-N 3.34Å; V10-F13 PolarHBondContact O-N 3.4Å; V10-V14 VanDerWaalsContact O-CG2 3.23Å; V10-V14 WeakPolarHBondContact O-CG2 3.31Å; V10-V14 PolarHBondContact O-N 2.97Å
11	V	74.3	Confident	64.5	Low	89 Å²	89	122 Å²	122	54%	0.539	64%	0.635	S	S	.	*	H	α-helix	trans	-64.5	-42.7	177.1	170.9	0	0	0	0	111.4	S7 V8 F13 V14 V15	S7-V11 VanDerWaalsContact O-CG2 3.24Å; S7-V11 WeakPolarHBondContact O-CG2 2.96Å; S7-V11 PolarHBondContact O-N 3.26Å; V8-V11 PolarHBondContact O-N 3Å; V11-F13 PolarHBondContact O-N 3.45Å; V11-V14 PolarHBondContact O-N 3.08Å; V11-V15 HydrophobicContact CG1-CG2 4.22Å; V11-V15 WeakPolarHBondContact O-CB 3.45Å; V11-V15 VanDerWaalsContact O-CG2 3.28Å; V11-V15 WeakPolarHBondContact O-CG2 3Å; V11-V15 PolarHBondContact O-N 3.25Å
12	L	69.3	Low	65.8	Low	114 Å²	114	114.1 Å²	114.1	60%	0.597	60%	0.604	S	S	*	*	H	α-helix	trans	-62.8	-39.9	176.7	-91	155.8	0	0	0	112.7	V8 E9 V14 V15 S16	V8-L12 HydrophobicContact CG1-CD1 4.21Å; V8-L12 PolarHBondContact O-N 3.3Å; E9-L12 PolarHBondContact O-N 3.36Å; L12-V14 VanDerWaalsContact C-N 3.35Å; L12-V15 PolarHBondContact O-N 3.49Å; L12-S16 VanDerWaalsContact O-CB 3.26Å; L12-S16 WeakPolarHBondContact O-CB 3.34Å; L12-S16 PolarHBondContact O-N 2.98Å
13	F	73.6	Confident	66.7	Low	160 Å²	160	112.4 Å²	112.4	70%	0.702	59%	0.591	S	S	*	*	H	α-helix	trans	-65.8	-39.1	176	-126.1	-84.8	0	0	0	112.1	E9 V10 V11 S17	E9-F13 PolarHBondContact O-N 3.25Å; V10-F13 PolarHBondContact O-N 3.4Å; V11-F13 PolarHBondContact O-N 3.45Å; F13-S17 WeakPolarHBondContact O-CB 3.45Å; F13-S17 PolarHBondContact O-N 3.33Å; F13-S17 PolarHBondContact O-OG 3.17Å
14	V	76	Confident	68	Low	79 Å²	79	102.4 Å²	102.4	48%	0.479	57%	0.565	S	S	.	*	H	α-helix	trans	-68.7	-43.4	177.9	171.9	0	0	0	0	111.1	V10 V11 L12 S17 L18	V10-V14 VanDerWaalsContact O-CG2 3.23Å; V10-V14 WeakPolarHBondContact O-CG2 3.31Å; V10-V14 PolarHBondContact O-N 2.97Å; V11-V14 PolarHBondContact O-N 3.08Å; L12-V14 VanDerWaalsContact C-N 3.35Å; V14-S17 PolarHBondContact O-N 3.05Å; V14-L18 HydrophobicContact CG1-CD1 3.93Å; V14-L18 WeakPolarHBondContact O-CB 3.46Å; V14-L18 WeakPolarHBondContact O-CG 3.33Å; V14-L18 PolarHBondContact O-N 2.92Å
15	V	76.8	Confident	68.7	Low	72 Å²	72	92.6 Å²	92.6	44%	0.436	54%	0.538	S	S	.	.	H	α-helix	trans	-66.5	-42.1	178	172.9	0	0	0	0	111.3	V11 L12 S17 L18 L19	V11-V15 HydrophobicContact CG1-CG2 4.22Å; V11-V15 WeakPolarHBondContact O-CB 3.45Å; V11-V15 VanDerWaalsContact O-CG2 3.28Å; V11-V15 WeakPolarHBondContact O-CG2 3Å; V11-V15 PolarHBondContact O-N 3.25Å; L12-V15 PolarHBondContact O-N 3.49Å; V15-S17 VanDerWaalsContact C-N 3.33Å; V15-S17 PolarHBondContact O-N 3.23Å; V15-L18 PolarHBondContact O-N 3.49Å; V15-L19 HydrophobicContact CG1-CD1 4.04Å; V15-L19 PolarHBondContact O-N 3.13Å
16	S	67.1	Low	69.1	Low	67 Å²	67	92.4 Å²	92.4	47%	0.469	54%	0.537	S	S	.	.	H	α-helix	trans	-63.5	-39.3	176.2	179.7	0	0	0	0	112.2	L12 L19 F20	L12-S16 VanDerWaalsContact O-CB 3.26Å; L12-S16 WeakPolarHBondContact O-CB 3.34Å; L12-S16 PolarHBondContact O-N 2.98Å; S16-L19 PolarHBondContact O-N 2.93Å; S16-F20 PolarHBondContact O-N 2.77Å; S16-F20 VanDerWaalsContact O-N 3.1Å
17	S	70.8	Confident	68.6	Low	57 Å²	57	93.5 Å²	93.5	40%	0.399	54%	0.543	S	S	.	.	H	α-helix	trans	-68.9	-36.8	176.8	-57.4	0	0	0	0	112.4	F13 V14 V15 F20 L21	F13-S17 WeakPolarHBondContact O-CB 3.45Å; F13-S17 PolarHBondContact O-N 3.33Å; F13-S17 PolarHBondContact O-OG 3.17Å; V14-S17 PolarHBondContact O-N 3.05Å; V15-S17 VanDerWaalsContact C-N 3.33Å; V15-S17 PolarHBondContact O-N 3.23Å; S17-F20 PolarHBondContact O-N 2.04Å; S17-L21 WeakPolarHBondContact O-CG 3.41Å; S17-L21 PolarHBondContact O-N 3.11Å; S17-L21 VanDerWaalsContact O-N 3.12Å
18	L	71.8	Confident	68.4	Low	103 Å²	103	92.8 Å²	92.8	54%	0.539	54%	0.535	S	S	.	.	H	α-helix	trans	-67.3	-39.2	175	-82.7	161.3	0	0	0	112.4	V14 V15 L21 C22	V14-L18 HydrophobicContact CG1-CD1 3.93Å; V14-L18 WeakPolarHBondContact O-CB 3.46Å; V14-L18 WeakPolarHBondContact O-CG 3.33Å; V14-L18 PolarHBondContact O-N 2.92Å; V15-L18 PolarHBondContact O-N 3.49Å; L18-L21 PolarHBondContact O-N 2.56Å; L18-C22 PolarHBondContact O-N 3.42Å
19	L	70.4	Confident	67.8	Low	107 Å²	107	92.2 Å²	92.2	56%	0.56	53%	0.531	S	S	*	.	H	α-helix	trans	-64.7	-39.8	174.7	-85.6	158.1	0	0	0	112.2	V15 S16 L21 C22 C23	V15-L19 HydrophobicContact CG1-CD1 4.04Å; V15-L19 PolarHBondContact O-N 3.13Å; S16-L19 PolarHBondContact O-N 2.93Å; L19-L21 PolarHBondContact O-N 3.04Å; L19-C22 PolarHBondContact O-N 2.82Å; L19-C23 PolarHBondContact O-N 2.9Å
20	F	69.9	Low	66.9	Low	163 Å²	163	90.7 Å²	90.7	72%	0.715	53%	0.533	S	S	*	.	H	α-helix	trans	-64.4	-39.3	175.3	-111.5	-83.3	0	0	0	112.7	S16 S17 C23 G24	S16-F20 PolarHBondContact O-N 2.77Å; S16-F20 VanDerWaalsContact O-N 3.1Å; S17-F20 PolarHBondContact O-N 2.04Å; F20-C23 PolarHBondContact O-N 3.19Å; F20-G24 PolarHBondContact O-N 3.2Å
21	L	69.5	Low	65.6	Low	133 Å²	133	96.8 Å²	96.8	70%	0.696	55%	0.547	S	S	*	.	H	α-helix	trans	-68.8	-37	175.4	-76.1	163.3	0	0	0	112.3	S17 L18 L19 G25	S17-L21 WeakPolarHBondContact O-CG 3.41Å; S17-L21 PolarHBondContact O-N 3.11Å; S17-L21 VanDerWaalsContact O-N 3.12Å; L18-L21 PolarHBondContact O-N 2.56Å; L19-L21 PolarHBondContact O-N 3.04Å; L21-G25 PolarHBondContact O-N 3.33Å
22	C	66.1	Low	63.7	Low	82 Å²	82	97.7 Å²	97.7	55%	0.554	55%	0.549	S	S	*	.	H	α-helix	trans	-66.5	-41.8	173	-91.7	0	0	0	0	112.6	L18 L19 G25 L26	L18-C22 PolarHBondContact O-N 3.42Å; L19-C22 PolarHBondContact O-N 2.82Å; C22-G25 PolarHBondContact O-N 3.42Å; C22-L26 PolarHBondContact O-N 2.8Å
23	C	62.7	Low	62.4	Low	77 Å²	77	96.8 Å²	96.8	52%	0.52	55%	0.552	S	S	.	*	H	α-helix	trans	-63.7	-42.3	175	-80.4	0	0	0	0	111.9	L19 F20 G25 L26 C27	L19-C23 PolarHBondContact O-N 2.9Å; F20-C23 PolarHBondContact O-N 3.19Å; C23-G25 VanDerWaalsContact C-N 3.33Å; C23-G25 PolarHBondContact O-N 2.88Å; C23-L26 PolarHBondContact O-N 3.08Å; C23-C27 PolarHBondContact O-N 3.09Å; C23-C27 PolarHBondContact O-SG 3.44Å
24	G	70.1	Confident	60.8	Low	37 Å²	37	96 Å²	96	38%	0.381	55%	0.554	S	S	.	*	H	α-helix	trans	-61.4	-41.6	172.7	0	0	0	0	0	112.4	F20 C27 V28	F20-G24 PolarHBondContact O-N 3.2Å; G24-C27 PolarHBondContact O-N 2.69Å; G24-V28 VanDerWaalsContact O-CG2 3.3Å; G24-V28 WeakPolarHBondContact O-CG2 3.32Å; G24-V28 PolarHBondContact O-N 3.15Å
25	G	68.1	Low	58.9	Low	33 Å²	33	96.7 Å²	96.7	34%	0.34	56%	0.559	S	S	.	*	H	α-helix	trans	-63.1	-42.6	175.7	0	0	0	0	0	113.3	L21 C22 C23 V28 V29	L21-G25 PolarHBondContact O-N 3.33Å; C22-G25 PolarHBondContact O-N 3.42Å; C23-G25 VanDerWaalsContact C-N 3.33Å; C23-G25 PolarHBondContact O-N 2.88Å; G25-V28 PolarHBondContact O-N 3.27Å; G25-V29 WeakPolarHBondContact O-CB 3.21Å; G25-V29 VanDerWaalsContact O-CG2 3.27Å; G25-V29 WeakPolarHBondContact O-CG2 3.21Å; G25-V29 PolarHBondContact O-N 2.99Å
26	L	61.1	Low	56.6	Low	121 Å²	121	98.3 Å²	98.3	63%	0.634	57%	0.573	S	S	*	*	H	α-helix	trans	-66.9	-37.9	176.4	-79.3	164	0	0	0	112.1	C22 C23 V28 V29 S30	C22-L26 PolarHBondContact O-N 2.8Å; C23-L26 PolarHBondContact O-N 3.08Å; L26-V28 VanDerWaalsContact C-N 3.33Å; L26-V28 PolarHBondContact O-N 3.31Å; L26-V29 PolarHBondContact O-N 3.41Å; L26-S30 WeakPolarHBondContact O-CB 3.25Å; L26-S30 PolarHBondContact O-N 2.97Å
27	C	56.6	Low	54.9	Low	91 Å²	91	104.5 Å²	104.5	62%	0.615	60%	0.595	S	S	*	*	H	α-helix	trans	-63.6	-39.2	172.4	-70.2	0	0	0	0	111.9	C23 G24 W31	C23-C27 PolarHBondContact O-N 3.09Å; C23-C27 PolarHBondContact O-SG 3.44Å; G24-C27 PolarHBondContact O-N 2.69Å; C27-W31 VanDerWaalsContact O-CB 3.29Å; C27-W31 WeakPolarHBondContact O-CB 3.2Å; C27-W31 PolarHBondContact O-N 3.2Å
28	V	58.3	Low	53	Low	83 Å²	83	105.5 Å²	105.5	50%	0.503	61%	0.614	S	S	.	*	H	α-helix	trans	-72.7	-37.6	177.8	171	0	0	0	0	112	G24 G25 L26 W31 L32	G24-V28 VanDerWaalsContact O-CG2 3.3Å; G24-V28 WeakPolarHBondContact O-CG2 3.32Å; G24-V28 PolarHBondContact O-N 3.15Å; G25-V28 PolarHBondContact O-N 3.27Å; L26-V28 VanDerWaalsContact C-N 3.33Å; L26-V28 PolarHBondContact O-N 3.31Å; V28-W31 PolarHBondContact O-N 3.44Å; V28-L32 HydrophobicContact CG1-CD1 3.69Å; V28-L32 HydrophobicContact CG1-CG 4.45Å; V28-L32 WeakPolarHBondContact O-CB 3.47Å; V28-L32 WeakPolarHBondContact O-CD1 3.06Å; V28-L32 WeakPolarHBondContact O-CG 3.06Å; V28-L32 PolarHBondContact O-N 2.97Å
29	V	53.1	Low	51.1	Low	85 Å²	85	105.3 Å²	105.3	52%	0.515	63%	0.627	S	S	.	*	H	α-helix	trans	-70	-36.8	174.8	173	0	0	0	0	111	G25 L26 W31 L32 S33	G25-V29 WeakPolarHBondContact O-CB 3.21Å; G25-V29 VanDerWaalsContact O-CG2 3.27Å; G25-V29 WeakPolarHBondContact O-CG2 3.21Å; G25-V29 PolarHBondContact O-N 2.99Å; L26-V29 PolarHBondContact O-N 3.41Å; V29-W31 VanDerWaalsContact C-N 3.35Å; V29-L32 PolarHBondContact O-N 3.4Å; V29-S33 VanDerWaalsContact O-CB 3.24Å; V29-S33 WeakPolarHBondContact O-CB 3.32Å; V29-S33 PolarHBondContact O-N 3.42Å; V29-S33 PolarHBondContact O-OG 3.32Å
30	S	47.9	Very low	49.5	Very low	75 Å²	75	106 Å²	106	52%	0.524	63%	0.632	S	S	.	*	H	α-helix	trans	-66.2	-38.3	172.6	-158	0	0	0	0	111.3	L26 L34	L26-S30 WeakPolarHBondContact O-CB 3.25Å; L26-S30 PolarHBondContact O-N 2.97Å; S30-L34 WeakPolarHBondContact O-CD1 3.27Å; S30-L34 WeakPolarHBondContact O-CG 3.46Å; S30-L34 PolarHBondContact O-N 3.38Å
31	W	43	Very low	48.2	Very low	204 Å²	204	105.7 Å²	105.7	77%	0.773	63%	0.632	S	S	*	*	H	α-helix	trans	-67.6	-38.5	173.3	-163.4	-76	0	0	0	113	C27 V28 V29	C27-W31 VanDerWaalsContact O-CB 3.29Å; C27-W31 WeakPolarHBondContact O-CB 3.2Å; C27-W31 PolarHBondContact O-N 3.2Å; V28-W31 PolarHBondContact O-N 3.44Å; V29-W31 VanDerWaalsContact C-N 3.35Å
32	L	36.3	Very low	47.2	Very low	109 Å²	109	101.5 Å²	101.5	57%	0.571	62%	0.617	S	S	*	*	H	α-helix	trans	-78.1	-29.2	178.8	-77	162.7	0	0	0	113.1	V28 V29 L34 T35	V28-L32 HydrophobicContact CG1-CD1 3.69Å; V28-L32 HydrophobicContact CG1-CG 4.45Å; V28-L32 WeakPolarHBondContact O-CB 3.47Å; V28-L32 WeakPolarHBondContact O-CD1 3.06Å; V28-L32 WeakPolarHBondContact O-CG 3.06Å; V28-L32 PolarHBondContact O-N 2.97Å; V29-L32 PolarHBondContact O-N 3.4Å; L32-L34 VanDerWaalsContact C-N 3.28Å; L32-T35 PolarHBondContact O-N 2.75Å; L32-T35 PolarHBondContact O-OG1 3.11Å
33	S	40.3	Very low	46.7	Very low	94 Å²	94	98.1 Å²	98.1	66%	0.657	60%	0.595	S	S	*	*	H	α-helix	trans	-77.2	-15.5	176.4	-54.7	0	0	0	0	112.7	V29	V29-S33 VanDerWaalsContact O-CB 3.24Å; V29-S33 WeakPolarHBondContact O-CB 3.32Å; V29-S33 PolarHBondContact O-N 3.42Å; V29-S33 PolarHBondContact O-OG 3.32Å
34	L	40.3	Very low	46.9	Very low	143 Å²	143	99 Å²	99	75%	0.749	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	0.6	170.1	-80.5	163	0	0	0	113.3	S30 L32	S30-L34 WeakPolarHBondContact O-CD1 3.27Å; S30-L34 WeakPolarHBondContact O-CG 3.46Å; S30-L34 PolarHBondContact O-N 3.38Å; L32-L34 VanDerWaalsContact C-N 3.28Å
35	T	35.8	Very low	47.2	Very low	95 Å²	95	97.7 Å²	97.7	58%	0.583	58%	0.576	S	S	*	*	S	Bend	trans	-132.1	83.1	177.3	53.9	0	0	0	0	111.6	L32	L32-T35 PolarHBondContact O-N 2.75Å; L32-T35 PolarHBondContact O-OG1 3.11Å
36	S	29.2	Very low	47.8	Very low	106 Å²	106	97.1 Å²	97.1	74%	0.741	57%	0.566	S	S	*	*			trans	174.1	89.2	152.5	162.5	0	0	0	0	110.6
37	E	31.9	Very low	48.7	Very low	197 Å²	197	91.4 Å²	91.4	92%	0.921	54%	0.536	S	S	*	.	S	Bend	trans	177.7	108.5	130.5	-98.9	174.5	173.4	0	0	109.7
38	G	30.3	Very low	49.9	Very low	78 Å²	78	92.8 Å²	92.8	80%	0.804	53%	0.529	S	S	*	.			trans	100	46	167.7	0	0	0	0	0	117.5	D40	G38-D40 PolarHBondContact O-N 2.92Å
39	A	32.3	Very low	51.2	Low	99 Å²	99	88.8 Å²	88.8	82%	0.818	51%	0.505	S	S	*	.			trans	-77.5	89.9	162.9	0	0	0	0	0	109.8	E41	A39-E41 PolarHBondContact O-N 2.93Å
40	D	36.7	Very low	52.6	Low	122 Å²	122	86.1 Å²	86.1	65%	0.652	49%	0.488	S	S	*	.			trans	-74.3	112.9	152	-86.4	-24.4	0	0	0	106.6	G38 A42	G38-D40 PolarHBondContact O-N 2.92Å; D40-A42 PolarHBondContact O-N 3.07Å
41	E	43.5	Very low	54.1	Low	156 Å²	156	82.6 Å²	82.6	73%	0.729	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-54.7	128.4	-177.8	-70.6	179.4	145.6	0	0	111.4	A39 A43	A39-E41 PolarHBondContact O-N 2.93Å; E41-A43 PolarHBondContact O-N 2.92Å
42	A	46.7	Very low	55.5	Low	44 Å²	44	76.2 Å²	76.2	36%	0.364	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-65.3	120.6	175.7	0	0	0	0	0	110.3	D40 Q44	D40-A42 PolarHBondContact O-N 3.07Å; A42-Q44 PolarHBondContact O-N 3.46Å
43	A	55.8	Low	57	Low	12 Å²	12	77.3 Å²	77.3	10%	0.099	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-74.5	117.1	177.4	0	0	0	0	0	110.6	E41 L45 F114 L117	E41-A43 PolarHBondContact O-N 2.92Å; A43-L45 HydrophobicContact CB-CG 4.46Å; A43-F114 PolarHBondContact O-N 3.37Å; A43-L117 HydrophobicContact CB-CD2 3.8Å; A43-L117 HydrophobicContact CB-CG 4.22Å
44	Q	67.8	Low	57.9	Low	96 Å²	96	75.7 Å²	75.7	45%	0.449	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	113.4	167.1	-170.1	170.2	1	0	0	108.5	A42 E111	A42-Q44 PolarHBondContact O-N 3.46Å; Q44-E111 PolarHBondContact NE2-OE2 2.64Å
45	L	76.9	Confident	59.3	Low	9 Å²	9	70.9 Å²	70.9	5%	0.047	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	143.1	-177.7	-59.7	178.7	0	0	0	109.5	A43 E111 L112 F114 T120 V123 I148	A43-L45 HydrophobicContact CB-CG 4.46Å; L45-E111 CarbonylContact O-C 3.59Å; L45-E111 WeakPolarHBondContact O-CA 3.21Å; L45-L112 HydrophobicContact CB-CB 4.48Å; L45-L112 PolarHBondContact N-O 2.94Å; L45-L112 PolarHBondContact O-N 3.22Å; L45-F114 HydrophobicContact CD1-CD2 4.32Å; L45-F114 HydrophobicContact CD1-CE2 4.32Å; L45-T120 HydrophobicContact CD1-CG2 4.32Å; L45-T120 HydrophobicContact CD2-CG2 3.68Å; L45-V123 HydrophobicContact CD1-CB 4.47Å; L45-V123 HydrophobicContact CD1-CG2 3.92Å; L45-I148 HydrophobicContact CB-CG2 3.93Å; L45-I148 HydrophobicContact CD1-CG2 4.15Å
46	S	79.3	Confident	60.9	Low	20 Å²	20	75 Å²	75	14%	0.14	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	127.4	175.4	-171.4	0	0	0	0	110.2	F110 I148 T149	S46-F110 CarbonylContact C-O 3.42Å; S46-F110 WeakPolarHBondContact CA-O 3.48Å; S46-F110 PolarHBondContact OG-O 2.85Å; S46-I148 CarbonylContact O-C 3.28Å; S46-I148 WeakPolarHBondContact O-CA 3.32Å; S46-T149 PolarHBondContact N-O 3.4Å; S46-T149 PolarHBondContact O-N 3.17Å; S46-T149 PolarHBondContact O-OG1 3.16Å
47	G	80.2	Confident	62.6	Low	1 Å²	1	72.6 Å²	72.6	1%	0.01	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	150.5	179	0	0	0	0	0	112.9	T109 F110 Q147	G47-T109 WeakPolarHBondContact O-CA 3.14Å; G47-F110 PolarHBondContact N-O 3.19Å; G47-F110 WeakPolarHBondContact O-CD1 3.35Å; G47-F110 PolarHBondContact O-N 3.15Å; G47-Q147 CarbonylContact C-O 3.43Å; G47-Q147 VanDerWaalsContact CA-O 3.29Å; G47-Q147 WeakPolarHBondContact CA-O 3.5Å
48	R	82.9	Confident	64.4	Low	120 Å²	120	65.3 Å²	65.3	45%	0.453	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	134.9	175.3	-173.3	-178.6	-178.7	-161.6	-0.4	109.8	V107 V108 I146 Q147	R48-V107 HydrophobicContact CG-CG1 3.92Å; R48-V108 VanDerWaalsContact CA-O 3.32Å; R48-V108 WeakPolarHBondContact CA-O 3.09Å; R48-I146 CarbonylContact O-C 3.52Å; R48-I146 VanDerWaalsContact O-CA 3.26Å; R48-I146 WeakPolarHBondContact O-CA 3.47Å; R48-Q147 PolarHBondContact N-O 3Å; R48-Q147 PolarHBondContact O-N 3.02Å
49	L	84.2	Confident	66.2	Low	0 Å²	0	67.7 Å²	67.7	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	159.8	172.8	66.5	82.6	0	0	0	111.6	I51 V108 F110 I141 I146	L49-I51 HydrophobicContact CD1-CG1 4.05Å; L49-V108 HydrophobicContact CD1-CB 3.88Å; L49-V108 HydrophobicContact CD1-CG2 3.64Å; L49-V108 HydrophobicContact CG-CB 4.1Å; L49-V108 HydrophobicContact CG-CG2 4.42Å; L49-V108 PolarHBondContact N-O 3.39Å; L49-V108 PolarHBondContact O-N 2.99Å; L49-F110 HydrophobicContact CB-CE1 4.26Å; L49-F110 HydrophobicContact CD2-CD1 4.33Å; L49-F110 HydrophobicContact CD2-CE1 3.5Å; L49-F110 HydrophobicContact CD2-CZ 4.01Å; L49-F110 HydrophobicContact CG-CD1 4.47Å; L49-F110 HydrophobicContact CG-CE1 3.76Å; L49-I141 HydrophobicContact CB-CG2 4.29Å; L49-I141 HydrophobicContact CD1-CD1 4.36Å; L49-I141 HydrophobicContact CD1-CG1 4.41Å; L49-I141 HydrophobicContact CD1-CG2 3.98Å; L49-I146 HydrophobicContact CB-CG1 4.09Å
50	V	83.4	Confident	67.7	Low	28 Å²	28	68.4 Å²	68.4	17%	0.17	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	128.9	-178.2	179	0	0	0	0	110.1	S105 V107 D142 S145	V50-S105 WeakPolarHBondContact CG1-O 3.34Å; V50-V107 HydrophobicContact CG2-CG2 4.17Å; V50-D142 PolarHBondContact O-N 2.98Å; V50-S145 WeakPolarHBondContact CB-OG 3.4Å; V50-S145 PolarHBondContact N-OG 3.03Å
51	I	79.2	Confident	69.1	Low	2 Å²	2	62.9 Å²	62.9	1%	0.01	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	122.2	172.6	-55.7	173.7	0	0	0	108.2	L49 E53 I76 S105 V106 V108 I141	L49-I51 HydrophobicContact CD1-CG1 4.05Å; I51-E53 WeakPolarHBondContact CG2-O 3.33Å; I51-I76 HydrophobicContact CD1-CD1 3.9Å; I51-I76 HydrophobicContact CD1-CG1 4.37Å; I51-S105 CarbonylContact O-C 3.5Å; I51-V106 HydrophobicContact CB-CB 4.37Å; I51-V106 HydrophobicContact CD1-CG1 4.46Å; I51-V106 PolarHBondContact N-O 3.45Å; I51-V108 HydrophobicContact CD1-CG2 3.8Å; I51-V108 HydrophobicContact CG1-CG2 4.06Å; I51-I141 HydrophobicContact CG1-CG1 4.42Å
52	T	72.9	Confident	70.2	Confident	70 Å²	70	62.8 Å²	62.8	43%	0.429	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	-32.9	-176.8	50.6	0	0	0	0	113	V140 D142	T52-V140 PolarHBondContact N-O 2.59Å; T52-V140 PolarHBondContact OG1-O 2.94Å; T52-D142 HydrophobicContact CG2-CB 3.77Å
53	E	66.4	Low	71.4	Confident	132 Å²	132	64.7 Å²	64.7	62%	0.617	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.9	149.4	179.6	-55.7	-175.5	166.1	0	0	111.3	I51 V140	I51-E53 WeakPolarHBondContact CG2-O 3.33Å; E53-V140 HydrophobicContact CB-CB 3.96Å; E53-V140 HydrophobicContact CB-CG2 4Å; E53-V140 PolarHBondContact N-O 3.05Å; E53-V140 PolarHBondContact O-N 2.96Å
54	G	61	Low	71.6	Confident	59 Å²	59	67.7 Å²	67.7	61%	0.608	35%	0.348	S	S	*	.	S	Bend	trans	108	-15.9	177.5	0	0	0	0	0	115.4
55	V	69.5	Low	71.5	Confident	43 Å²	43	66.9 Å²	66.9	26%	0.261	35%	0.353	S	S	.	.			trans	-145.4	130.4	178.9	-174.6	0	0	0	0	111.3	L61 L72 V106 L139	V55-L61 HydrophobicContact CG1-CD1 4.28Å; V55-L72 HydrophobicContact CG1-CD2 3.96Å; V55-L72 HydrophobicContact CG2-CD1 3.8Å; V55-V106 HydrophobicContact CB-CG2 4.33Å; V55-V106 HydrophobicContact CG1-CG2 4.03Å; V55-L139 HydrophobicContact CG2-CD2 3.27Å
56	E	68.2	Low	71.4	Confident	182 Å²	182	67.5 Å²	67.5	85%	0.85	36%	0.358	S	S	*	.			trans	-95.1	138.6	166.3	-70.9	-170.8	162.5	0	0	110.6	S58	E56-S58 PolarHBondContact O-N 2.95Å
57	F	66.2	Low	71	Confident	54 Å²	54	74.2 Å²	74.2	24%	0.237	39%	0.387	C	S	.	.			trans	-67.6	121.2	178.3	-177.5	-92.4	0	0	0	110.6	L61 F101 P103 V106	F57-L61 HydrophobicContact CE2-CB 4.46Å; F57-F101 HydrophobicContact CE2-CB 4.38Å; F57-F101 WeakPolarHBondContact CE2-O 3.4Å; F57-P103 HydrophobicContact CD1-CB 3.74Å; F57-P103 HydrophobicContact CD2-CB 4.41Å; F57-P103 HydrophobicContact CE1-CB 3.71Å; F57-P103 HydrophobicContact CE1-CG 4.22Å; F57-P103 HydrophobicContact CE2-CB 4.39Å; F57-P103 HydrophobicContact CG-CB 4.1Å; F57-P103 HydrophobicContact CZ-CB 4.05Å; F57-P103 HydrophobicContact CZ-CG 4.25Å; F57-V106 HydrophobicContact CB-CG2 4.07Å
58	S	69.7	Low	70.5	Confident	44 Å²	44	82.3 Å²	82.3	31%	0.308	42%	0.417	S	S	.	.			trans	-111.7	151.4	171.1	74.6	0	0	0	0	111	E56 E60 L61	E56-S58 PolarHBondContact O-N 2.95Å; S58-E60 PolarHBondContact O-N 2.8Å; S58-E60 VanDerWaalsContact O-N 3.08Å; S58-L61 WeakPolarHBondContact O-CB 3.37Å; S58-L61 PolarHBondContact O-N 2.87Å
59	E	67.6	Low	70.2	Confident	128 Å²	128	77.2 Å²	77.2	60%	0.598	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-58.6	-22.5	177	-78.6	-74.2	140.2	0	0	112.8	L61 R62	E59-L61 VanDerWaalsContact C-N 3.29Å; E59-L61 PolarHBondContact O-N 3.46Å; E59-R62 WeakPolarHBondContact O-CB 3.41Å; E59-R62 PolarHBondContact O-N 3.01Å; E59-R62 IonicContact OE1-NH1 3.66Å; E59-R62 PolarHBondContact OE1-NH1 2.89Å; E59-R62 IonicContact OE2-CZ 3.43Å; E59-R62 IonicContact OE2-NH1 3.69Å; E59-R62 PolarHBondContact OE2-NH1 2.82Å; E59-R62 IonicContact OE2-NH2 3.4Å
60	E	62.5	Low	69.8	Low	114 Å²	114	83.4 Å²	83.4	53%	0.533	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-69.8	-23.2	175.3	-64.7	-179.1	176.8	0	0	113.4	S58 R62 N63 S66	S58-E60 PolarHBondContact O-N 2.8Å; S58-E60 VanDerWaalsContact O-N 3.08Å; E60-R62 PolarHBondContact O-N 3.32Å; E60-N63 PolarHBondContact O-N 2.77Å; E60-S66 VanDerWaalsContact O-CB 3.32Å; E60-S66 WeakPolarHBondContact O-CB 3.24Å
61	L	67.2	Low	69.4	Low	6 Å²	6	84.9 Å²	84.9	3%	0.031	44%	0.436	C	S	.	.	G	3₁₀ helix	trans	-74.9	-8.6	174.4	-68.3	174.6	0	0	0	112.8	V55 F57 S58 E59 N63 R68 F69 L72 F101	V55-L61 HydrophobicContact CG1-CD1 4.28Å; F57-L61 HydrophobicContact CE2-CB 4.46Å; S58-L61 WeakPolarHBondContact O-CB 3.37Å; S58-L61 PolarHBondContact O-N 2.87Å; E59-L61 VanDerWaalsContact C-N 3.29Å; E59-L61 PolarHBondContact O-N 3.46Å; L61-N63 VanDerWaalsContact C-N 3.31Å; L61-R68 HydrophobicContact CD2-CB 4.21Å; L61-F69 WeakPolarHBondContact O-CD2 3.5Å; L61-L72 HydrophobicContact CD1-CD2 4.03Å; L61-L72 HydrophobicContact CD2-CB 4.38Å; L61-L72 HydrophobicContact CD2-CD2 3.88Å; L61-F101 HydrophobicContact CB-CB 4.31Å; L61-F101 HydrophobicContact CB-CD2 4.35Å; L61-F101 HydrophobicContact CD2-CD2 4.4Å
62	R	67.2	Low	69.3	Low	155 Å²	155	85.3 Å²	85.3	59%	0.585	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-83.3	-12.3	171.1	-147.5	171.2	76.2	-142.6	-2.8	112.5	E59 E60	E59-R62 WeakPolarHBondContact O-CB 3.41Å; E59-R62 PolarHBondContact O-N 3.01Å; E59-R62 IonicContact OE1-NH1 3.66Å; E59-R62 PolarHBondContact OE1-NH1 2.89Å; E59-R62 IonicContact OE2-CZ 3.43Å; E59-R62 IonicContact OE2-NH1 3.69Å; E59-R62 PolarHBondContact OE2-NH1 2.82Å; E59-R62 IonicContact OE2-NH2 3.4Å; E60-R62 PolarHBondContact O-N 3.32Å
63	N	70.9	Confident	69.5	Low	84 Å²	84	82.4 Å²	82.4	45%	0.449	42%	0.422	S	S	.	.			trans	-103.1	106.4	179.1	-172.9	0.8	0	0	0	110.5	E60 L61 S65 S66 F69	E60-N63 PolarHBondContact O-N 2.77Å; L61-N63 VanDerWaalsContact C-N 3.31Å; N63-S65 PolarHBondContact ND2-OG 2.79Å; N63-S65 PolarHBondContact O-N 3.43Å; N63-S65 PolarHBondContact OD1-N 2.87Å; N63-S65 PolarHBondContact OD1-OG 2.81Å; N63-S66 WeakPolarHBondContact O-CB 3.35Å; N63-S66 PolarHBondContact O-N 2.78Å; N63-F69 VanDerWaalsContact O-CB 3.32Å; N63-F69 WeakPolarHBondContact O-CB 3.49Å
64	S	61.1	Low	69.9	Low	75 Å²	75	81.9 Å²	81.9	52%	0.524	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-16.2	-178.5	58.1	0	0	0	0	114.6	F69	S64-F69 WeakPolarHBondContact O-CD1 3.33Å
65	S	66	Low	70.7	Confident	79 Å²	79	82.4 Å²	82.4	55%	0.552	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-8.9	174.5	75.1	0	0	0	0	114	N63	N63-S65 PolarHBondContact ND2-OG 2.79Å; N63-S65 PolarHBondContact O-N 3.43Å; N63-S65 PolarHBondContact OD1-N 2.87Å; N63-S65 PolarHBondContact OD1-OG 2.81Å
66	S	74.5	Confident	71.2	Confident	21 Å²	21	80.4 Å²	80.4	15%	0.147	39%	0.394	C	S	.	.	S	Bend	trans	-68.8	143.1	-178.6	176.7	0	0	0	0	111.8	E60 N63 R68 F69 K70	E60-S66 VanDerWaalsContact O-CB 3.32Å; E60-S66 WeakPolarHBondContact O-CB 3.24Å; N63-S66 WeakPolarHBondContact O-CB 3.35Å; N63-S66 PolarHBondContact O-N 2.78Å; S66-R68 PolarHBondContact O-N 3.08Å; S66-R68 PolarHBondContact OG-N 3.45Å; S66-F69 WeakPolarHBondContact O-CB 3.33Å; S66-F69 PolarHBondContact O-N 2.74Å; S66-F69 VanDerWaalsContact O-N 3.15Å; S66-K70 PolarHBondContact O-N 3.46Å
67	H	69.4	Low	71.9	Confident	162 Å²	162	74 Å²	74	75%	0.75	37%	0.365	S	S	*	.	H	α-helix	trans	-59.5	-34.6	174.1	-164.2	-74.5	0	0	0	111.7	S71	H67-S71 VanDerWaalsContact O-CB 3.3Å; H67-S71 WeakPolarHBondContact O-CB 3.42Å; H67-S71 PolarHBondContact O-N 3.47Å
68	R	70.9	Confident	72.5	Confident	171 Å²	171	75.7 Å²	75.7	65%	0.645	37%	0.373	S	S	*	.	H	α-helix	trans	-66.6	-40.8	175.4	-76.3	-86.6	-174.4	164.9	-2.1	112.1	L61 S66 L72	L61-R68 HydrophobicContact CD2-CB 4.21Å; S66-R68 PolarHBondContact O-N 3.08Å; S66-R68 PolarHBondContact OG-N 3.45Å; R68-L72 WeakPolarHBondContact O-CB 3.35Å; R68-L72 PolarHBondContact O-N 3.4Å; R68-L72 VanDerWaalsContact O-N 3.09Å
69	F	77	Confident	73	Confident	13 Å²	13	75.1 Å²	75.1	6%	0.057	37%	0.366	C	S	.	.	H	α-helix	trans	-63.8	-49.4	175.1	179.7	-84.1	0	0	0	110.8	L61 N63 S64 S66 S71 L72 A73 F101	L61-F69 WeakPolarHBondContact O-CD2 3.5Å; N63-F69 VanDerWaalsContact O-CB 3.32Å; N63-F69 WeakPolarHBondContact O-CB 3.49Å; S64-F69 WeakPolarHBondContact O-CD1 3.33Å; S66-F69 WeakPolarHBondContact O-CB 3.33Å; S66-F69 PolarHBondContact O-N 2.74Å; S66-F69 VanDerWaalsContact O-N 3.15Å; F69-S71 PolarHBondContact O-N 2.78Å; F69-L72 PolarHBondContact O-N 2.97Å; F69-A73 HydrophobicContact CD1-CB 4.32Å; F69-A73 HydrophobicContact CE1-CB 4.18Å; F69-A73 WeakPolarHBondContact O-CB 3.46Å; F69-A73 PolarHBondContact O-N 2.89Å; F69-F101 AromaticContact CD2-CD2 3.41Å; F69-F101 HydrophobicContact CD2-CD2 3.41Å; F69-F101 VanDerWaalsContact CD2-CD2 3.41Å; F69-F101 AromaticContact CD2-CE2 3.49Å; F69-F101 HydrophobicContact CD2-CE2 3.49Å; F69-F101 VanDerWaalsContact CD2-CE2 3.49Å; F69-F101 AromaticContact CE2-CD2 3.42Å; F69-F101 HydrophobicContact CE2-CD2 3.42Å; F69-F101 VanDerWaalsContact CE2-CD2 3.42Å; F69-F101 AromaticContact CE2-CE2 3.53Å; F69-F101 HydrophobicContact CE2-CE2 3.53Å; F69-F101 HydrophobicContact CG-CD2 4.4Å; F69-F101 HydrophobicContact CG-CE2 4.11Å; F69-F101 HydrophobicContact CZ-CD2 4.42Å; F69-F101 HydrophobicContact CZ-CE2 4.18Å
70	K	74	Confident	73.5	Confident	130 Å²	130	69 Å²	69	57%	0.565	34%	0.338	S	S	*	.	H	α-helix	trans	-64.3	-40.6	-177.6	-68.4	-177.2	-178.5	-179.1	0	112.4	S66 F74	S66-K70 PolarHBondContact O-N 3.46Å; K70-F74 VanDerWaalsContact O-CB 3.25Å; K70-F74 WeakPolarHBondContact O-CB 3.35Å; K70-F74 PolarHBondContact O-N 2.94Å
71	S	75.6	Confident	74.3	Confident	58 Å²	58	69.1 Å²	69.1	41%	0.406	33%	0.334	S	S	.	.	H	α-helix	trans	-62.6	-51.7	175.5	-170.8	0	0	0	0	111.3	H67 F69 A73 F74 D75	H67-S71 VanDerWaalsContact O-CB 3.3Å; H67-S71 WeakPolarHBondContact O-CB 3.42Å; H67-S71 PolarHBondContact O-N 3.47Å; F69-S71 PolarHBondContact O-N 2.78Å; S71-A73 PolarHBondContact O-N 3.04Å; S71-F74 WeakPolarHBondContact O-CB 2.98Å; S71-F74 PolarHBondContact O-N 2.02Å; S71-D75 VanDerWaalsContact O-CG 3.26Å; S71-D75 PolarHBondContact O-N 3.47Å
72	L	78.6	Confident	74.8	Confident	12 Å²	12	72.7 Å²	72.7	6%	0.063	35%	0.351	C	S	.	.	H	α-helix	trans	-67.6	-37.1	-178.9	-175.8	63.5	0	0	0	112.2	V55 L61 R68 F69 F74 D75 I76 F101 V106 L139	V55-L72 HydrophobicContact CG1-CD2 3.96Å; V55-L72 HydrophobicContact CG2-CD1 3.8Å; L61-L72 HydrophobicContact CD1-CD2 4.03Å; L61-L72 HydrophobicContact CD2-CB 4.38Å; L61-L72 HydrophobicContact CD2-CD2 3.88Å; R68-L72 WeakPolarHBondContact O-CB 3.35Å; R68-L72 PolarHBondContact O-N 3.4Å; R68-L72 VanDerWaalsContact O-N 3.09Å; F69-L72 PolarHBondContact O-N 2.97Å; L72-F74 VanDerWaalsContact C-N 3.33Å; L72-D75 PolarHBondContact O-N 3.06Å; L72-I76 HydrophobicContact CD1-CD1 4.17Å; L72-I76 HydrophobicContact CG-CD1 3.91Å; L72-I76 VanDerWaalsContact O-CD1 3.32Å; L72-I76 WeakPolarHBondContact O-CD1 3.31Å; L72-I76 VanDerWaalsContact O-CG1 3.28Å; L72-I76 WeakPolarHBondContact O-CG1 3.45Å; L72-I76 PolarHBondContact O-N 3.11Å; L72-I76 VanDerWaalsContact O-N 3.08Å; L72-F101 HydrophobicContact CB-CZ 4.16Å; L72-F101 HydrophobicContact CD2-CD1 4.21Å; L72-F101 HydrophobicContact CD2-CE1 3.75Å; L72-F101 HydrophobicContact CD2-CE2 4.24Å; L72-F101 HydrophobicContact CD2-CZ 3.77Å; L72-F101 HydrophobicContact CG-CE1 4.03Å; L72-F101 HydrophobicContact CG-CE2 4.48Å; L72-F101 HydrophobicContact CG-CZ 3.77Å; L72-V106 HydrophobicContact CD2-CG1 4.46Å; L72-L139 HydrophobicContact CD1-CD1 4.3Å; L72-L139 HydrophobicContact CD1-CD2 4.49Å
73	A	76.6	Confident	75.4	Confident	8 Å²	8	65.3 Å²	65.3	7%	0.066	32%	0.323	C	S	.	.	H	α-helix	trans	-61.9	-42.2	174	0	0	0	0	0	111.3	F69 S71 I76 Q77 V98 F101	F69-A73 HydrophobicContact CD1-CB 4.32Å; F69-A73 HydrophobicContact CE1-CB 4.18Å; F69-A73 WeakPolarHBondContact O-CB 3.46Å; F69-A73 PolarHBondContact O-N 2.89Å; S71-A73 PolarHBondContact O-N 3.04Å; A73-I76 PolarHBondContact O-N 3.2Å; A73-Q77 WeakPolarHBondContact O-CB 3.48Å; A73-Q77 WeakPolarHBondContact O-CG 3.29Å; A73-Q77 PolarHBondContact O-N 2.72Å; A73-Q77 PolarHBondContact O-OE1 2.97Å; A73-V98 HydrophobicContact CB-CB 3.93Å; A73-V98 HydrophobicContact CB-CG1 4.24Å; A73-V98 HydrophobicContact CB-CG2 4.36Å; A73-F101 HydrophobicContact CB-CZ 4.44Å
74	F	75.2	Confident	75.7	Confident	121 Å²	121	61.3 Å²	61.3	53%	0.531	30%	0.301	S	S	.	.	H	α-helix	trans	-62.9	-47.7	176.3	-177.7	-94.2	0	0	0	111.7	K70 S71 L72 I76 Q77 Q78	K70-F74 VanDerWaalsContact O-CB 3.25Å; K70-F74 WeakPolarHBondContact O-CB 3.35Å; K70-F74 PolarHBondContact O-N 2.94Å; S71-F74 WeakPolarHBondContact O-CB 2.98Å; S71-F74 PolarHBondContact O-N 2.02Å; L72-F74 VanDerWaalsContact C-N 3.33Å; F74-I76 VanDerWaalsContact C-N 3.27Å; F74-I76 PolarHBondContact O-N 2.98Å; F74-Q77 PolarHBondContact O-N 2.84Å; F74-Q77 VanDerWaalsContact O-N 3.13Å; F74-Q78 PolarHBondContact O-N 3.01Å
75	D	77.8	Confident	76.2	Confident	71 Å²	71	60.1 Å²	60.1	38%	0.38	29%	0.293	S	S	.	.	H	α-helix	trans	-58	-41.4	178.4	-64.4	-22.6	0	0	0	111.4	S71 L72 L79 L139	S71-D75 VanDerWaalsContact O-CG 3.26Å; S71-D75 PolarHBondContact O-N 3.47Å; L72-D75 PolarHBondContact O-N 3.06Å; D75-L79 VanDerWaalsContact O-CB 3.23Å; D75-L79 WeakPolarHBondContact O-CB 3.35Å; D75-L79 PolarHBondContact O-N 2.89Å; D75-L139 HydrophobicContact CB-CD1 4.28Å
76	I	79.1	Confident	76.5	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-72.7	-38.2	178	-64.2	159.3	0	0	0	111.7	I51 L72 A73 F74 L79 V80 V98 F101 V108	I51-I76 HydrophobicContact CD1-CD1 3.9Å; I51-I76 HydrophobicContact CD1-CG1 4.37Å; L72-I76 HydrophobicContact CD1-CD1 4.17Å; L72-I76 HydrophobicContact CG-CD1 3.91Å; L72-I76 VanDerWaalsContact O-CD1 3.32Å; L72-I76 WeakPolarHBondContact O-CD1 3.31Å; L72-I76 VanDerWaalsContact O-CG1 3.28Å; L72-I76 WeakPolarHBondContact O-CG1 3.45Å; L72-I76 PolarHBondContact O-N 3.11Å; L72-I76 VanDerWaalsContact O-N 3.08Å; A73-I76 PolarHBondContact O-N 3.2Å; F74-I76 VanDerWaalsContact C-N 3.27Å; F74-I76 PolarHBondContact O-N 2.98Å; I76-L79 PolarHBondContact O-N 2.88Å; I76-V80 HydrophobicContact CG2-CG2 4.33Å; I76-V80 VanDerWaalsContact O-CG2 3.3Å; I76-V80 WeakPolarHBondContact O-CG2 3.38Å; I76-V80 PolarHBondContact O-N 3.37Å; I76-V98 HydrophobicContact CB-CG2 4.29Å; I76-V98 HydrophobicContact CG2-CG2 4.12Å; I76-F101 HydrophobicContact CD1-CE1 3.45Å; I76-F101 VanDerWaalsContact CD1-CE1 3.45Å; I76-F101 HydrophobicContact CD1-CZ 3.81Å; I76-V108 HydrophobicContact CD1-CG1 4.02Å; I76-V108 HydrophobicContact CD1-CG2 3.8Å; I76-V108 HydrophobicContact CG2-CG1 4.27Å
77	Q	82.3	Confident	76.4	Confident	48 Å²	48	60.8 Å²	60.8	22%	0.224	29%	0.289	C	S	.	.	H	α-helix	trans	-63.3	-42.1	176.4	-76.6	171.3	-40.2	0	0	111.7	A73 F74 V80 Y81 C96 V98	A73-Q77 WeakPolarHBondContact O-CB 3.48Å; A73-Q77 WeakPolarHBondContact O-CG 3.29Å; A73-Q77 PolarHBondContact O-N 2.72Å; A73-Q77 PolarHBondContact O-OE1 2.97Å; F74-Q77 PolarHBondContact O-N 2.84Å; F74-Q77 VanDerWaalsContact O-N 3.13Å; Q77-V80 PolarHBondContact O-N 2.99Å; Q77-Y81 WeakPolarHBondContact O-CB 3.41Å; Q77-Y81 PolarHBondContact O-N 3.1Å; Q77-C96 WeakPolarHBondContact CG-O 3.33Å; Q77-C96 PolarHBondContact NE2-O 2.84Å; Q77-V98 HydrophobicContact CG-CG2 3.97Å
78	Q	79.2	Confident	76.5	Confident	89 Å²	89	59.6 Å²	59.6	42%	0.416	29%	0.288	S	S	.	.	H	α-helix	trans	-64.7	-43.2	175.1	-177.2	175	-19.7	0	0	111.1	F74 V80 Y81 E82	F74-Q78 PolarHBondContact O-N 3.01Å; Q78-V80 PolarHBondContact O-N 2.96Å; Q78-Y81 WeakPolarHBondContact O-CB 3.32Å; Q78-Y81 PolarHBondContact O-N 3.07Å; Q78-Y81 VanDerWaalsContact O-N 3.16Å; Q78-E82 PolarHBondContact NE2-OE1 3.41Å; Q78-E82 WeakPolarHBondContact O-CG 3.43Å; Q78-E82 PolarHBondContact O-N 2.75Å
79	L	79.9	Confident	76.5	Confident	32 Å²	32	52.3 Å²	52.3	17%	0.168	26%	0.262	C	S	.	.	H	α-helix	trans	-65.1	-38.3	179.3	-171.9	151.7	0	0	0	112.2	D75 I76 A83 L131 I141	D75-L79 VanDerWaalsContact O-CB 3.23Å; D75-L79 WeakPolarHBondContact O-CB 3.35Å; D75-L79 PolarHBondContact O-N 2.89Å; I76-L79 PolarHBondContact O-N 2.88Å; L79-A83 WeakPolarHBondContact O-CB 3.48Å; L79-A83 PolarHBondContact O-N 3.48Å; L79-L131 HydrophobicContact CD2-CD2 3.12Å; L79-L131 HydrophobicContact CG-CD2 4.31Å; L79-I141 HydrophobicContact CD1-CD1 4.24Å; L79-I141 HydrophobicContact CD2-CD1 3.47Å; L79-I141 VanDerWaalsContact CD2-CD1 3.47Å
80	V	79.1	Confident	76.2	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-68.6	-37.3	172.7	172.5	0	0	0	0	111.5	I76 Q77 Q78 A83 F84 C96 L112 L127	I76-V80 HydrophobicContact CG2-CG2 4.33Å; I76-V80 VanDerWaalsContact O-CG2 3.3Å; I76-V80 WeakPolarHBondContact O-CG2 3.38Å; I76-V80 PolarHBondContact O-N 3.37Å; Q77-V80 PolarHBondContact O-N 2.99Å; Q78-V80 PolarHBondContact O-N 2.96Å; V80-A83 PolarHBondContact O-N 3.43Å; V80-F84 HydrophobicContact CG1-CD2 3.77Å; V80-F84 HydrophobicContact CG1-CE2 3.69Å; V80-F84 VanDerWaalsContact O-CD2 3.27Å; V80-F84 WeakPolarHBondContact O-CD2 3.17Å; V80-F84 PolarHBondContact O-N 3.05Å; V80-C96 HydrophobicContact CG1-CB 4.05Å; V80-L112 HydrophobicContact CG1-CD2 3.94Å; V80-L127 HydrophobicContact CG1-CD1 4.22Å
81	Y	77.9	Confident	75.7	Confident	116 Å²	116	60.4 Å²	60.4	46%	0.455	29%	0.288	S	S	.	.	H	α-helix	trans	-61.6	-47.5	174.4	175.2	-80.6	0	0	0	111.7	Q77 Q78 A83 F84 S85 W90 Y93	Q77-Y81 WeakPolarHBondContact O-CB 3.41Å; Q77-Y81 PolarHBondContact O-N 3.1Å; Q78-Y81 WeakPolarHBondContact O-CB 3.32Å; Q78-Y81 PolarHBondContact O-N 3.07Å; Q78-Y81 VanDerWaalsContact O-N 3.16Å; Y81-A83 VanDerWaalsContact C-N 3.33Å; Y81-A83 PolarHBondContact O-N 3.22Å; Y81-F84 PolarHBondContact O-N 2.69Å; Y81-S85 PolarHBondContact O-N 3.22Å; Y81-W90 HydrophobicContact CD1-CZ3 4.46Å; Y81-W90 AromaticContact CD2-CH2 3.9Å; Y81-W90 HydrophobicContact CD2-CH2 3.9Å; Y81-W90 AromaticContact CD2-CZ3 3.86Å; Y81-W90 HydrophobicContact CD2-CZ3 3.86Å; Y81-W90 AromaticContact CE1-CH2 3.91Å; Y81-W90 HydrophobicContact CE1-CH2 3.91Å; Y81-W90 HydrophobicContact CE1-CZ3 4.2Å; Y81-W90 AromaticContact CE2-CH2 3.16Å; Y81-W90 HydrophobicContact CE2-CH2 3.16Å; Y81-W90 HydrophobicContact CE2-CZ2 4.27Å; Y81-W90 AromaticContact CE2-CZ3 3.62Å; Y81-W90 HydrophobicContact CE2-CZ3 3.62Å; Y81-W90 HydrophobicContact CG-CZ3 4.27Å; Y81-W90 AromaticContact CZ-CH2 3.12Å; Y81-W90 AromaticContact CZ-CZ2 3.92Å; Y81-W90 AromaticContact CZ-CZ3 3.76Å; Y81-W90 WeakPolarHBondContact OH-CH2 3.09Å; Y81-W90 WeakPolarHBondContact OH-CZ2 3.25Å; Y81-Y93 AromaticContact CD2-CE1 3.95Å; Y81-Y93 HydrophobicContact CD2-CE1 3.95Å
82	E	78.9	Confident	75.5	Confident	80 Å²	80	61.1 Å²	61.1	37%	0.374	28%	0.284	S	S	.	.	H	α-helix	trans	-63.6	-38.4	176.7	-72.9	175.7	-167	0	0	111.8	Q78 F84 S85	Q78-E82 PolarHBondContact NE2-OE1 3.41Å; Q78-E82 WeakPolarHBondContact O-CG 3.43Å; Q78-E82 PolarHBondContact O-N 2.75Å; E82-F84 VanDerWaalsContact C-N 3.32Å; E82-F84 PolarHBondContact O-N 3.37Å; E82-S85 PolarHBondContact O-N 3.46Å; E82-S85 PolarHBondContact O-OG 3.08Å
83	A	78.8	Confident	75.3	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62.3	-39.4	175	0	0	0	0	0	112.4	L79 V80 Y81 L127 G130 L131	L79-A83 WeakPolarHBondContact O-CB 3.48Å; L79-A83 PolarHBondContact O-N 3.48Å; V80-A83 PolarHBondContact O-N 3.43Å; Y81-A83 VanDerWaalsContact C-N 3.33Å; Y81-A83 PolarHBondContact O-N 3.22Å; A83-L127 HydrophobicContact CB-CD1 3.83Å; A83-G130 WeakPolarHBondContact O-CA 3.39Å; A83-L131 HydrophobicContact CB-CD2 3.75Å; A83-L131 HydrophobicContact CB-CG 3.83Å
84	F	78	Confident	75.2	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-79.2	-26.6	177.1	-78.6	-63.4	0	0	0	113.6	V80 Y81 E82 I86 S87 W90 Y93 L112 F114 V123 L127	V80-F84 HydrophobicContact CG1-CD2 3.77Å; V80-F84 HydrophobicContact CG1-CE2 3.69Å; V80-F84 VanDerWaalsContact O-CD2 3.27Å; V80-F84 WeakPolarHBondContact O-CD2 3.17Å; V80-F84 PolarHBondContact O-N 3.05Å; Y81-F84 PolarHBondContact O-N 2.69Å; E82-F84 VanDerWaalsContact C-N 3.32Å; E82-F84 PolarHBondContact O-N 3.37Å; F84-I86 PolarHBondContact O-N 3.04Å; F84-S87 WeakPolarHBondContact CA-OG 3.28Å; F84-S87 WeakPolarHBondContact O-CB 3.49Å; F84-S87 PolarHBondContact O-N 3.13Å; F84-S87 PolarHBondContact O-OG 2.88Å; F84-W90 HydrophobicContact CB-CE3 4.47Å; F84-W90 WeakPolarHBondContact O-CB 3.42Å; F84-Y93 HydrophobicContact CB-CG 4.32Å; F84-Y93 AromaticContact CD2-CD2 3.92Å; F84-Y93 HydrophobicContact CD2-CD2 3.92Å; F84-Y93 AromaticContact CD2-CE2 3.87Å; F84-Y93 HydrophobicContact CD2-CE2 3.87Å; F84-Y93 HydrophobicContact CD2-CG 4.49Å; F84-Y93 HydrophobicContact CE2-CD2 4.39Å; F84-Y93 HydrophobicContact CE2-CE2 4.28Å; F84-Y93 HydrophobicContact CG-CD2 4.27Å; F84-Y93 HydrophobicContact CG-CG 4.47Å; F84-L112 HydrophobicContact CE2-CD1 4.1Å; F84-L112 HydrophobicContact CE2-CD2 3.92Å; F84-L112 HydrophobicContact CZ-CD1 4.07Å; F84-F114 HydrophobicContact CE1-CE1 4.46Å; F84-F114 HydrophobicContact CE1-CZ 4Å; F84-F114 HydrophobicContact CE2-CZ 4.45Å; F84-F114 AromaticContact CZ-CZ 3.95Å; F84-F114 HydrophobicContact CZ-CZ 3.95Å; F84-V123 HydrophobicContact CE1-CG1 4.22Å; F84-V123 HydrophobicContact CZ-CG1 3.84Å; F84-L127 HydrophobicContact CD2-CD1 4.29Å; F84-L127 HydrophobicContact CE1-CB 4.31Å; F84-L127 HydrophobicContact CE2-CD1 3.78Å; F84-L127 HydrophobicContact CZ-CB 3.93Å; F84-L127 HydrophobicContact CZ-CD1 3.99Å; F84-L127 HydrophobicContact CZ-CD2 4.41Å; F84-L127 HydrophobicContact CZ-CG 4.32Å
85	S	71.2	Confident	75	Confident	50 Å²	50	64.5 Å²	64.5	35%	0.35	30%	0.298	S	S	.	.	H	α-helix	trans	-65.9	-25.8	-179.7	74.7	0	0	0	0	113.5	Y81 E82	Y81-S85 PolarHBondContact O-N 3.22Å; E82-S85 PolarHBondContact O-N 3.46Å; E82-S85 PolarHBondContact O-OG 3.08Å
86	I	72.9	Confident	75.1	Confident	102 Å²	102	61.5 Å²	61.5	52%	0.523	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-9.1	175.8	-51	166.9	0	0	0	111.1	F84 V133	F84-I86 PolarHBondContact O-N 3.04Å; I86-V133 HydrophobicContact CD1-CG1 4.38Å
87	S	71.6	Confident	75	Confident	12 Å²	12	68.6 Å²	68.6	8%	0.084	31%	0.309	C	S	.	.	S	Bend	trans	-93.5	156.6	-178.4	81.1	0	0	0	0	113	F84 L89 W90	F84-S87 WeakPolarHBondContact CA-OG 3.28Å; F84-S87 WeakPolarHBondContact O-CB 3.49Å; F84-S87 PolarHBondContact O-N 3.13Å; F84-S87 PolarHBondContact O-OG 2.88Å; S87-L89 PolarHBondContact O-N 2.91Å; S87-L89 VanDerWaalsContact O-N 3.08Å; S87-L89 PolarHBondContact OG-N 3.33Å; S87-W90 WeakPolarHBondContact O-CB 3.32Å; S87-W90 PolarHBondContact O-N 3.42Å; S87-W90 VanDerWaalsContact O-N 3.16Å
88	D	71.2	Confident	75	Confident	138 Å²	138	66.4 Å²	66.4	74%	0.738	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-14.4	175.6	-67.7	-37.6	0	0	0	113.3
89	L	72.3	Confident	75	Confident	18 Å²	18	66.3 Å²	66.3	9%	0.094	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-4.2	179.2	-61.4	-178.6	0	0	0	113.8	S87 R91 F92 Y93 F114 I118 E122 V123 Q126	S87-L89 PolarHBondContact O-N 2.91Å; S87-L89 VanDerWaalsContact O-N 3.08Å; S87-L89 PolarHBondContact OG-N 3.33Å; L89-R91 VanDerWaalsContact C-N 3.26Å; L89-R91 PolarHBondContact O-N 3.29Å; L89-F92 PolarHBondContact O-N 3.03Å; L89-Y93 PolarHBondContact O-N 3.49Å; L89-Y93 VanDerWaalsContact O-N 3.16Å; L89-F114 HydrophobicContact CB-CE1 4.39Å; L89-I118 HydrophobicContact CD1-CG2 4.13Å; L89-I118 HydrophobicContact CD2-CD1 4.07Å; L89-I118 HydrophobicContact CD2-CG2 4.16Å; L89-E122 HydrophobicContact CD1-CG 4.44Å; L89-V123 HydrophobicContact CD1-CG2 4.19Å; L89-Q126 HydrophobicContact CD1-CB 4.04Å; L89-Q126 HydrophobicContact CD1-CG 3.87Å; L89-Q126 HydrophobicContact CG-CG 4.18Å
90	W	70.3	Confident	74.9	Confident	90 Å²	90	67.9 Å²	67.9	34%	0.341	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-49.9	-43.9	-178.9	176	-119	0	0	0	113.2	Y81 F84 S87 F92 Y93	Y81-W90 HydrophobicContact CD1-CZ3 4.46Å; Y81-W90 AromaticContact CD2-CH2 3.9Å; Y81-W90 HydrophobicContact CD2-CH2 3.9Å; Y81-W90 AromaticContact CD2-CZ3 3.86Å; Y81-W90 HydrophobicContact CD2-CZ3 3.86Å; Y81-W90 AromaticContact CE1-CH2 3.91Å; Y81-W90 HydrophobicContact CE1-CH2 3.91Å; Y81-W90 HydrophobicContact CE1-CZ3 4.2Å; Y81-W90 AromaticContact CE2-CH2 3.16Å; Y81-W90 HydrophobicContact CE2-CH2 3.16Å; Y81-W90 HydrophobicContact CE2-CZ2 4.27Å; Y81-W90 AromaticContact CE2-CZ3 3.62Å; Y81-W90 HydrophobicContact CE2-CZ3 3.62Å; Y81-W90 HydrophobicContact CG-CZ3 4.27Å; Y81-W90 AromaticContact CZ-CH2 3.12Å; Y81-W90 AromaticContact CZ-CZ2 3.92Å; Y81-W90 AromaticContact CZ-CZ3 3.76Å; Y81-W90 WeakPolarHBondContact OH-CH2 3.09Å; Y81-W90 WeakPolarHBondContact OH-CZ2 3.25Å; F84-W90 HydrophobicContact CB-CE3 4.47Å; F84-W90 WeakPolarHBondContact O-CB 3.42Å; S87-W90 WeakPolarHBondContact O-CB 3.32Å; S87-W90 PolarHBondContact O-N 3.42Å; S87-W90 VanDerWaalsContact O-N 3.16Å; W90-F92 PolarHBondContact O-N 3Å; W90-F92 VanDerWaalsContact O-N 3.07Å; W90-Y93 HydrophobicContact CE3-CD1 4.18Å; W90-Y93 AromaticContact CZ3-CD1 3.72Å; W90-Y93 HydrophobicContact CZ3-CD1 3.72Å; W90-Y93 HydrophobicContact CZ3-CE1 4.22Å; W90-Y93 PolarHBondContact O-N 3.3Å
91	R	64.4	Low	75.1	Confident	222 Å²	222	68 Å²	68	84%	0.838	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-63.9	-16.4	-178.4	-66	-176.2	178.6	178.6	0.5	114	L89	L89-R91 VanDerWaalsContact C-N 3.26Å; L89-R91 PolarHBondContact O-N 3.29Å
92	F	71	Confident	74.9	Confident	73 Å²	73	64.1 Å²	64.1	32%	0.32	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-111.2	-12.6	-178.6	-53	-63.6	0	0	0	113	L89 W90 F114 S115 K116 I118	L89-F92 PolarHBondContact O-N 3.03Å; W90-F92 PolarHBondContact O-N 3Å; W90-F92 VanDerWaalsContact O-N 3.07Å; F92-F114 HydrophobicContact CB-CD1 4.37Å; F92-F114 CarbonylContact O-C 3.57Å; F92-F114 WeakPolarHBondContact O-CA 3.49Å; F92-S115 WeakPolarHBondContact CA-OG 3.3Å; F92-S115 PolarHBondContact O-N 2.94Å; F92-S115 PolarHBondContact O-OG 3.34Å; F92-K116 HydrophobicContact CD1-CD 4.29Å; F92-K116 HydrophobicContact CD1-CG 4.42Å; F92-K116 HydrophobicContact CE1-CD 4.14Å; F92-I118 HydrophobicContact CB-CD1 4Å
93	Y	73.2	Confident	74.3	Confident	23 Å²	23	64.9 Å²	64.9	9%	0.09	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	131.2	178.9	174.6	-104	0	0	0	110.9	Y81 F84 L89 W90 C96 L112 F114	Y81-Y93 AromaticContact CD2-CE1 3.95Å; Y81-Y93 HydrophobicContact CD2-CE1 3.95Å; F84-Y93 HydrophobicContact CB-CG 4.32Å; F84-Y93 AromaticContact CD2-CD2 3.92Å; F84-Y93 HydrophobicContact CD2-CD2 3.92Å; F84-Y93 AromaticContact CD2-CE2 3.87Å; F84-Y93 HydrophobicContact CD2-CE2 3.87Å; F84-Y93 HydrophobicContact CD2-CG 4.49Å; F84-Y93 HydrophobicContact CE2-CD2 4.39Å; F84-Y93 HydrophobicContact CE2-CE2 4.28Å; F84-Y93 HydrophobicContact CG-CD2 4.27Å; F84-Y93 HydrophobicContact CG-CG 4.47Å; L89-Y93 PolarHBondContact O-N 3.49Å; L89-Y93 VanDerWaalsContact O-N 3.16Å; W90-Y93 HydrophobicContact CE3-CD1 4.18Å; W90-Y93 AromaticContact CZ3-CD1 3.72Å; W90-Y93 HydrophobicContact CZ3-CD1 3.72Å; W90-Y93 HydrophobicContact CZ3-CE1 4.22Å; W90-Y93 PolarHBondContact O-N 3.3Å; Y93-C96 HydrophobicContact CE2-CB 4.27Å; Y93-C96 WeakPolarHBondContact OH-CB 3.32Å; Y93-C96 PolarHBondContact OH-N 3.09Å; Y93-L112 HydrophobicContact CE2-CD2 4.01Å; Y93-F114 AromaticContact CD2-CE1 3.96Å; Y93-F114 HydrophobicContact CD2-CE1 3.96Å; Y93-F114 HydrophobicContact CD2-CZ 4.11Å; Y93-F114 HydrophobicContact CG-CE1 4.42Å
94	Q	75.3	Confident	73.1	Confident	96 Å²	96	67.5 Å²	67.5	45%	0.449	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	-57.9	178.1	-66.3	-173.8	-17.8	0	0	111.8	R113	Q94-R113 HydrophobicContact CB-CB 4.46Å; Q94-R113 WeakPolarHBondContact CB-O 3.46Å; Q94-R113 PolarHBondContact N-O 3.38Å; Q94-R113 VanDerWaalsContact OE1-CD 3.31Å
95	F	71.6	Confident	72.2	Confident	94 Å²	94	71 Å²	71	41%	0.412	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.5	163.9	179.8	62.2	-94.1	0	0	0	112.7	R113	F95-R113 HydrophobicContact CD1-CB 4.27Å; F95-R113 HydrophobicContact CE1-CB 3.96Å; F95-R113 HydrophobicContact CE1-CG 4.28Å; F95-R113 HydrophobicContact CE2-CB 4.27Å; F95-R113 HydrophobicContact CZ-CB 3.95Å; F95-R113 VanDerWaalsContact CZ-CD 3.48Å; F95-R113 HydrophobicContact CZ-CG 4.38Å; F95-R113 PolarHBondContact O-N 2.78Å; F95-R113 VanDerWaalsContact O-N 3.09Å
96	C	78.8	Confident	72.2	Confident	8 Å²	8	68.7 Å²	68.7	5%	0.054	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	134	173.2	176	0	0	0	0	109.8	Q77 V80 Y93 F110 E111 L112	Q77-C96 WeakPolarHBondContact CG-O 3.33Å; Q77-C96 PolarHBondContact NE2-O 2.84Å; V80-C96 HydrophobicContact CG1-CB 4.05Å; Y93-C96 HydrophobicContact CE2-CB 4.27Å; Y93-C96 WeakPolarHBondContact OH-CB 3.32Å; Y93-C96 PolarHBondContact OH-N 3.09Å; C96-F110 VanDerWaalsContact SG-CD2 3.52Å; C96-E111 CarbonylContact C-O 3.55Å; C96-E111 VanDerWaalsContact CA-O 3.24Å; C96-E111 WeakPolarHBondContact CA-O 3.23Å; C96-L112 HydrophobicContact CB-CD2 3.76Å
97	W	76.9	Confident	72.3	Confident	150 Å²	150	64.4 Å²	64.4	57%	0.568	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.8	118.3	177.6	-168.8	-80.1	0	0	0	112.1	F110 E111	W97-F110 CarbonylContact O-C 3.05Å; W97-F110 WeakPolarHBondContact O-CA 3.46Å; W97-F110 WeakPolarHBondContact O-CB 3.42Å; W97-E111 PolarHBondContact N-O 2.96Å; W97-E111 PolarHBondContact O-N 2.91Å
98	V	81.8	Confident	72.8	Confident	1 Å²	1	63.8 Å²	63.8	1%	0.006	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	125.6	175.3	177.7	0	0	0	0	109.8	A73 I76 Q77 F101 V108 F110	A73-V98 HydrophobicContact CB-CB 3.93Å; A73-V98 HydrophobicContact CB-CG1 4.24Å; A73-V98 HydrophobicContact CB-CG2 4.36Å; I76-V98 HydrophobicContact CB-CG2 4.29Å; I76-V98 HydrophobicContact CG2-CG2 4.12Å; Q77-V98 HydrophobicContact CG-CG2 3.97Å; V98-F101 HydrophobicContact CG1-CE1 4.15Å; V98-F101 HydrophobicContact CG1-CE2 4.11Å; V98-F101 HydrophobicContact CG1-CZ 3.72Å; V98-V108 HydrophobicContact CG1-CG1 3.74Å; V98-V108 HydrophobicContact CG2-CG1 4.26Å; V98-F110 HydrophobicContact CG2-CB 4.2Å
99	Q	79.1	Confident	73.2	Confident	88 Å²	88	59.3 Å²	59.3	41%	0.411	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	-52.2	-174.7	-69.2	-71.4	-25.7	0	0	112	T109 E111	Q99-T109 WeakPolarHBondContact CB-O 3.21Å; Q99-T109 PolarHBondContact N-O 3.36Å; Q99-E111 HydrophobicContact CG-CG 4.09Å; Q99-E111 PolarHBondContact NE2-OE2 2.86Å
100	D	79.6	Confident	73.6	Confident	65 Å²	65	58.5 Å²	58.5	35%	0.348	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	158.7	-174.3	-170.6	46.1	0	0	0	112.8	T109	D100-T109 PolarHBondContact O-N 3.36Å; D100-T109 VanDerWaalsContact O-N 3.08Å
101	F	81.8	Confident	74.1	Confident	1 Å²	1	55.3 Å²	55.3	0%	0.004	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	129.3	172.4	-61.8	-73.9	0	0	0	110.2	F57 L61 F69 L72 A73 I76 V98 V106 V107 V108	F57-F101 HydrophobicContact CE2-CB 4.38Å; F57-F101 WeakPolarHBondContact CE2-O 3.4Å; L61-F101 HydrophobicContact CB-CB 4.31Å; L61-F101 HydrophobicContact CB-CD2 4.35Å; L61-F101 HydrophobicContact CD2-CD2 4.4Å; F69-F101 AromaticContact CD2-CD2 3.41Å; F69-F101 HydrophobicContact CD2-CD2 3.41Å; F69-F101 VanDerWaalsContact CD2-CD2 3.41Å; F69-F101 AromaticContact CD2-CE2 3.49Å; F69-F101 HydrophobicContact CD2-CE2 3.49Å; F69-F101 VanDerWaalsContact CD2-CE2 3.49Å; F69-F101 AromaticContact CE2-CD2 3.42Å; F69-F101 HydrophobicContact CE2-CD2 3.42Å; F69-F101 VanDerWaalsContact CE2-CD2 3.42Å; F69-F101 AromaticContact CE2-CE2 3.53Å; F69-F101 HydrophobicContact CE2-CE2 3.53Å; F69-F101 HydrophobicContact CG-CD2 4.4Å; F69-F101 HydrophobicContact CG-CE2 4.11Å; F69-F101 HydrophobicContact CZ-CD2 4.42Å; F69-F101 HydrophobicContact CZ-CE2 4.18Å; L72-F101 HydrophobicContact CB-CZ 4.16Å; L72-F101 HydrophobicContact CD2-CD1 4.21Å; L72-F101 HydrophobicContact CD2-CE1 3.75Å; L72-F101 HydrophobicContact CD2-CE2 4.24Å; L72-F101 HydrophobicContact CD2-CZ 3.77Å; L72-F101 HydrophobicContact CG-CE1 4.03Å; L72-F101 HydrophobicContact CG-CE2 4.48Å; L72-F101 HydrophobicContact CG-CZ 3.77Å; A73-F101 HydrophobicContact CB-CZ 4.44Å; I76-F101 HydrophobicContact CD1-CE1 3.45Å; I76-F101 VanDerWaalsContact CD1-CE1 3.45Å; I76-F101 HydrophobicContact CD1-CZ 3.81Å; V98-F101 HydrophobicContact CG1-CE1 4.15Å; V98-F101 HydrophobicContact CG1-CE2 4.11Å; V98-F101 HydrophobicContact CG1-CZ 3.72Å; F101-V106 HydrophobicContact CB-CG1 4.21Å; F101-V106 HydrophobicContact CD1-CG1 3.53Å; F101-V106 HydrophobicContact CE1-CG1 4.29Å; F101-V106 HydrophobicContact CG-CG1 4.2Å; F101-V107 WeakPolarHBondContact CA-O 2.96Å; F101-V108 HydrophobicContact CD1-CB 4.37Å; F101-V108 HydrophobicContact CD1-CG1 4.23Å; F101-V108 HydrophobicContact CD1-CG2 3.91Å; F101-V108 HydrophobicContact CE1-CB 4.25Å; F101-V108 HydrophobicContact CE1-CG1 3.78Å; F101-V108 HydrophobicContact CE1-CG2 3.75Å
102	S	73.9	Confident	74.9	Confident	36 Å²	36	44.8 Å²	44.8	25%	0.252	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	150.4	178.4	50.8	0	0	0	0	113.9	V107	S102-V107 PolarHBondContact N-O 3.07Å; S102-V107 PolarHBondContact O-N 3.46Å; S102-V107 WeakPolarHBondContact OG-CB 2.99Å
103	P	66.6	Low	75.1	Confident	95 Å²	95	46.2 Å²	46.2	62%	0.617	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.5	144.3	-173.6	23.5	-31	0	0	0	113.8	F57	F57-P103 HydrophobicContact CD1-CB 3.74Å; F57-P103 HydrophobicContact CD2-CB 4.41Å; F57-P103 HydrophobicContact CE1-CB 3.71Å; F57-P103 HydrophobicContact CE1-CG 4.22Å; F57-P103 HydrophobicContact CE2-CB 4.39Å; F57-P103 HydrophobicContact CG-CB 4.1Å; F57-P103 HydrophobicContact CZ-CB 4.05Å; F57-P103 HydrophobicContact CZ-CG 4.25Å
104	G	53.6	Low	75.2	Confident	56 Å²	56	45.1 Å²	45.1	58%	0.577	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	95.8	97.3	-176.9	0	0	0	0	0	111.1
105	S	58.3	Low	74.7	Confident	73 Å²	73	42.9 Å²	42.9	51%	0.51	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.6	87.7	-169	-61.4	0	0	0	0	111.2	V50 I51 V107	V50-S105 WeakPolarHBondContact CG1-O 3.34Å; I51-S105 CarbonylContact O-C 3.5Å; S105-V107 WeakPolarHBondContact O-CG2 3.03Å; S105-V107 PolarHBondContact O-N 3.24Å
106	V	72.3	Confident	74.6	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.012	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-28.8	100.7	-165.5	-179.1	0	0	0	0	112.6	I51 V55 F57 L72 F101 V108	I51-V106 HydrophobicContact CB-CB 4.37Å; I51-V106 HydrophobicContact CD1-CG1 4.46Å; I51-V106 PolarHBondContact N-O 3.45Å; V55-V106 HydrophobicContact CB-CG2 4.33Å; V55-V106 HydrophobicContact CG1-CG2 4.03Å; F57-V106 HydrophobicContact CB-CG2 4.07Å; L72-V106 HydrophobicContact CD2-CG1 4.46Å; F101-V106 HydrophobicContact CB-CG1 4.21Å; F101-V106 HydrophobicContact CD1-CG1 3.53Å; F101-V106 HydrophobicContact CE1-CG1 4.29Å; F101-V106 HydrophobicContact CG-CG1 4.2Å; V106-V108 HydrophobicContact CG1-CG2 4.48Å
107	V	74.2	Confident	74	Confident	11 Å²	11	48.9 Å²	48.9	7%	0.067	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	120.7	-178.2	178.3	0	0	0	0	107.2	R48 V50 F101 S102 S105	R48-V107 HydrophobicContact CG-CG1 3.92Å; V50-V107 HydrophobicContact CG2-CG2 4.17Å; F101-V107 WeakPolarHBondContact CA-O 2.96Å; S102-V107 PolarHBondContact N-O 3.07Å; S102-V107 PolarHBondContact O-N 3.46Å; S102-V107 WeakPolarHBondContact OG-CB 2.99Å; S105-V107 WeakPolarHBondContact O-CG2 3.03Å; S105-V107 PolarHBondContact O-N 3.24Å
108	V	81.9	Confident	73.7	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	127.6	-176.9	-167.7	0	0	0	0	109.2	R48 L49 I51 I76 V98 F101 V106 F110	R48-V108 VanDerWaalsContact CA-O 3.32Å; R48-V108 WeakPolarHBondContact CA-O 3.09Å; L49-V108 HydrophobicContact CD1-CB 3.88Å; L49-V108 HydrophobicContact CD1-CG2 3.64Å; L49-V108 HydrophobicContact CG-CB 4.1Å; L49-V108 HydrophobicContact CG-CG2 4.42Å; L49-V108 PolarHBondContact N-O 3.39Å; L49-V108 PolarHBondContact O-N 2.99Å; I51-V108 HydrophobicContact CD1-CG2 3.8Å; I51-V108 HydrophobicContact CG1-CG2 4.06Å; I76-V108 HydrophobicContact CD1-CG1 4.02Å; I76-V108 HydrophobicContact CD1-CG2 3.8Å; I76-V108 HydrophobicContact CG2-CG1 4.27Å; V98-V108 HydrophobicContact CG1-CG1 3.74Å; V98-V108 HydrophobicContact CG2-CG1 4.26Å; F101-V108 HydrophobicContact CD1-CB 4.37Å; F101-V108 HydrophobicContact CD1-CG1 4.23Å; F101-V108 HydrophobicContact CD1-CG2 3.91Å; F101-V108 HydrophobicContact CE1-CB 4.25Å; F101-V108 HydrophobicContact CE1-CG1 3.78Å; F101-V108 HydrophobicContact CE1-CG2 3.75Å; V106-V108 HydrophobicContact CG1-CG2 4.48Å; V108-F110 HydrophobicContact CG1-CD1 4.33Å
109	T	80.4	Confident	73.4	Confident	44 Å²	44	47.9 Å²	47.9	27%	0.27	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	128.6	169.9	-47.4	0	0	0	0	108.9	G47 Q99 D100	G47-T109 WeakPolarHBondContact O-CA 3.14Å; Q99-T109 WeakPolarHBondContact CB-O 3.21Å; Q99-T109 PolarHBondContact N-O 3.36Å; D100-T109 PolarHBondContact O-N 3.36Å; D100-T109 VanDerWaalsContact O-N 3.08Å
110	F	81.3	Confident	73.3	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	161.1	-178	57.9	-84.1	0	0	0	111.8	S46 G47 L49 C96 W97 V98 V108 L112 L127	S46-F110 CarbonylContact C-O 3.42Å; S46-F110 WeakPolarHBondContact CA-O 3.48Å; S46-F110 PolarHBondContact OG-O 2.85Å; G47-F110 PolarHBondContact N-O 3.19Å; G47-F110 WeakPolarHBondContact O-CD1 3.35Å; G47-F110 PolarHBondContact O-N 3.15Å; L49-F110 HydrophobicContact CB-CE1 4.26Å; L49-F110 HydrophobicContact CD2-CD1 4.33Å; L49-F110 HydrophobicContact CD2-CE1 3.5Å; L49-F110 HydrophobicContact CD2-CZ 4.01Å; L49-F110 HydrophobicContact CG-CD1 4.47Å; L49-F110 HydrophobicContact CG-CE1 3.76Å; C96-F110 VanDerWaalsContact SG-CD2 3.52Å; W97-F110 CarbonylContact O-C 3.05Å; W97-F110 WeakPolarHBondContact O-CA 3.46Å; W97-F110 WeakPolarHBondContact O-CB 3.42Å; V98-F110 HydrophobicContact CG2-CB 4.2Å; V108-F110 HydrophobicContact CG1-CD1 4.33Å; F110-L112 HydrophobicContact CD2-CD2 3.92Å; F110-L112 HydrophobicContact CD2-CG 3.95Å; F110-L112 HydrophobicContact CE2-CD1 3.96Å; F110-L112 HydrophobicContact CE2-CD2 3.89Å; F110-L112 HydrophobicContact CE2-CG 3.85Å; F110-L127 HydrophobicContact CE2-CD2 4.33Å; F110-L127 HydrophobicContact CZ-CD2 4.05Å
111	E	81	Confident	73.2	Confident	23 Å²	23	49.8 Å²	49.8	11%	0.107	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	135.7	175.3	-70.8	-167.8	152.7	0	0	110.6	Q44 L45 C96 W97 Q99 K151	Q44-E111 PolarHBondContact NE2-OE2 2.64Å; L45-E111 CarbonylContact O-C 3.59Å; L45-E111 WeakPolarHBondContact O-CA 3.21Å; C96-E111 CarbonylContact C-O 3.55Å; C96-E111 VanDerWaalsContact CA-O 3.24Å; C96-E111 WeakPolarHBondContact CA-O 3.23Å; W97-E111 PolarHBondContact N-O 2.96Å; W97-E111 PolarHBondContact O-N 2.91Å; Q99-E111 HydrophobicContact CG-CG 4.09Å; Q99-E111 PolarHBondContact NE2-OE2 2.86Å; E111-K151 IonicContact OE1-NZ 2.75Å; E111-K151 PolarHBondContact OE1-NZ 2.97Å
112	L	80	Confident	73.1	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	138.4	177.9	-61.6	173	0	0	0	109.5	L45 V80 F84 Y93 C96 F110 F114 V123 I148	L45-L112 HydrophobicContact CB-CB 4.48Å; L45-L112 PolarHBondContact N-O 2.94Å; L45-L112 PolarHBondContact O-N 3.22Å; V80-L112 HydrophobicContact CG1-CD2 3.94Å; F84-L112 HydrophobicContact CE2-CD1 4.1Å; F84-L112 HydrophobicContact CE2-CD2 3.92Å; F84-L112 HydrophobicContact CZ-CD1 4.07Å; Y93-L112 HydrophobicContact CE2-CD2 4.01Å; C96-L112 HydrophobicContact CB-CD2 3.76Å; F110-L112 HydrophobicContact CD2-CD2 3.92Å; F110-L112 HydrophobicContact CD2-CG 3.95Å; F110-L112 HydrophobicContact CE2-CD1 3.96Å; F110-L112 HydrophobicContact CE2-CD2 3.89Å; F110-L112 HydrophobicContact CE2-CG 3.85Å; L112-F114 HydrophobicContact CB-CE2 3.87Å; L112-F114 HydrophobicContact CD1-CE2 4.31Å; L112-V123 HydrophobicContact CD1-CG1 3.84Å; L112-I148 HydrophobicContact CD1-CD1 3.98Å
113	R	76.3	Confident	73.4	Confident	103 Å²	103	51.6 Å²	51.6	39%	0.389	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	131	173.8	-162.7	178.3	-170.9	177.3	1.3	111.4	Q94 F95	Q94-R113 HydrophobicContact CB-CB 4.46Å; Q94-R113 WeakPolarHBondContact CB-O 3.46Å; Q94-R113 PolarHBondContact N-O 3.38Å; Q94-R113 VanDerWaalsContact OE1-CD 3.31Å; F95-R113 HydrophobicContact CD1-CB 4.27Å; F95-R113 HydrophobicContact CE1-CB 3.96Å; F95-R113 HydrophobicContact CE1-CG 4.28Å; F95-R113 HydrophobicContact CE2-CB 4.27Å; F95-R113 HydrophobicContact CZ-CB 3.95Å; F95-R113 VanDerWaalsContact CZ-CD 3.48Å; F95-R113 HydrophobicContact CZ-CG 4.38Å; F95-R113 PolarHBondContact O-N 2.78Å; F95-R113 VanDerWaalsContact O-N 3.09Å
114	F	74.1	Confident	74.1	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	149.4	175.5	-64.6	-90.1	0	0	0	111.3	A43 L45 F84 L89 F92 Y93 L112 K116 I118 V123	A43-F114 PolarHBondContact O-N 3.37Å; L45-F114 HydrophobicContact CD1-CD2 4.32Å; L45-F114 HydrophobicContact CD1-CE2 4.32Å; F84-F114 HydrophobicContact CE1-CE1 4.46Å; F84-F114 HydrophobicContact CE1-CZ 4Å; F84-F114 HydrophobicContact CE2-CZ 4.45Å; F84-F114 AromaticContact CZ-CZ 3.95Å; F84-F114 HydrophobicContact CZ-CZ 3.95Å; L89-F114 HydrophobicContact CB-CE1 4.39Å; F92-F114 HydrophobicContact CB-CD1 4.37Å; F92-F114 CarbonylContact O-C 3.57Å; F92-F114 WeakPolarHBondContact O-CA 3.49Å; Y93-F114 AromaticContact CD2-CE1 3.96Å; Y93-F114 HydrophobicContact CD2-CE1 3.96Å; Y93-F114 HydrophobicContact CD2-CZ 4.11Å; Y93-F114 HydrophobicContact CG-CE1 4.42Å; L112-F114 HydrophobicContact CB-CE2 3.87Å; L112-F114 HydrophobicContact CD1-CE2 4.31Å; F114-K116 WeakPolarHBondContact CB-O 3.26Å; F114-K116 PolarHBondContact O-N 2.82Å; F114-I118 HydrophobicContact CB-CD1 3.78Å; F114-I118 HydrophobicContact CD1-CD1 3.43Å; F114-I118 VanDerWaalsContact CD1-CD1 3.43Å; F114-I118 HydrophobicContact CD2-CD1 4.43Å; F114-I118 HydrophobicContact CE1-CD1 4.1Å; F114-I118 HydrophobicContact CG-CD1 3.63Å; F114-V123 HydrophobicContact CE2-CG1 3.89Å; F114-V123 HydrophobicContact CE2-CG2 3.98Å; F114-V123 HydrophobicContact CZ-CG1 3.9Å; F114-V123 HydrophobicContact CZ-CG2 4.14Å
115	S	66.3	Low	75.4	Confident	50 Å²	50	52.5 Å²	52.5	35%	0.35	26%	0.264	S	S	.	.	S	Bend	trans	-72.1	-10.6	178.1	61.4	0	0	0	0	113.7	F92	F92-S115 WeakPolarHBondContact CA-OG 3.3Å; F92-S115 PolarHBondContact O-N 2.94Å; F92-S115 PolarHBondContact O-OG 3.34Å
116	K	68.4	Low	76.5	Confident	107 Å²	107	50.6 Å²	50.6	47%	0.465	25%	0.248	S	C	.	.	S	Bend	trans	-139.2	159.2	174.3	-68.3	-169.3	174.1	-169.8	0	111.1	F92 F114 I118	F92-K116 HydrophobicContact CD1-CD 4.29Å; F92-K116 HydrophobicContact CD1-CG 4.42Å; F92-K116 HydrophobicContact CE1-CD 4.14Å; F114-K116 WeakPolarHBondContact CB-O 3.26Å; F114-K116 PolarHBondContact O-N 2.82Å; K116-I118 PolarHBondContact O-N 3.31Å
117	L	66.4	Low	76.9	Confident	120 Å²	120	50.5 Å²	50.5	63%	0.628	25%	0.247	S	C	*	.			trans	-65.4	115.8	170.2	-85.2	149.7	0	0	0	110.3	A43	A43-L117 HydrophobicContact CB-CD2 3.8Å; A43-L117 HydrophobicContact CB-CG 4.22Å
118	I	70.3	Confident	77.2	Confident	28 Å²	28	53.4 Å²	53.4	14%	0.144	26%	0.257	C	S	.	.			trans	-120.7	139.5	177.8	-58.7	161.9	0	0	0	108	L89 F92 F114 K116 E122 V123	L89-I118 HydrophobicContact CD1-CG2 4.13Å; L89-I118 HydrophobicContact CD2-CD1 4.07Å; L89-I118 HydrophobicContact CD2-CG2 4.16Å; F92-I118 HydrophobicContact CB-CD1 4Å; F114-I118 HydrophobicContact CB-CD1 3.78Å; F114-I118 HydrophobicContact CD1-CD1 3.43Å; F114-I118 VanDerWaalsContact CD1-CD1 3.43Å; F114-I118 HydrophobicContact CD2-CD1 4.43Å; F114-I118 HydrophobicContact CE1-CD1 4.1Å; F114-I118 HydrophobicContact CG-CD1 3.63Å; K116-I118 PolarHBondContact O-N 3.31Å; I118-E122 HydrophobicContact CG2-CB 4.34Å; I118-E122 HydrophobicContact CG2-CG 4.49Å; I118-V123 HydrophobicContact CB-CG2 4.06Å; I118-V123 HydrophobicContact CG2-CG2 3.61Å
119	D	75.8	Confident	77.1	Confident	103 Å²	103	55.5 Å²	55.5	55%	0.551	27%	0.274	S	S	*	.			trans	-62	136.3	179.6	-174.6	51.3	0	0	0	111.4	K121 E122 V123	D119-K121 PolarHBondContact O-N 3.49Å; D119-K121 WeakPolarHBondContact OD2-CB 3.3Å; D119-K121 PolarHBondContact OD2-N 3.02Å; D119-E122 HydrophobicContact CB-CB 4.37Å; D119-E122 PolarHBondContact O-N 3.48Å; D119-E122 VanDerWaalsContact O-N 3.11Å; D119-V123 PolarHBondContact O-N 2.94Å; D119-V123 VanDerWaalsContact O-N 3.16Å
120	T	77.8	Confident	76.8	Confident	41 Å²	41	53.6 Å²	53.6	25%	0.252	26%	0.263	S	S	.	.	H	α-helix	trans	-63.2	-30.4	-174.2	52	0	0	0	0	112.6	L45 E124 I148	L45-T120 HydrophobicContact CD1-CG2 4.32Å; L45-T120 HydrophobicContact CD2-CG2 3.68Å; T120-E124 WeakPolarHBondContact O-CB 3.43Å; T120-E124 PolarHBondContact O-N 2.91Å; T120-E124 VanDerWaalsContact O-N 3.08Å; T120-I148 HydrophobicContact CG2-CG2 4.22Å
121	K	77.3	Confident	76.6	Confident	152 Å²	152	54.3 Å²	54.3	66%	0.661	27%	0.267	S	S	*	.	H	α-helix	trans	-72.3	-35.1	177.3	-68.2	-172.6	174.3	-176.9	0	112.4	D119 E124 Q125	D119-K121 PolarHBondContact O-N 3.49Å; D119-K121 WeakPolarHBondContact OD2-CB 3.3Å; D119-K121 PolarHBondContact OD2-N 3.02Å; K121-E124 PolarHBondContact O-N 3.26Å; K121-Q125 WeakPolarHBondContact O-CB 3.01Å; K121-Q125 PolarHBondContact O-N 2.9Å
122	E	79.1	Confident	76.3	Confident	74 Å²	74	59.7 Å²	59.7	35%	0.346	29%	0.292	S	S	.	.	H	α-helix	trans	-66.5	-45	176.2	-172.4	59.5	-146.3	0	0	110.5	L89 I118 D119 E124 Q125 Q126	L89-E122 HydrophobicContact CD1-CG 4.44Å; I118-E122 HydrophobicContact CG2-CB 4.34Å; I118-E122 HydrophobicContact CG2-CG 4.49Å; D119-E122 HydrophobicContact CB-CB 4.37Å; D119-E122 PolarHBondContact O-N 3.48Å; D119-E122 VanDerWaalsContact O-N 3.11Å; E122-E124 VanDerWaalsContact C-N 3.31Å; E122-E124 PolarHBondContact O-N 3.25Å; E122-Q125 PolarHBondContact O-N 3.33Å; E122-Q126 HydrophobicContact CG-CG 4.44Å; E122-Q126 WeakPolarHBondContact O-CB 3.23Å; E122-Q126 VanDerWaalsContact O-CG 3.24Å; E122-Q126 WeakPolarHBondContact O-CG 3.24Å; E122-Q126 PolarHBondContact O-N 3Å; E122-Q126 WeakPolarHBondContact OE1-CG 3.46Å; E122-Q126 PolarHBondContact OE1-NE2 3.49Å
123	V	79.2	Confident	75.9	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-59.7	-42.7	175	178.5	0	0	0	0	111.3	L45 F84 L89 L112 F114 I118 D119 L127 I148	L45-V123 HydrophobicContact CD1-CB 4.47Å; L45-V123 HydrophobicContact CD1-CG2 3.92Å; F84-V123 HydrophobicContact CE1-CG1 4.22Å; F84-V123 HydrophobicContact CZ-CG1 3.84Å; L89-V123 HydrophobicContact CD1-CG2 4.19Å; L112-V123 HydrophobicContact CD1-CG1 3.84Å; F114-V123 HydrophobicContact CE2-CG1 3.89Å; F114-V123 HydrophobicContact CE2-CG2 3.98Å; F114-V123 HydrophobicContact CZ-CG1 3.9Å; F114-V123 HydrophobicContact CZ-CG2 4.14Å; I118-V123 HydrophobicContact CB-CG2 4.06Å; I118-V123 HydrophobicContact CG2-CG2 3.61Å; D119-V123 PolarHBondContact O-N 2.94Å; D119-V123 VanDerWaalsContact O-N 3.16Å; V123-L127 VanDerWaalsContact O-CB 3.26Å; V123-L127 WeakPolarHBondContact O-CB 3.17Å; V123-L127 PolarHBondContact O-N 3.46Å; V123-I148 HydrophobicContact CG1-CG1 4.33Å
124	E	81.4	Confident	75.2	Confident	42 Å²	42	61.2 Å²	61.2	20%	0.196	32%	0.316	C	S	.	.	H	α-helix	trans	-64.3	-43.3	177.7	-169.5	-176.7	154.3	0	0	112.2	T120 K121 E122 R128 I146 I148	T120-E124 WeakPolarHBondContact O-CB 3.43Å; T120-E124 PolarHBondContact O-N 2.91Å; T120-E124 VanDerWaalsContact O-N 3.08Å; K121-E124 PolarHBondContact O-N 3.26Å; E122-E124 VanDerWaalsContact C-N 3.31Å; E122-E124 PolarHBondContact O-N 3.25Å; E124-R128 WeakPolarHBondContact O-CB 3.38Å; E124-R128 VanDerWaalsContact O-CG 3.25Å; E124-R128 WeakPolarHBondContact O-CG 3.47Å; E124-R128 PolarHBondContact O-N 3.37Å; E124-R128 IonicContact OE1-CZ 2.69Å; E124-R128 VanDerWaalsContact OE1-CZ 3.32Å; E124-R128 IonicContact OE1-NE 2.69Å; E124-R128 PolarHBondContact OE1-NE 2.97Å; E124-R128 IonicContact OE1-NH2 3.32Å; E124-R128 PolarHBondContact OE1-NH2 3.38Å; E124-I146 HydrophobicContact CG-CG2 4.28Å; E124-I148 HydrophobicContact CB-CB 4.48Å; E124-I148 HydrophobicContact CB-CG1 3.96Å; E124-I148 HydrophobicContact CG-CG1 4.37Å
125	Q	81.7	Confident	74.2	Confident	128 Å²	128	64.6 Å²	64.6	60%	0.598	35%	0.351	S	S	*	.	H	α-helix	trans	-67.7	-42.5	-179.3	-174.5	172.8	-22.1	0	0	112.1	K121 E122 R128 A129	K121-Q125 WeakPolarHBondContact O-CB 3.01Å; K121-Q125 PolarHBondContact O-N 2.9Å; E122-Q125 PolarHBondContact O-N 3.33Å; Q125-R128 PolarHBondContact O-N 3.5Å; Q125-A129 PolarHBondContact O-N 3.12Å
126	Q	80.7	Confident	73.3	Confident	34 Å²	34	66 Å²	66	16%	0.159	37%	0.373	C	S	.	.	H	α-helix	trans	-68.2	-40.1	178.5	-67.1	-69.4	-18.2	0	0	111.6	L89 E122 A129 G130	L89-Q126 HydrophobicContact CD1-CB 4.04Å; L89-Q126 HydrophobicContact CD1-CG 3.87Å; L89-Q126 HydrophobicContact CG-CG 4.18Å; E122-Q126 HydrophobicContact CG-CG 4.44Å; E122-Q126 WeakPolarHBondContact O-CB 3.23Å; E122-Q126 VanDerWaalsContact O-CG 3.24Å; E122-Q126 WeakPolarHBondContact O-CG 3.24Å; E122-Q126 PolarHBondContact O-N 3Å; E122-Q126 WeakPolarHBondContact OE1-CG 3.46Å; E122-Q126 PolarHBondContact OE1-NE2 3.49Å; Q126-A129 PolarHBondContact O-N 3.45Å; Q126-G130 PolarHBondContact O-N 3.02Å
127	L	80.5	Confident	72.8	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-64	-41.8	174.9	-175.6	59.4	0	0	0	111.4	V80 A83 F84 F110 V123 A129 G130 L131 I146 I148	V80-L127 HydrophobicContact CG1-CD1 4.22Å; A83-L127 HydrophobicContact CB-CD1 3.83Å; F84-L127 HydrophobicContact CD2-CD1 4.29Å; F84-L127 HydrophobicContact CE1-CB 4.31Å; F84-L127 HydrophobicContact CE2-CD1 3.78Å; F84-L127 HydrophobicContact CZ-CB 3.93Å; F84-L127 HydrophobicContact CZ-CD1 3.99Å; F84-L127 HydrophobicContact CZ-CD2 4.41Å; F84-L127 HydrophobicContact CZ-CG 4.32Å; F110-L127 HydrophobicContact CE2-CD2 4.33Å; F110-L127 HydrophobicContact CZ-CD2 4.05Å; V123-L127 VanDerWaalsContact O-CB 3.26Å; V123-L127 WeakPolarHBondContact O-CB 3.17Å; V123-L127 PolarHBondContact O-N 3.46Å; L127-A129 PolarHBondContact O-N 2.98Å; L127-G130 PolarHBondContact O-N 2.96Å; L127-L131 HydrophobicContact CD1-CD1 3.88Å; L127-L131 HydrophobicContact CD1-CG 4.07Å; L127-L131 HydrophobicContact CG-CD1 3.8Å; L127-L131 HydrophobicContact CG-CG 4.41Å; L127-L131 WeakPolarHBondContact O-CB 3.37Å; L127-L131 WeakPolarHBondContact O-CD1 3.36Å; L127-L131 WeakPolarHBondContact O-CG 3.41Å; L127-L131 PolarHBondContact O-N 3.3Å; L127-I146 HydrophobicContact CD2-CG2 4.03Å; L127-I148 HydrophobicContact CD2-CD1 4.41Å
128	R	81.8	Confident	72.5	Confident	71 Å²	71	62.5 Å²	62.5	27%	0.268	39%	0.387	S	S	.	.	H	α-helix	trans	-60.1	-43.8	174.3	-74.6	171.6	-177	-135	1.3	112.1	E124 Q125 Q132 I143 I146	E124-R128 WeakPolarHBondContact O-CB 3.38Å; E124-R128 VanDerWaalsContact O-CG 3.25Å; E124-R128 WeakPolarHBondContact O-CG 3.47Å; E124-R128 PolarHBondContact O-N 3.37Å; E124-R128 IonicContact OE1-CZ 2.69Å; E124-R128 VanDerWaalsContact OE1-CZ 3.32Å; E124-R128 IonicContact OE1-NE 2.69Å; E124-R128 PolarHBondContact OE1-NE 2.97Å; E124-R128 IonicContact OE1-NH2 3.32Å; E124-R128 PolarHBondContact OE1-NH2 3.38Å; Q125-R128 PolarHBondContact O-N 3.5Å; R128-Q132 WeakPolarHBondContact O-CG 3.38Å; R128-Q132 PolarHBondContact O-N 3.1Å; R128-Q132 VanDerWaalsContact O-N 3.17Å; R128-I143 HydrophobicContact CB-CG2 3.92Å; R128-I143 HydrophobicContact CG-CG2 3.85Å; R128-I146 HydrophobicContact CG-CB 4.48Å; R128-I146 HydrophobicContact CG-CD1 4Å; R128-I146 PolarHBondContact NH2-O 3.27Å
129	A	78.6	Confident	72.5	Confident	45 Å²	45	62.7 Å²	62.7	37%	0.372	39%	0.388	S	S	.	.	H	α-helix	trans	-67.1	-44.4	179.1	0	0	0	0	0	111.9	Q125 Q126 L127 L131 Q132 V133	Q125-A129 PolarHBondContact O-N 3.12Å; Q126-A129 PolarHBondContact O-N 3.45Å; L127-A129 PolarHBondContact O-N 2.98Å; A129-L131 PolarHBondContact O-N 2.93Å; A129-Q132 PolarHBondContact O-N 3.31Å; A129-V133 PolarHBondContact O-N 3.46Å
130	G	76	Confident	72.5	Confident	4 Å²	4	61.1 Å²	61.1	4%	0.041	38%	0.382	C	S	.	.	H	α-helix	trans	-61.6	-42.4	177.7	0	0	0	0	0	112.6	A83 Q126 L127 Q132 V133 A134	A83-G130 WeakPolarHBondContact O-CA 3.39Å; Q126-G130 PolarHBondContact O-N 3.02Å; L127-G130 PolarHBondContact O-N 2.96Å; G130-Q132 VanDerWaalsContact C-N 3.34Å; G130-Q132 PolarHBondContact O-N 2.88Å; G130-V133 PolarHBondContact O-N 3.26Å; G130-A134 VanDerWaalsContact O-CB 3.3Å; G130-A134 WeakPolarHBondContact O-CB 3.06Å; G130-A134 PolarHBondContact O-N 3.46Å
131	L	76.8	Confident	72.5	Confident	14 Å²	14	60.3 Å²	60.3	7%	0.073	38%	0.376	C	S	.	.	H	α-helix	trans	-69.9	-28.2	178.3	-67.5	170.4	0	0	0	113.5	L79 A83 L127 A129 V133 G135 I141 I146	L79-L131 HydrophobicContact CD2-CD2 3.12Å; L79-L131 HydrophobicContact CG-CD2 4.31Å; A83-L131 HydrophobicContact CB-CD2 3.75Å; A83-L131 HydrophobicContact CB-CG 3.83Å; L127-L131 HydrophobicContact CD1-CD1 3.88Å; L127-L131 HydrophobicContact CD1-CG 4.07Å; L127-L131 HydrophobicContact CG-CD1 3.8Å; L127-L131 HydrophobicContact CG-CG 4.41Å; L127-L131 WeakPolarHBondContact O-CB 3.37Å; L127-L131 WeakPolarHBondContact O-CD1 3.36Å; L127-L131 WeakPolarHBondContact O-CG 3.41Å; L127-L131 PolarHBondContact O-N 3.3Å; A129-L131 PolarHBondContact O-N 2.93Å; L131-V133 VanDerWaalsContact C-N 3.32Å; L131-G135 PolarHBondContact O-N 3.49Å; L131-I141 HydrophobicContact CD2-CD1 4.43Å; L131-I146 HydrophobicContact CD1-CD1 3.41Å; L131-I146 VanDerWaalsContact CD1-CD1 3.41Å
132	Q	74.4	Confident	72.5	Confident	136 Å²	136	55.9 Å²	55.9	64%	0.636	36%	0.359	S	S	*	.	H	α-helix	trans	-68.3	-31.6	172.5	-81.7	178.1	-13.9	0	0	112.7	R128 A129 G130 I143	R128-Q132 WeakPolarHBondContact O-CG 3.38Å; R128-Q132 PolarHBondContact O-N 3.1Å; R128-Q132 VanDerWaalsContact O-N 3.17Å; A129-Q132 PolarHBondContact O-N 3.31Å; G130-Q132 VanDerWaalsContact C-N 3.34Å; G130-Q132 PolarHBondContact O-N 2.88Å; Q132-I143 HydrophobicContact CG-CD1 3.55Å; Q132-I143 HydrophobicContact CG-CG1 4.5Å; Q132-I143 HydrophobicContact CG-CG2 4.44Å
133	V	71.4	Confident	72.4	Confident	107 Å²	107	54.5 Å²	54.5	65%	0.648	35%	0.354	S	S	*	.	H	α-helix	trans	-87.5	-36.4	-179.6	179.5	0	0	0	0	111.5	I86 A129 G130 L131 G135	I86-V133 HydrophobicContact CD1-CG1 4.38Å; A129-V133 PolarHBondContact O-N 3.46Å; G130-V133 PolarHBondContact O-N 3.26Å; L131-V133 VanDerWaalsContact C-N 3.32Å; V133-G135 PolarHBondContact O-N 3.04Å
134	A	61.8	Low	72.3	Confident	29 Å²	29	60.6 Å²	60.6	24%	0.24	39%	0.386	C	S	.	.	S	Bend	trans	-75.7	-3.8	178.7	0	0	0	0	0	114.1	G130 G136	G130-A134 VanDerWaalsContact O-CB 3.3Å; G130-A134 WeakPolarHBondContact O-CB 3.06Å; G130-A134 PolarHBondContact O-N 3.46Å; A134-G136 VanDerWaalsContact C-N 3.33Å; A134-G136 PolarHBondContact O-N 3.38Å
135	G	53.3	Low	72.1	Confident	72 Å²	72	59.7 Å²	59.7	74%	0.742	39%	0.385	S	S	*	.			trans	-66.8	76.5	-174.9	0	0	0	0	0	115	L131 V133	L131-G135 PolarHBondContact O-N 3.49Å; V133-G135 PolarHBondContact O-N 3.04Å
136	G	47	Very low	72	Confident	79 Å²	79	53.6 Å²	53.6	81%	0.814	36%	0.356	S	S	*	.			trans	-144.1	14.3	172.1	0	0	0	0	0	114.6	A134	A134-G136 VanDerWaalsContact C-N 3.33Å; A134-G136 PolarHBondContact O-N 3.38Å
137	G	57	Low	71.9	Confident	55 Å²	55	57.4 Å²	57.4	57%	0.567	37%	0.374	S	S	*	.	S	Bend	trans	-100.3	168.3	177	0	0	0	0	0	114	L139	G137-L139 PolarHBondContact O-N 3.04Å
138	A	60	Low	72	Confident	98 Å²	98	58 Å²	58	81%	0.81	38%	0.377	S	S	*	.	S	Bend	trans	-66.6	-1.7	-175.1	0	0	0	0	0	116.1
139	L	71.1	Confident	71.8	Confident	33 Å²	33	58.9 Å²	58.9	17%	0.173	39%	0.39	C	S	.	.			trans	-113.6	125.3	-177.5	-62.2	173.7	0	0	0	110.5	V55 L72 D75 G137	V55-L139 HydrophobicContact CG2-CD2 3.27Å; L72-L139 HydrophobicContact CD1-CD1 4.3Å; L72-L139 HydrophobicContact CD1-CD2 4.49Å; D75-L139 HydrophobicContact CB-CD1 4.28Å; G137-L139 PolarHBondContact O-N 3.04Å
140	V	74.9	Confident	71.1	Confident	69 Å²	69	59 Å²	59	42%	0.418	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	115.3	177.3	-173.1	0	0	0	0	109.6	T52 E53	T52-V140 PolarHBondContact N-O 2.59Å; T52-V140 PolarHBondContact OG1-O 2.94Å; E53-V140 HydrophobicContact CB-CB 3.96Å; E53-V140 HydrophobicContact CB-CG2 4Å; E53-V140 PolarHBondContact N-O 3.05Å; E53-V140 PolarHBondContact O-N 2.96Å
141	I	77.8	Confident	70	Confident	24 Å²	24	65 Å²	65	12%	0.123	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	133.4	-179.5	-59	171.8	0	0	0	109.6	L49 I51 L79 L131 I143	L49-I141 HydrophobicContact CB-CG2 4.29Å; L49-I141 HydrophobicContact CD1-CD1 4.36Å; L49-I141 HydrophobicContact CD1-CG1 4.41Å; L49-I141 HydrophobicContact CD1-CG2 3.98Å; I51-I141 HydrophobicContact CG1-CG1 4.42Å; L79-I141 HydrophobicContact CD1-CD1 4.24Å; L79-I141 HydrophobicContact CD2-CD1 3.47Å; L79-I141 VanDerWaalsContact CD2-CD1 3.47Å; L131-I141 HydrophobicContact CD2-CD1 4.43Å; I141-I143 PolarHBondContact O-N 3.21Å; I141-I143 VanDerWaalsContact O-N 3.07Å
142	D	78.6	Confident	67.9	Low	60 Å²	60	69.9 Å²	69.9	32%	0.321	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	98.5	168.4	179.1	9.3	0	0	0	109.6	V50 T52 N144 S145	V50-D142 PolarHBondContact O-N 2.98Å; T52-D142 HydrophobicContact CG2-CB 3.77Å; D142-N144 PolarHBondContact O-N 3.33Å; D142-N144 VanDerWaalsContact O-N 3.1Å; D142-N144 WeakPolarHBondContact OD1-CB 3.24Å; D142-N144 PolarHBondContact OD1-N 2.96Å; D142-S145 VanDerWaalsContact O-CB 3.31Å; D142-S145 WeakPolarHBondContact O-CB 3.4Å; D142-S145 PolarHBondContact O-N 3.42Å; D142-S145 PolarHBondContact O-OG 3.41Å
143	I	77	Confident	65.8	Low	44 Å²	44	70.1 Å²	70.1	23%	0.226	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	-26.4	-178.4	-62	152.1	0	0	0	112	R128 Q132 I141 S145 I146	R128-I143 HydrophobicContact CB-CG2 3.92Å; R128-I143 HydrophobicContact CG-CG2 3.85Å; Q132-I143 HydrophobicContact CG-CD1 3.55Å; Q132-I143 HydrophobicContact CG-CG1 4.5Å; Q132-I143 HydrophobicContact CG-CG2 4.44Å; I141-I143 PolarHBondContact O-N 3.21Å; I141-I143 VanDerWaalsContact O-N 3.07Å; I143-S145 VanDerWaalsContact C-N 3.27Å; I143-S145 PolarHBondContact O-N 2.95Å; I143-I146 HydrophobicContact CG2-CD1 4.39Å; I143-I146 WeakPolarHBondContact O-CG1 3.18Å
144	N	76.5	Confident	63.6	Low	128 Å²	128	72.9 Å²	72.9	68%	0.684	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.7	-12.8	178.8	-63.4	-49.6	0	0	0	113.3	D142 I146	D142-N144 PolarHBondContact O-N 3.33Å; D142-N144 VanDerWaalsContact O-N 3.1Å; D142-N144 WeakPolarHBondContact OD1-CB 3.24Å; D142-N144 PolarHBondContact OD1-N 2.96Å; N144-I146 VanDerWaalsContact C-N 3.35Å
145	S	76.6	Confident	61.8	Low	23 Å²	23	77 Å²	77	16%	0.161	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-7	179.3	76	0	0	0	0	114	V50 D142 I143 Q147	V50-S145 WeakPolarHBondContact CB-OG 3.4Å; V50-S145 PolarHBondContact N-OG 3.03Å; D142-S145 VanDerWaalsContact O-CB 3.31Å; D142-S145 WeakPolarHBondContact O-CB 3.4Å; D142-S145 PolarHBondContact O-N 3.42Å; D142-S145 PolarHBondContact O-OG 3.41Å; I143-S145 VanDerWaalsContact C-N 3.27Å; I143-S145 PolarHBondContact O-N 2.95Å; S145-Q147 PolarHBondContact O-N 3.47Å
146	I	80.3	Confident	60.5	Low	0 Å²	0	82.6 Å²	82.6	0%	0	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	125.8	-175.6	-58	172.7	0	0	0	110.3	R48 L49 E124 L127 R128 L131 I143 N144	R48-I146 CarbonylContact O-C 3.52Å; R48-I146 VanDerWaalsContact O-CA 3.26Å; R48-I146 WeakPolarHBondContact O-CA 3.47Å; L49-I146 HydrophobicContact CB-CG1 4.09Å; E124-I146 HydrophobicContact CG-CG2 4.28Å; L127-I146 HydrophobicContact CD2-CG2 4.03Å; R128-I146 HydrophobicContact CG-CB 4.48Å; R128-I146 HydrophobicContact CG-CD1 4Å; R128-I146 PolarHBondContact NH2-O 3.27Å; L131-I146 HydrophobicContact CD1-CD1 3.41Å; L131-I146 VanDerWaalsContact CD1-CD1 3.41Å; I143-I146 HydrophobicContact CG2-CD1 4.39Å; I143-I146 WeakPolarHBondContact O-CG1 3.18Å; N144-I146 VanDerWaalsContact C-N 3.35Å
147	Q	78.8	Confident	60.4	Low	115 Å²	115	83.6 Å²	83.6	54%	0.537	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	134	175.1	-65.4	-172.3	-24.1	0	0	110.9	G47 R48 S145	G47-Q147 CarbonylContact C-O 3.43Å; G47-Q147 VanDerWaalsContact CA-O 3.29Å; G47-Q147 WeakPolarHBondContact CA-O 3.5Å; R48-Q147 PolarHBondContact N-O 3Å; R48-Q147 PolarHBondContact O-N 3.02Å; S145-Q147 PolarHBondContact O-N 3.47Å
148	I	82.6	Confident	58.8	Low	11 Å²	11	88 Å²	88	6%	0.056	51%	0.511	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	133.5	175.7	-54.1	-60.3	0	0	0	110.3	L45 S46 L112 T120 V123 E124 L127	L45-I148 HydrophobicContact CB-CG2 3.93Å; L45-I148 HydrophobicContact CD1-CG2 4.15Å; S46-I148 CarbonylContact O-C 3.28Å; S46-I148 WeakPolarHBondContact O-CA 3.32Å; L112-I148 HydrophobicContact CD1-CD1 3.98Å; T120-I148 HydrophobicContact CG2-CG2 4.22Å; V123-I148 HydrophobicContact CG1-CG1 4.33Å; E124-I148 HydrophobicContact CB-CB 4.48Å; E124-I148 HydrophobicContact CB-CG1 3.96Å; E124-I148 HydrophobicContact CG-CG1 4.37Å; L127-I148 HydrophobicContact CD2-CD1 4.41Å
149	T	77.4	Confident	57.2	Low	90 Å²	90	92.1 Å²	92.1	55%	0.552	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.6	142	178.1	45.7	0	0	0	0	111.6	S46	S46-T149 PolarHBondContact N-O 3.4Å; S46-T149 PolarHBondContact O-N 3.17Å; S46-T149 PolarHBondContact O-OG1 3.16Å
150	G	65	Low	55	Low	49 Å²	49	93.6 Å²	93.6	51%	0.505	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	138.2	176.6	0	0	0	0	0	112.6
151	K	52.5	Low	52.5	Low	130 Å²	130	96.4 Å²	96.4	57%	0.565	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-88.3	117.3	173.8	-79.6	177.7	177.8	169.6	0	110.6	E111	E111-K151 IonicContact OE1-NZ 2.75Å; E111-K151 PolarHBondContact OE1-NZ 2.97Å
152	S	32.1	Very low	49.9	Very low	116 Å²	116	98.9 Å²	98.9	81%	0.811	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-91.8	124.9	162.3	149.4	0	0	0	0	108.4
153	V	30	Very low	47.2	Very low	141 Å²	141	103.2 Å²	103.2	86%	0.855	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-97.6	121.3	175	178.9	0	0	0	0	108.9
154	M	24.6	Very low	44.6	Very low	165 Å²	165	107.7 Å²	107.7	81%	0.813	64%	0.644	S	S	*	*			trans	-140.3	126.6	165.7	-149.8	164.4	79.1	0	0	111.8
155	S	25.9	Very low	42.3	Very low	114 Å²	114	110.2 Å²	110.2	80%	0.797	65%	0.651	S	S	*	*			trans	78.6	143.3	154.2	60.8	0	0	0	0	122.8
156	H	25.5	Very low	40.5	Very low	191 Å²	191	114.5 Å²	114.5	88%	0.884	68%	0.678	S	S	*	*			trans	-76.3	175.2	-168.3	-126	21.7	0	0	0	114.6
157	P	45.4	Very low	37.8	Very low	100 Å²	100	119 Å²	119	65%	0.649	72%	0.715	S	S	*	*			trans	-90	154.5	-151	37.3	-36.5	0	0	0	113.9
158	D	23	Very low	35.1	Very low	146 Å²	146	117.1 Å²	117.1	78%	0.781	72%	0.72	S	S	*	*			trans	-149.2	128	153.2	-108.7	-27.2	0	0	0	112.7
159	Q	26.6	Very low	32.2	Very low	185 Å²	185	124.4 Å²	124.4	86%	0.864	76%	0.758	S	S	*	*			trans	39.3	130.5	143.6	-64.6	-179.9	2.1	0	0	121.6
160	G	23.2	Very low	29.5	Very low	65 Å²	65	125.1 Å²	125.1	67%	0.67	77%	0.765	S	S	*	*				135.3	97.6	128.2	0	0	0	0	0	116.8
161	S	23.5	Very low	27.4	Very low	128 Å²	128	129.1 Å²	129.1	90%	0.895	78%	0.78	S	S	*	*				48.2	132	128.2	65.1	0	0	0	0	121
162	G	22.9	Very low	26.7	Very low	75 Å²	75	128.4 Å²	128.4	77%	0.773	79%	0.789	S	S	*	*			trans	158.6	95.5	146	0	0	0	0	0	114.7
163	D	23	Very low	26.3	Very low	151 Å²	151	127.1 Å²	127.1	81%	0.807	79%	0.785	S	S	*	*			trans	-42.7	144.4	159.4	-69.7	-55.9	0	0	0	112.5
164	T	22.2	Very low	26	Very low	139 Å²	139	128.6 Å²	128.6	85%	0.853	78%	0.782	S	S	*	*				164.5	115.7	107	24.7	0	0	0	0	111.6
165	Q	27.2	Very low	26	Very low	181 Å²	181	129.4 Å²	129.4	85%	0.846	78%	0.781	S	S	*	*			trans	-68.9	175.5	140.5	-118.8	172.1	-20	0	0	108.6
166	P	38	Very low	26.1	Very low	112 Å²	112	132.4 Å²	132.4	73%	0.727	79%	0.787	S	S	*	*			cis	-145	-160	-0.4	32.4	-6.9	0	0	0	113.6
167	A	23.7	Very low	26.2	Very low	94 Å²	94	132 Å²	132	78%	0.777	79%	0.786	S	S	*	*			trans	85.1	146.3	148.5	0	0	0	0	0	117.7
168	A	23.8	Very low	25.3	Very low	77 Å²	77	136.6 Å²	136.6	64%	0.636	80%	0.796	S	S	*	*			cis	-179.8	173.7	-9.9	0	0	0	0	0	107.8
169	L	21.5	Very low	25.4	Very low	164 Å²	164	135.5 Å²	135.5	86%	0.859	79%	0.794	S	S	*	*			trans	78.6	149.8	155.4	-59.9	140.3	0	0	0	117.3
170	C	19.5	Very low	25.5	Very low	104 Å²	104	132.7 Å²	132.7	70%	0.703	79%	0.79	S	S	*	*			cis	177.6	122.6	-30.9	-104.5	0	0	0	0	104.3
171	V	22.2	Very low	26.2	Very low	134 Å²	134	134.3 Å²	134.3	81%	0.812	79%	0.789	S	S	*	*				44.1	153.1	124.9	-172.1	0	0	0	0	119.3
172	P	36.7	Very low	26.7	Very low	115 Å²	115	134.1 Å²	134.1	75%	0.747	78%	0.782	S	S	*	*			cis	-140.1	-174.7	1.2	23.1	3.5	0	0	0	117.8
173	A	23.2	Very low	27.7	Very low	89 Å²	89	135.2 Å²	135.2	74%	0.736	79%	0.785	S	S	*	*			trans	100.1	132.2	143.3	0	0	0	0	0	116.2
174	E	24.4	Very low	28.9	Very low	171 Å²	171	132.9 Å²	132.9	80%	0.799	77%	0.77	S	S	*	*			cis	-165	138.3	24.9	-138	171.9	179.2	0	0	112
175	K	24.2	Very low	30.4	Very low	182 Å²	182	132.9 Å²	132.9	79%	0.791	77%	0.77	S	S	*	*			trans	34.4	123.5	146.9	-80.5	173.5	171.3	168.6	0	122.9
176	L	27.6	Very low	32.1	Very low	177 Å²	177	125.8 Å²	125.8	93%	0.927	74%	0.74	S	S	*	*				-159.4	121	106.7	-157.2	72	0	0	0	111.4
177	E	27.3	Very low	33.4	Very low	182 Å²	182	124 Å²	124	85%	0.85	73%	0.728	S	S	*	*			trans	-87.8	139	178.1	-71.8	176.1	147.7	0	0	112.6
178	K	27	Very low	35.2	Very low	197 Å²	197	126.1 Å²	126.1	86%	0.857	73%	0.734	S	S	*	*			trans	-169.5	94.3	131.6	-109.8	176.1	178.9	-179.4	0	111.6
179	T	24.8	Very low	36.8	Very low	123 Å²	123	125 Å²	125	76%	0.755	73%	0.73	S	S	*	*			trans	14.1	134.8	137.8	49.8	0	0	0	0	118.4
180	T	29.2	Very low	39.2	Very low	126 Å²	126	121 Å²	121	77%	0.773	71%	0.707	S	S	*	*			cis	-178.3	173.8	16.1	10.8	0	0	0	0	106.4
181	P	37.3	Very low	41.6	Very low	99 Å²	99	118.4 Å²	118.4	64%	0.643	69%	0.688	S	S	*	*			cis	-119.8	159.2	10.2	31.8	-12	0	0	0	114.9	A183	P181-A183 PolarHBondContact O-N 3.4Å
182	T	34.6	Very low	43.8	Very low	124 Å²	124	114.1 Å²	114.1	76%	0.761	67%	0.667	S	S	*	*			trans	-56.7	119.5	172.3	34.9	0	0	0	0	111.9	M184	T182-M184 PolarHBondContact O-N 3.11Å
183	A	43.9	Very low	45.5	Very low	99 Å²	99	109 Å²	109	82%	0.818	63%	0.634	S	S	*	*			trans	-62.1	114.4	165.5	0	0	0	0	0	109.1	P181	P181-A183 PolarHBondContact O-N 3.4Å
184	M	48.8	Very low	47.6	Very low	102 Å²	102	109.3 Å²	109.3	50%	0.502	63%	0.631	S	S	.	*			trans	-69.9	126.6	176.6	-165.4	171.6	-170.8	0	0	108.9	T182	T182-M184 PolarHBondContact O-N 3.11Å
185	T	54.4	Low	49.2	Very low	139 Å²	139	106.6 Å²	106.6	85%	0.853	62%	0.621	S	S	*	*			trans	-86.6	113.4	174.6	45.3	0	0	0	0	110
186	C	61.2	Low	51	Low	32 Å²	32	99.2 Å²	99.2	22%	0.216	60%	0.597	C	S	.	*	P	Polyproline II helix	trans	-85.8	152.4	179.5	-57.3	0	0	0	0	112.3	Q190 C199	C186-Q190 HydrophobicContact CB-CB 3.85Å; C186-Q190 VanDerWaalsContact CB-O 3.31Å; C186-Q190 WeakPolarHBondContact CB-O 3.44Å; C186-C199 WeakPolarHBondContact CA-SG 3.29Å; C186-C199 HydrophobicContact CB-CB 3.69Å; C186-C199 WeakPolarHBondContact CB-SG 3.28Å; C186-C199 VanDerWaalsContact SG-CA 3.56Å; C186-C199 WeakPolarHBondContact SG-CB 3.3Å; C186-C199 CovalentContact SG-SG 2.02Å; C186-C199 PolarHBondContact SG-SG 3.17Å
187	P	66.6	Low	52.5	Low	73 Å²	73	93.6 Å²	93.6	47%	0.474	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-59.8	160	173.3	-18.7	30	0	0	0	112.9	G189 Q190	P187-G189 PolarHBondContact O-N 3.01Å; P187-Q190 PolarHBondContact O-N 3.4Å
188	P	60.2	Low	54.4	Low	140 Å²	140	86 Å²	86	91%	0.909	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	124.4	176.5	22.5	-31.6	0	0	0	111
189	G	59	Low	56.6	Low	53 Å²	53	78.3 Å²	78.3	55%	0.546	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.4	-2.5	-175.3	0	0	0	0	0	115.1	P187 S202	P187-G189 PolarHBondContact O-N 3.01Å; G189-S202 PolarHBondContact O-N 3.29Å; G189-S202 PolarHBondContact O-OG 3.07Å
190	Q	70.4	Confident	58.8	Low	79 Å²	79	73 Å²	73	37%	0.369	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	139.5	175.7	-65.2	-177.4	-2.7	0	0	111.9	C186 P187 C199 V200	C186-Q190 HydrophobicContact CB-CB 3.85Å; C186-Q190 VanDerWaalsContact CB-O 3.31Å; C186-Q190 WeakPolarHBondContact CB-O 3.44Å; P187-Q190 PolarHBondContact O-N 3.4Å; Q190-C199 HydrophobicContact CB-CB 4.19Å; Q190-V200 CarbonylContact C-O 3.58Å; Q190-V200 WeakPolarHBondContact CA-O 3.24Å; Q190-V200 WeakPolarHBondContact CB-O 3.41Å
191	T	70.4	Confident	60.7	Low	50 Å²	50	68.5 Å²	68.5	31%	0.307	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	143	177.5	40.4	0	0	0	0	110.6	V200	T191-V200 PolarHBondContact N-O 3.16Å; T191-V200 WeakPolarHBondContact O-CG2 3.47Å; T191-V200 PolarHBondContact O-N 2.94Å; T191-V200 PolarHBondContact OG1-O 3.44Å
192	A	68.1	Low	62.1	Low	45 Å²	45	66.6 Å²	66.6	37%	0.372	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	137.6	-179.2	0	0	0	0	0	111.4
193	C	73	Confident	63.5	Low	7 Å²	7	66 Å²	66	5%	0.047	44%	0.435	C	S	.	.			trans	-65.3	149.1	169.2	-56.8	0	0	0	0	110.6	D195 G196 G198 C212	C193-D195 PolarHBondContact O-N 3.49Å; C193-D195 VanDerWaalsContact O-N 3.17Å; C193-G196 PolarHBondContact O-N 2.88Å; C193-G198 PolarHBondContact N-O 2.93Å; C193-C212 HydrophobicContact CB-CB 3.78Å; C193-C212 WeakPolarHBondContact CB-SG 3.44Å; C193-C212 WeakPolarHBondContact SG-CB 3.47Å; C193-C212 CovalentContact SG-SG 2.04Å; C193-C212 PolarHBondContact SG-SG 2Å
194	S	67	Low	64.6	Low	96 Å²	96	66 Å²	66	67%	0.671	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-33.7	-174.1	-52.5	0	0	0	0	113.9	G196 S216	S194-G196 VanDerWaalsContact C-N 3.32Å; S194-G196 PolarHBondContact O-N 3.01Å; S194-S216 WeakPolarHBondContact CB-OG 3.26Å; S194-S216 VanDerWaalsContact OG-CB 3.24Å; S194-S216 WeakPolarHBondContact OG-CB 3.49Å; S194-S216 PolarHBondContact OG-OG 2.87Å
195	D	59	Low	65.5	Low	114 Å²	114	63.5 Å²	63.5	61%	0.61	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-1.8	177.4	-82.7	-11.9	0	0	0	114.6	C193 S197 D214	C193-D195 PolarHBondContact O-N 3.49Å; C193-D195 VanDerWaalsContact O-N 3.17Å; D195-S197 PolarHBondContact O-N 3.33Å; D195-D214 PolarHBondContact N-OD2 2.95Å
196	G	61.4	Low	66.2	Low	26 Å²	26	57.5 Å²	57.5	27%	0.268	36%	0.364	S	S	.	.	S	Bend	trans	69.8	18.1	-177.7	0	0	0	0	0	114.3	C193 S194 G198	C193-G196 PolarHBondContact O-N 2.88Å; S194-G196 VanDerWaalsContact C-N 3.32Å; S194-G196 PolarHBondContact O-N 3.01Å; G196-G198 VanDerWaalsContact C-N 3.33Å; G196-G198 PolarHBondContact O-N 3.07Å
197	S	59.5	Low	66.4	Low	60 Å²	60	56.3 Å²	56.3	42%	0.42	36%	0.355	S	S	.	.	S	Bend	trans	-78.7	-9.7	-175.2	55.2	0	0	0	0	114.4	D195	D195-S197 PolarHBondContact O-N 3.33Å
198	G	67.6	Low	66.4	Low	21 Å²	21	52.9 Å²	52.9	22%	0.216	33%	0.333	C	S	.	.			trans	173.1	172.6	177.4	0	0	0	0	0	113.7	C193 G196	C193-G198 PolarHBondContact N-O 2.93Å; G196-G198 VanDerWaalsContact C-N 3.33Å; G196-G198 PolarHBondContact O-N 3.07Å
199	C	71.4	Confident	67	Low	36 Å²	36	48.4 Å²	48.4	24%	0.243	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	122.9	173	-65.7	0	0	0	0	108.7	C186 Q190	C186-C199 WeakPolarHBondContact CA-SG 3.29Å; C186-C199 HydrophobicContact CB-CB 3.69Å; C186-C199 WeakPolarHBondContact CB-SG 3.28Å; C186-C199 VanDerWaalsContact SG-CA 3.56Å; C186-C199 WeakPolarHBondContact SG-CB 3.3Å; C186-C199 CovalentContact SG-SG 2.02Å; C186-C199 PolarHBondContact SG-SG 3.17Å; Q190-C199 HydrophobicContact CB-CB 4.19Å
200	V	71.1	Confident	67.5	Low	12 Å²	12	49.5 Å²	49.5	7%	0.073	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	144.6	174.2	-81.9	0	0	0	0	109.8	Q190 T191 F205 D211	Q190-V200 CarbonylContact C-O 3.58Å; Q190-V200 WeakPolarHBondContact CA-O 3.24Å; Q190-V200 WeakPolarHBondContact CB-O 3.41Å; T191-V200 PolarHBondContact N-O 3.16Å; T191-V200 WeakPolarHBondContact O-CG2 3.47Å; T191-V200 PolarHBondContact O-N 2.94Å; T191-V200 PolarHBondContact OG1-O 3.44Å; V200-F205 HydrophobicContact CG2-CD2 4.35Å; V200-D211 HydrophobicContact CG1-CB 3.99Å
201	P	70.4	Confident	67.6	Low	31 Å²	31	48.7 Å²	48.7	20%	0.201	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.9	140.6	169.4	-25.9	36	0	0	0	112	N203 W204	P201-N203 WeakPolarHBondContact CB-OD1 3.4Å; P201-N203 PolarHBondContact O-N 3.46Å; P201-W204 HydrophobicContact CB-CD2 4.15Å; P201-W204 HydrophobicContact CB-CG 4.08Å; P201-W204 VanDerWaalsContact CD-CE3 3.47Å; P201-W204 HydrophobicContact CG-CD2 3.77Å; P201-W204 HydrophobicContact CG-CE3 3.92Å; P201-W204 HydrophobicContact CG-CG 4.24Å; P201-W204 HydrophobicContact CG-CH2 4.41Å; P201-W204 HydrophobicContact CG-CZ2 4.31Å; P201-W204 HydrophobicContact CG-CZ3 4.23Å; P201-W204 WeakPolarHBondContact O-CB 3.44Å; P201-W204 PolarHBondContact O-N 3.16Å
202	S	65.3	Low	67.5	Low	60 Å²	60	46.5 Å²	46.5	42%	0.42	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-62.6	-21.7	-174.5	-50.1	0	0	0	0	113.1	G189	G189-S202 PolarHBondContact O-N 3.29Å; G189-S202 PolarHBondContact O-OG 3.07Å
203	N	64.4	Low	67.4	Low	111 Å²	111	52 Å²	52	59%	0.594	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-81.4	-9.9	176.1	59.8	-51.1	0	0	0	114.1	P201	P201-N203 WeakPolarHBondContact CB-OD1 3.4Å; P201-N203 PolarHBondContact O-N 3.46Å
204	W	67.3	Low	67.1	Low	99 Å²	99	54 Å²	54	38%	0.375	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-95.3	-1.3	174.2	-65.1	-0.8	0	0	0	111.8	P201 D211	P201-W204 HydrophobicContact CB-CD2 4.15Å; P201-W204 HydrophobicContact CB-CG 4.08Å; P201-W204 VanDerWaalsContact CD-CE3 3.47Å; P201-W204 HydrophobicContact CG-CD2 3.77Å; P201-W204 HydrophobicContact CG-CE3 3.92Å; P201-W204 HydrophobicContact CG-CG 4.24Å; P201-W204 HydrophobicContact CG-CH2 4.41Å; P201-W204 HydrophobicContact CG-CZ2 4.31Å; P201-W204 HydrophobicContact CG-CZ3 4.23Å; P201-W204 WeakPolarHBondContact O-CB 3.44Å; P201-W204 PolarHBondContact O-N 3.16Å; W204-D211 WeakPolarHBondContact CB-OD2 3.24Å
205	F	68.1	Low	67	Low	50 Å²	50	52.2 Å²	52.2	22%	0.219	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	129.6	174.1	-143.3	-98.4	0	0	0	109.7	V200 D207 D217 R255	V200-F205 HydrophobicContact CG2-CD2 4.35Å; F205-D207 VanDerWaalsContact C-N 3.27Å; F205-D207 PolarHBondContact O-N 3.04Å; F205-D217 HydrophobicContact CD2-CB 3.78Å; F205-D217 HydrophobicContact CE2-CB 3.85Å; F205-D217 HydrophobicContact CG-CB 4.4Å; F205-D217 HydrophobicContact CZ-CB 4.49Å; F205-R255 PolarHBondContact O-NH2 2.98Å
206	C	69.5	Low	67.4	Low	13 Å²	13	47.7 Å²	47.7	9%	0.088	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.6	28.5	-177.9	-50.1	0	0	0	0	114	D217 E218 C223 F231 R255	C206-D217 WeakPolarHBondContact CA-O 3.27Å; C206-D217 PolarHBondContact N-O 3.19Å; C206-D217 PolarHBondContact SG-O 3.3Å; C206-E218 WeakPolarHBondContact CA-OE1 3.25Å; C206-E218 PolarHBondContact N-OE1 2.8Å; C206-C223 VanDerWaalsContact CA-SG 3.58Å; C206-C223 HydrophobicContact CB-CB 3.6Å; C206-C223 WeakPolarHBondContact CB-SG 3.44Å; C206-C223 WeakPolarHBondContact SG-CA 3.07Å; C206-C223 WeakPolarHBondContact SG-CB 3.5Å; C206-C223 CovalentContact SG-SG 2.02Å; C206-C223 PolarHBondContact SG-SG 3.39Å; C206-F231 HydrophobicContact CB-CE1 4.39Å; C206-F231 HydrophobicContact CB-CE2 3.84Å; C206-F231 HydrophobicContact CB-CZ 3.66Å; C206-F231 VanDerWaalsContact O-CE2 3.24Å; C206-F231 WeakPolarHBondContact O-CE2 3.41Å; C206-F231 WeakPolarHBondContact O-CZ 3.36Å; C206-R255 PolarHBondContact O-NE 3.32Å; C206-R255 PolarHBondContact O-NH1 3.23Å; C206-R255 PolarHBondContact O-NH2 3.46Å
207	D	65.6	Low	67.7	Low	7 Å²	7	46.5 Å²	46.5	4%	0.037	27%	0.27	C	S	.	.	S	Bend	trans	-86.7	-2.5	-178	83.6	-11.2	0	0	0	114.7	F205 V209 E218 G289	F205-D207 VanDerWaalsContact C-N 3.27Å; F205-D207 PolarHBondContact O-N 3.04Å; D207-V209 WeakPolarHBondContact OD1-CB 3.37Å; D207-V209 PolarHBondContact OD1-N 2.9Å; D207-E218 PolarHBondContact N-OE1 3.3Å; D207-G289 PolarHBondContact O-N 3Å
208	G	65	Low	68.3	Low	1 Å²	1	44.5 Å²	44.5	1%	0.01	25%	0.254	C	S	.	.	S	Bend	trans	92.5	-2.3	178.2	0	0	0	0	0	115.6	E218 R259	G208-E218 WeakPolarHBondContact CA-OE2 3.48Å; G208-E218 PolarHBondContact N-OE1 3.11Å; G208-E218 PolarHBondContact N-OE2 2.9Å; G208-R259 PolarHBondContact O-NH2 3.42Å
209	V	73.3	Confident	68.4	Low	46 Å²	46	45.5 Å²	45.5	28%	0.279	26%	0.258	S	S	.	.	S	Bend	trans	-108.9	126.7	175.4	-175.6	0	0	0	0	108.1	D207 D211 E218 V288	D207-V209 WeakPolarHBondContact OD1-CB 3.37Å; D207-V209 PolarHBondContact OD1-N 2.9Å; V209-D211 VanDerWaalsContact C-N 3.34Å; V209-D211 PolarHBondContact O-N 2.93Å; V209-E218 WeakPolarHBondContact O-CG 3.2Å; V209-V288 HydrophobicContact CG2-CB 4.43Å; V209-V288 HydrophobicContact CG2-CG2 4Å
210	P	69.4	Low	68.1	Low	75 Å²	75	48.2 Å²	48.2	49%	0.487	28%	0.275	S	S	.	.			trans	-73.1	92.1	174.1	29.4	-32.1	0	0	0	109.3	S215	P210-S215 WeakPolarHBondContact CB-OG 3.43Å
211	D	71.9	Confident	67.6	Low	62 Å²	62	56.9 Å²	56.9	33%	0.332	31%	0.312	S	S	.	.			trans	-87.7	-25.4	176.5	-71.5	-39.1	0	0	0	111.5	V200 W204 V209 D217	V200-D211 HydrophobicContact CG1-CB 3.99Å; W204-D211 WeakPolarHBondContact CB-OD2 3.24Å; V209-D211 VanDerWaalsContact C-N 3.34Å; V209-D211 PolarHBondContact O-N 2.93Å; D211-D217 WeakPolarHBondContact CA-OD2 3.32Å; D211-D217 WeakPolarHBondContact CB-OD2 3.45Å; D211-D217 PolarHBondContact N-OD2 2.72Å
212	C	68.6	Low	67.3	Low	4 Å²	4	58.3 Å²	58.3	3%	0.027	32%	0.323	C	S	.	.	S	Bend	trans	-81.2	140.1	165.9	-66.3	0	0	0	0	111.4	C193 D214 S215 D217	C193-C212 HydrophobicContact CB-CB 3.78Å; C193-C212 WeakPolarHBondContact CB-SG 3.44Å; C193-C212 WeakPolarHBondContact SG-CB 3.47Å; C193-C212 CovalentContact SG-SG 2.04Å; C193-C212 PolarHBondContact SG-SG 2Å; C212-D214 WeakPolarHBondContact CB-OD1 3.26Å; C212-D214 PolarHBondContact O-N 2.9Å; C212-D214 VanDerWaalsContact O-N 3.11Å; C212-S215 PolarHBondContact O-N 2.8Å; C212-D217 HydrophobicContact CB-CB 4.25Å; C212-D217 WeakPolarHBondContact CB-OD1 3.34Å; C212-D217 PolarHBondContact N-OD1 3.33Å; C212-D217 PolarHBondContact N-OD2 2.89Å
213	L	67.6	Low	67.4	Low	161 Å²	161	55.9 Å²	55.9	84%	0.843	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-23.3	180	-78.2	163	0	0	0	114.2
214	D	66.6	Low	67.3	Low	48 Å²	48	52.9 Å²	52.9	26%	0.257	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	2.1	177.2	63.4	-15.1	0	0	0	113	D195 C212 S216	D195-D214 PolarHBondContact N-OD2 2.95Å; C212-D214 WeakPolarHBondContact CB-OD1 3.26Å; C212-D214 PolarHBondContact O-N 2.9Å; C212-D214 VanDerWaalsContact O-N 3.11Å; D214-S216 PolarHBondContact O-N 2.78Å; D214-S216 VanDerWaalsContact OD1-CB 3.27Å; D214-S216 WeakPolarHBondContact OD1-CB 3.43Å; D214-S216 PolarHBondContact OD1-N 2.79Å; D214-S216 VanDerWaalsContact OD1-N 3.13Å; D214-S216 PolarHBondContact OD1-OG 2.82Å; D214-S216 VanDerWaalsContact OD2-CB 3.25Å; D214-S216 WeakPolarHBondContact OD2-CB 3.15Å; D214-S216 PolarHBondContact OD2-OG 2.82Å
215	S	64.3	Low	67.3	Low	59 Å²	59	48.6 Å²	48.6	41%	0.413	28%	0.281	S	S	.	.			trans	55.5	23.8	-172.2	-48.4	0	0	0	0	114.1	P210 C212 D217 E218	P210-S215 WeakPolarHBondContact CB-OG 3.43Å; C212-S215 PolarHBondContact O-N 2.8Å; S215-D217 WeakPolarHBondContact CA-OD1 3.46Å; S215-D217 PolarHBondContact O-N 2.9Å; S215-E218 PolarHBondContact O-N 2.8Å; S215-E218 VanDerWaalsContact O-N 3.11Å
216	S	66.8	Low	67.4	Low	20 Å²	20	50.4 Å²	50.4	14%	0.14	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-65	-29.1	-178.7	-88.6	0	0	0	0	113.9	S194 D214 E218 S219 S222	S194-S216 WeakPolarHBondContact CB-OG 3.26Å; S194-S216 VanDerWaalsContact OG-CB 3.24Å; S194-S216 WeakPolarHBondContact OG-CB 3.49Å; S194-S216 PolarHBondContact OG-OG 2.87Å; D214-S216 PolarHBondContact O-N 2.78Å; D214-S216 VanDerWaalsContact OD1-CB 3.27Å; D214-S216 WeakPolarHBondContact OD1-CB 3.43Å; D214-S216 PolarHBondContact OD1-N 2.79Å; D214-S216 VanDerWaalsContact OD1-N 3.13Å; D214-S216 PolarHBondContact OD1-OG 2.82Å; D214-S216 VanDerWaalsContact OD2-CB 3.25Å; D214-S216 WeakPolarHBondContact OD2-CB 3.15Å; D214-S216 PolarHBondContact OD2-OG 2.82Å; S216-E218 PolarHBondContact O-N 2.82Å; S216-S219 PolarHBondContact O-N 2.94Å; S216-S222 PolarHBondContact O-OG 3.48Å
217	D	68.4	Low	67.6	Low	0 Å²	0	50 Å²	50	0%	0	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-61.2	-21.1	172.1	53.9	-26.8	0	0	0	113.7	F205 C206 D211 C212 S215 C223	F205-D217 HydrophobicContact CD2-CB 3.78Å; F205-D217 HydrophobicContact CE2-CB 3.85Å; F205-D217 HydrophobicContact CG-CB 4.4Å; F205-D217 HydrophobicContact CZ-CB 4.49Å; C206-D217 WeakPolarHBondContact CA-O 3.27Å; C206-D217 PolarHBondContact N-O 3.19Å; C206-D217 PolarHBondContact SG-O 3.3Å; D211-D217 WeakPolarHBondContact CA-OD2 3.32Å; D211-D217 WeakPolarHBondContact CB-OD2 3.45Å; D211-D217 PolarHBondContact N-OD2 2.72Å; C212-D217 HydrophobicContact CB-CB 4.25Å; C212-D217 WeakPolarHBondContact CB-OD1 3.34Å; C212-D217 PolarHBondContact N-OD1 3.33Å; C212-D217 PolarHBondContact N-OD2 2.89Å; S215-D217 WeakPolarHBondContact CA-OD1 3.46Å; S215-D217 PolarHBondContact O-N 2.9Å; D217-C223 PolarHBondContact O-SG 2.84Å
218	E	72.6	Confident	67.9	Low	18 Å²	18	50.4 Å²	50.4	8%	0.084	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-114.9	14.6	-178.1	-64.3	-59.1	135.4	0	0	113.1	C206 D207 G208 V209 S215 S216 F231	C206-E218 WeakPolarHBondContact CA-OE1 3.25Å; C206-E218 PolarHBondContact N-OE1 2.8Å; D207-E218 PolarHBondContact N-OE1 3.3Å; G208-E218 WeakPolarHBondContact CA-OE2 3.48Å; G208-E218 PolarHBondContact N-OE1 3.11Å; G208-E218 PolarHBondContact N-OE2 2.9Å; V209-E218 WeakPolarHBondContact O-CG 3.2Å; S215-E218 PolarHBondContact O-N 2.8Å; S215-E218 VanDerWaalsContact O-N 3.11Å; S216-E218 PolarHBondContact O-N 2.82Å; E218-F231 WeakPolarHBondContact OE2-CE1 3.41Å; E218-F231 WeakPolarHBondContact OE2-CZ 3.27Å
219	S	69.6	Low	68.1	Low	42 Å²	42	52.5 Å²	52.5	29%	0.294	32%	0.319	S	S	.	.			trans	-65.5	132.1	-176.5	166.9	0	0	0	0	111.4	S216 F221 S222 C223	S216-S219 PolarHBondContact O-N 2.94Å; S219-F221 PolarHBondContact O-N 3.45Å; S219-F221 PolarHBondContact OG-N 2.95Å; S219-S222 WeakPolarHBondContact CB-OG 3.45Å; S219-S222 PolarHBondContact O-N 3.25Å; S219-S222 VanDerWaalsContact O-N 3.11Å; S219-S222 PolarHBondContact O-OG 2.83Å; S219-S222 VanDerWaalsContact O-OG 3.06Å; S219-C223 WeakPolarHBondContact O-CB 3.24Å; S219-C223 PolarHBondContact O-N 2.87Å
220	P	63.4	Low	68.3	Low	94 Å²	94	54.7 Å²	54.7	61%	0.61	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-21.5	177.9	-23.8	32.1	0	0	0	114.1	A224	P220-A224 WeakPolarHBondContact O-CB 3Å; P220-A224 PolarHBondContact O-N 3.36Å
221	F	62.6	Low	68.6	Low	193 Å²	193	51.4 Å²	51.4	85%	0.846	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-33.4	179.8	-172.7	-98	0	0	0	112.8	S219	S219-F221 PolarHBondContact O-N 3.45Å; S219-F221 PolarHBondContact OG-N 2.95Å
222	S	63.4	Low	69.1	Low	62 Å²	62	50.5 Å²	50.5	43%	0.434	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-31.2	176.2	48.6	0	0	0	0	112.4	S216 S219	S216-S222 PolarHBondContact O-OG 3.48Å; S219-S222 WeakPolarHBondContact CB-OG 3.45Å; S219-S222 PolarHBondContact O-N 3.25Å; S219-S222 VanDerWaalsContact O-N 3.11Å; S219-S222 PolarHBondContact O-OG 2.83Å; S219-S222 VanDerWaalsContact O-OG 3.06Å
223	C	66.3	Low	69.8	Low	9 Å²	9	51 Å²	51	6%	0.061	30%	0.302	C	S	.	.	S	Bend	trans	-99.7	5.8	-176	-59.1	0	0	0	0	114.4	C206 D217 S219 T225 F231	C206-C223 VanDerWaalsContact CA-SG 3.58Å; C206-C223 HydrophobicContact CB-CB 3.6Å; C206-C223 WeakPolarHBondContact CB-SG 3.44Å; C206-C223 WeakPolarHBondContact SG-CA 3.07Å; C206-C223 WeakPolarHBondContact SG-CB 3.5Å; C206-C223 CovalentContact SG-SG 2.02Å; C206-C223 PolarHBondContact SG-SG 3.39Å; D217-C223 PolarHBondContact O-SG 2.84Å; S219-C223 WeakPolarHBondContact O-CB 3.24Å; S219-C223 PolarHBondContact O-N 2.87Å; C223-T225 PolarHBondContact O-N 2.69Å; C223-T225 VanDerWaalsContact O-N 3.15Å; C223-F231 HydrophobicContact CB-CB 4.23Å; C223-F231 HydrophobicContact CB-CD1 3.39Å; C223-F231 HydrophobicContact CB-CD2 3.84Å; C223-F231 HydrophobicContact CB-CE1 3.61Å; C223-F231 HydrophobicContact CB-CE2 4.05Å; C223-F231 HydrophobicContact CB-CG 3.53Å; C223-F231 HydrophobicContact CB-CZ 3.94Å; C223-F231 WeakPolarHBondContact O-CB 3.08Å; C223-F231 WeakPolarHBondContact O-CD2 3.38Å; C223-F231 WeakPolarHBondContact O-CG 3.44Å
224	A	63	Low	70.5	Confident	47 Å²	47	49.9 Å²	49.9	39%	0.388	29%	0.292	S	S	.	.			trans	-53.4	121.3	178	0	0	0	0	0	110.4	P220	P220-A224 WeakPolarHBondContact O-CB 3Å; P220-A224 PolarHBondContact O-N 3.36Å
225	T	68.4	Low	71	Confident	9 Å²	9	48.6 Å²	48.6	6%	0.055	29%	0.29	C	S	.	.			trans	-68	142.4	179.8	58.8	0	0	0	0	111	C223 C227 D228 G229 K230 C254 R255	C223-T225 PolarHBondContact O-N 2.69Å; C223-T225 VanDerWaalsContact O-N 3.15Å; T225-C227 PolarHBondContact O-N 2.91Å; T225-C227 VanDerWaalsContact O-N 3.16Å; T225-D228 PolarHBondContact OG1-OD1 2.77Å; T225-G229 VanDerWaalsContact O-CA 3.27Å; T225-G229 WeakPolarHBondContact O-CA 3.25Å; T225-G229 PolarHBondContact O-N 3.07Å; T225-K230 VanDerWaalsContact CG2-O 3.24Å; T225-K230 WeakPolarHBondContact CG2-O 3.29Å; T225-K230 PolarHBondContact OG1-O 2.84Å; T225-C254 HydrophobicContact CG2-CB 4.34Å; T225-R255 VanDerWaalsContact CG2-N 3.35Å; T225-R255 WeakPolarHBondContact CG2-O 3.47Å
226	P	68.3	Low	71.9	Confident	88 Å²	88	50 Å²	50	57%	0.571	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-13.6	175.8	24.2	-31.4	0	0	0	113.4	V252 F253	P226-V252 HydrophobicContact CG-CG1 4.08Å; P226-F253 WeakPolarHBondContact CG-O 2.98Å
227	C	75.6	Confident	72.9	Confident	6 Å²	6	53 Å²	53	4%	0.041	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-64.3	179	-70.2	0	0	0	0	113.1	T225 R241 S242 C254 W256	T225-C227 PolarHBondContact O-N 2.91Å; T225-C227 VanDerWaalsContact O-N 3.16Å; C227-R241 WeakPolarHBondContact CB-O 3.43Å; C227-S242 VanDerWaalsContact CB-O 3.27Å; C227-S242 WeakPolarHBondContact CB-O 3.36Å; C227-S242 PolarHBondContact SG-O 3.47Å; C227-C254 HydrophobicContact CB-CB 3.9Å; C227-C254 WeakPolarHBondContact CB-SG 3.47Å; C227-C254 PolarHBondContact N-SG 3.31Å; C227-C254 WeakPolarHBondContact SG-CB 3.38Å; C227-C254 CovalentContact SG-SG 2Å; C227-C254 PolarHBondContact SG-SG 2.9Å; C227-W256 HydrophobicContact CB-CH2 4.14Å; C227-W256 HydrophobicContact CB-CZ2 3.66Å
228	D	71.4	Confident	73.7	Confident	15 Å²	15	54 Å²	54	8%	0.08	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.1	2	-173.5	71.3	-6.8	0	0	0	113.8	T225 K230 F240 R241 W256	T225-D228 PolarHBondContact OG1-OD1 2.77Å; D228-K230 PolarHBondContact O-N 2.83Å; D228-K230 WeakPolarHBondContact OD1-CB 3.4Å; D228-K230 PolarHBondContact OD1-N 3.45Å; D228-F240 WeakPolarHBondContact OD2-CA 2.89Å; D228-R241 HydrophobicContact CB-CG 3.76Å; D228-R241 PolarHBondContact OD2-N 3.39Å; D228-W256 VanDerWaalsContact CG-NE1 3.34Å; D228-W256 PolarHBondContact OD1-NE1 2.78Å; D228-W256 PolarHBondContact OD2-NE1 3.25Å
229	G	68.3	Low	74.4	Confident	44 Å²	44	55.7 Å²	55.7	45%	0.454	34%	0.343	S	S	.	.	S	Bend	trans	71.3	8.1	-179.3	0	0	0	0	0	113.6	T225	T225-G229 VanDerWaalsContact O-CA 3.27Å; T225-G229 WeakPolarHBondContact O-CA 3.25Å; T225-G229 PolarHBondContact O-N 3.07Å
230	K	78.3	Confident	75.2	Confident	93 Å²	93	53.8 Å²	53.8	40%	0.404	33%	0.33	S	S	.	.			trans	-106.5	145.6	176.7	-57.8	179.8	-171.3	172.7	0	109.5	T225 D228 L233 S239	T225-K230 VanDerWaalsContact CG2-O 3.24Å; T225-K230 WeakPolarHBondContact CG2-O 3.29Å; T225-K230 PolarHBondContact OG1-O 2.84Å; D228-K230 PolarHBondContact O-N 2.83Å; D228-K230 WeakPolarHBondContact OD1-CB 3.4Å; D228-K230 PolarHBondContact OD1-N 3.45Å; K230-L233 HydrophobicContact CB-CD2 4.13Å; K230-L233 HydrophobicContact CD-CD2 3.79Å; K230-S239 PolarHBondContact NZ-O 3.01Å
231	F	75.9	Confident	76.3	Confident	6 Å²	6	53.3 Å²	53.3	3%	0.026	32%	0.316	C	S	.	.			trans	-126	-59.7	-179.7	176.6	-117.3	0	0	0	110.5	C206 E218 C223 R255 W256 I257	C206-F231 HydrophobicContact CB-CE1 4.39Å; C206-F231 HydrophobicContact CB-CE2 3.84Å; C206-F231 HydrophobicContact CB-CZ 3.66Å; C206-F231 VanDerWaalsContact O-CE2 3.24Å; C206-F231 WeakPolarHBondContact O-CE2 3.41Å; C206-F231 WeakPolarHBondContact O-CZ 3.36Å; E218-F231 WeakPolarHBondContact OE2-CE1 3.41Å; E218-F231 WeakPolarHBondContact OE2-CZ 3.27Å; C223-F231 HydrophobicContact CB-CB 4.23Å; C223-F231 HydrophobicContact CB-CD1 3.39Å; C223-F231 HydrophobicContact CB-CD2 3.84Å; C223-F231 HydrophobicContact CB-CE1 3.61Å; C223-F231 HydrophobicContact CB-CE2 4.05Å; C223-F231 HydrophobicContact CB-CG 3.53Å; C223-F231 HydrophobicContact CB-CZ 3.94Å; C223-F231 WeakPolarHBondContact O-CB 3.08Å; C223-F231 WeakPolarHBondContact O-CD2 3.38Å; C223-F231 WeakPolarHBondContact O-CG 3.44Å; F231-R255 WeakPolarHBondContact CD2-O 3.4Å; F231-R255 HydrophobicContact CE2-CG 4.46Å; F231-W256 CarbonylContact O-C 3.52Å; F231-W256 WeakPolarHBondContact O-CA 3.23Å; F231-I257 HydrophobicContact CE1-CD1 3.79Å; F231-I257 HydrophobicContact CE2-CD1 3.8Å; F231-I257 HydrophobicContact CE2-CG1 4.35Å; F231-I257 HydrophobicContact CZ-CD1 3.28Å; F231-I257 HydrophobicContact CZ-CG1 4.28Å; F231-I257 PolarHBondContact O-N 3.4Å
232	V	81.8	Confident	77.2	Confident	43 Å²	43	44.4 Å²	44.4	26%	0.261	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	127.4	173.4	-168.7	0	0	0	0	110.7	E234 R259	V232-E234 HydrophobicContact CG1-CG 3.68Å; V232-R259 HydrophobicContact CG1-CG 4.34Å
233	L	82.5	Confident	77.8	Confident	15 Å²	15	42 Å²	42	8%	0.079	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	101.4	176.2	-58.4	169.7	0	0	0	108.9	K230 F240 W256 I257 I258 R259 F333	K230-L233 HydrophobicContact CB-CD2 4.13Å; K230-L233 HydrophobicContact CD-CD2 3.79Å; L233-F240 HydrophobicContact CD1-CB 3.94Å; L233-F240 HydrophobicContact CD1-CD1 3.94Å; L233-F240 HydrophobicContact CD1-CG 4.27Å; L233-W256 HydrophobicContact CD1-CB 4.24Å; L233-I257 PolarHBondContact N-O 3.32Å; L233-I258 HydrophobicContact CD1-CG1 4.29Å; L233-R259 PolarHBondContact O-N 3.39Å; L233-F333 HydrophobicContact CB-CE1 3.65Å; L233-F333 HydrophobicContact CB-CZ 3.88Å; L233-F333 HydrophobicContact CD1-CD1 4.42Å; L233-F333 HydrophobicContact CD1-CE1 3.88Å; L233-F333 HydrophobicContact CG-CE1 4.32Å
234	E	82.6	Confident	77.6	Confident	137 Å²	137	49 Å²	49	64%	0.64	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.8	134.3	179.7	-54.1	-167.1	153.1	0	0	111.1	V232 R259	V232-E234 HydrophobicContact CG1-CG 3.68Å; E234-R259 HydrophobicContact CG-CB 4.38Å; E234-R259 IonicContact OE1-NH1 3.37Å
235	G	77.9	Confident	77.4	Confident	20 Å²	20	50 Å²	50	21%	0.206	30%	0.297	C	S	.	.	S	Bend	trans	135.5	179	172	0	0	0	0	0	114.7	S237 R259	G235-S237 PolarHBondContact O-N 3.31Å; G235-R259 PolarHBondContact N-O 2.86Å
236	P	82.9	Confident	77.1	Confident	88 Å²	88	57.1 Å²	57.1	57%	0.571	33%	0.334	S	S	*	.	S	Bend	trans	-74.1	-14.8	-179	30.7	-35.6	0	0	0	113.3	R334 A335	P236-R334 CarbonylContact O-C 3.54Å; P236-R334 WeakPolarHBondContact O-CA 3.48Å; P236-A335 PolarHBondContact O-N 3.06Å
237	S	87.6	Confident	77.2	Confident	83 Å²	83	54.4 Å²	54.4	58%	0.58	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-156.9	147.9	175.4	60.6	0	0	0	0	110.5	G235 F333	G235-S237 PolarHBondContact O-N 3.31Å; S237-F333 WeakPolarHBondContact CA-O 3.34Å
238	G	85.9	Confident	77.2	Confident	22 Å²	22	54.2 Å²	54.2	23%	0.227	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	175.1	174	0	0	0	0	0	112.1	S332 F333	G238-S332 CarbonylContact O-C 3.55Å; G238-S332 VanDerWaalsContact O-CA 3.23Å; G238-S332 WeakPolarHBondContact O-CA 3.22Å; G238-S332 WeakPolarHBondContact O-CB 3.14Å; G238-F333 PolarHBondContact N-O 3.29Å; G238-F333 WeakPolarHBondContact O-CD1 3.42Å; G238-F333 PolarHBondContact O-N 2.93Å
239	S	85.7	Confident	77.3	Confident	54 Å²	54	58 Å²	58	38%	0.378	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	143.1	178.9	59.9	0	0	0	0	111.8	K230 A331	K230-S239 PolarHBondContact NZ-O 3.01Å; S239-A331 VanDerWaalsContact CA-O 3.27Å; S239-A331 WeakPolarHBondContact CA-O 3.44Å; S239-A331 WeakPolarHBondContact CB-O 3.27Å
240	F	87.6	Confident	77.6	Confident	2 Å²	2	58.9 Å²	58.9	1%	0.009	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	153	179.6	60.4	-83.5	0	0	0	109.9	D228 L233 W256 I258 V268 V316 F329 A331	D228-F240 WeakPolarHBondContact OD2-CA 2.89Å; L233-F240 HydrophobicContact CD1-CB 3.94Å; L233-F240 HydrophobicContact CD1-CD1 3.94Å; L233-F240 HydrophobicContact CD1-CG 4.27Å; F240-W256 HydrophobicContact CB-CD2 4.28Å; F240-W256 HydrophobicContact CB-CG 4.17Å; F240-W256 HydrophobicContact CD2-CD2 4.07Å; F240-W256 HydrophobicContact CD2-CE3 4.13Å; F240-W256 HydrophobicContact CD2-CG 4.49Å; F240-W256 HydrophobicContact CD2-CZ3 4.45Å; F240-W256 HydrophobicContact CG-CD2 4.45Å; F240-W256 HydrophobicContact CG-CG 4.47Å; F240-I258 HydrophobicContact CE1-CD1 4.16Å; F240-V268 HydrophobicContact CE1-CG1 4.26Å; F240-V268 HydrophobicContact CZ-CG1 4.02Å; F240-V316 HydrophobicContact CE2-CG1 3.79Å; F240-V316 HydrophobicContact CZ-CG1 4.19Å; F240-V316 HydrophobicContact CZ-CG2 4.31Å; F240-F329 AromaticContact CD2-CE2 3.74Å; F240-F329 HydrophobicContact CD2-CE2 3.74Å; F240-F329 HydrophobicContact CE2-CD2 4.49Å; F240-F329 AromaticContact CE2-CE2 3.67Å; F240-F329 HydrophobicContact CE2-CE2 3.67Å; F240-F329 HydrophobicContact CE2-CZ 4.47Å; F240-A331 HydrophobicContact CD1-CB 4.34Å; F240-A331 HydrophobicContact CD2-CB 4.25Å; F240-A331 HydrophobicContact CE1-CB 3.81Å; F240-A331 HydrophobicContact CE2-CB 3.7Å; F240-A331 HydrophobicContact CZ-CB 3.46Å; F240-A331 VanDerWaalsContact CZ-CB 3.46Å; F240-A331 PolarHBondContact N-O 3.18Å; F240-A331 PolarHBondContact O-N 2.97Å; F240-A331 VanDerWaalsContact O-O 3.1Å
241	R	86.1	Confident	77.5	Confident	84 Å²	84	60.1 Å²	60.1	32%	0.317	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	153.4	-174.8	64.6	177.7	69.5	-164.6	0	111.9	C227 D228 S243 W256 F329	C227-R241 WeakPolarHBondContact CB-O 3.43Å; D228-R241 HydrophobicContact CB-CG 3.76Å; D228-R241 PolarHBondContact OD2-N 3.39Å; R241-S243 WeakPolarHBondContact CD-O 3.38Å; R241-S243 WeakPolarHBondContact CG-O 3.45Å; R241-W256 VanDerWaalsContact O-CZ2 3.32Å; R241-W256 WeakPolarHBondContact O-CZ2 3.27Å; R241-F329 WeakPolarHBondContact CA-O 3.47Å
242	S	82.1	Confident	77.7	Confident	5 Å²	5	60.6 Å²	60.6	4%	0.035	35%	0.347	C	S	.	.	S	Bend	trans	-69.2	-25.6	178.7	56.7	0	0	0	0	115.1	C227 G328 F329	C227-S242 VanDerWaalsContact CB-O 3.27Å; C227-S242 WeakPolarHBondContact CB-O 3.36Å; C227-S242 PolarHBondContact SG-O 3.47Å; S242-G328 WeakPolarHBondContact OG-CA 3.4Å; S242-F329 PolarHBondContact N-O 2.99Å; S242-F329 VanDerWaalsContact N-O 3.08Å; S242-F329 PolarHBondContact OG-N 3.28Å; S242-F329 PolarHBondContact OG-O 2.88Å
243	S	75.1	Confident	77.7	Confident	13 Å²	13	63.3 Å²	63.3	9%	0.091	36%	0.355	C	S	.	.			trans	-159.8	159.6	177.7	-168.8	0	0	0	0	112.9	R241 S245 A247	R241-S243 WeakPolarHBondContact CD-O 3.38Å; R241-S243 WeakPolarHBondContact CG-O 3.45Å; S243-S245 PolarHBondContact OG-N 2.88Å; S243-S245 PolarHBondContact OG-OG 3Å; S243-A247 VanDerWaalsContact CB-O 3.3Å; S243-A247 WeakPolarHBondContact CB-O 3.19Å; S243-A247 PolarHBondContact OG-O 2.84Å
244	Q	62.4	Low	77.8	Confident	154 Å²	154	62.6 Å²	62.6	72%	0.72	35%	0.352	S	S	*	.	S	Bend	trans	-83.1	-21.5	169.1	-64.2	-167.4	10.6	0	0	113.1
245	S	59.4	Low	78	Confident	70 Å²	70	58.1 Å²	58.1	49%	0.49	33%	0.329	S	S	.	.	S	Bend	trans	-92.3	175.2	174.7	47.6	0	0	0	0	112.4	S243 A247	S243-S245 PolarHBondContact OG-N 2.88Å; S243-S245 PolarHBondContact OG-OG 3Å; S245-A247 PolarHBondContact O-N 2.8Å; S245-A247 PolarHBondContact OG-O 3.07Å
246	D	62.2	Low	78.5	Confident	158 Å²	158	57.1 Å²	57.1	85%	0.845	32%	0.319	S	S	*	.	S	Bend	trans	-66.3	-11.9	-179.2	-64.5	-37.5	0	0	0	114.2	P327	D246-P327 VanDerWaalsContact O-CA 3.25Å; D246-P327 WeakPolarHBondContact O-CA 3.33Å
247	A	69.6	Low	78.6	Confident	30 Å²	30	53 Å²	53	25%	0.248	29%	0.292	C	S	.	.	S	Bend	trans	-140	155	173	0	0	0	0	0	111.5	S243 S245 L326	S243-A247 VanDerWaalsContact CB-O 3.3Å; S243-A247 WeakPolarHBondContact CB-O 3.19Å; S243-A247 PolarHBondContact OG-O 2.84Å; S245-A247 PolarHBondContact O-N 2.8Å; S245-A247 PolarHBondContact OG-O 3.07Å; A247-L326 VanDerWaalsContact CA-O 3.29Å; A247-L326 WeakPolarHBondContact CA-O 3.24Å; A247-L326 WeakPolarHBondContact CB-O 3.45Å
248	Y	76.2	Confident	78.5	Confident	2 Å²	2	49 Å²	49	1%	0.008	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-81.8	151	174.9	61.9	-89.4	0	0	0	112.6	D280 F318 S325 L326 G328	Y248-D280 WeakPolarHBondContact CE2-OD2 3.2Å; Y248-D280 PolarHBondContact OH-OD2 3.31Å; Y248-F318 HydrophobicContact CD1-CZ 4.32Å; Y248-F318 AromaticContact CD2-CE1 3.93Å; Y248-F318 HydrophobicContact CD2-CE1 3.93Å; Y248-F318 AromaticContact CD2-CZ 3.91Å; Y248-F318 HydrophobicContact CD2-CZ 3.91Å; Y248-F318 HydrophobicContact CE1-CZ 4.39Å; Y248-F318 HydrophobicContact CE2-CE1 4.46Å; Y248-F318 HydrophobicContact CE2-CZ 4.01Å; Y248-F318 HydrophobicContact CG-CE1 4.05Å; Y248-F318 HydrophobicContact CG-CZ 4.09Å; Y248-S325 WeakPolarHBondContact O-CB 3.48Å; Y248-L326 WeakPolarHBondContact CD1-O 3.27Å; Y248-L326 HydrophobicContact CE1-CB 3.9Å; Y248-L326 WeakPolarHBondContact CE1-O 3.47Å; Y248-L326 PolarHBondContact N-O 3.44Å; Y248-G328 VanDerWaalsContact CD1-CA 3.45Å
249	N	73.4	Confident	78.6	Confident	96 Å²	96	51.2 Å²	51.2	51%	0.513	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-78.2	151.8	-179.4	-54.6	-38.8	0	0	0	111	V252 S320	N249-V252 HydrophobicContact CB-CG2 3.57Å; N249-V252 WeakPolarHBondContact O-CB 3.33Å; N249-V252 WeakPolarHBondContact O-CG2 3.42Å; N249-S320 PolarHBondContact O-OG 3.25Å
250	N	75.3	Confident	78.6	Confident	61 Å²	61	49.3 Å²	49.3	33%	0.326	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	150.5	174.2	-62.7	5.6	0	0	0	110.7	V252 D321 S322 S325	N250-V252 VanDerWaalsContact C-N 3.3Å; N250-V252 PolarHBondContact O-N 2.88Å; N250-D321 CarbonylContact C-O 3.48Å; N250-D321 VanDerWaalsContact CA-O 3.29Å; N250-D321 WeakPolarHBondContact CA-O 3.3Å; N250-D321 VanDerWaalsContact CB-O 3.32Å; N250-D321 WeakPolarHBondContact CB-O 3.41Å; N250-S322 PolarHBondContact ND2-O 3Å; N250-S325 WeakPolarHBondContact OD1-CB 3.3Å
251	N	75.6	Confident	78.5	Confident	119 Å²	119	54.1 Å²	54.1	64%	0.636	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	35.4	-177.9	-67.4	95.7	0	0	0	114	S320 D321 S322	N251-S320 WeakPolarHBondContact CA-O 3.43Å; N251-S320 PolarHBondContact N-OG 3.19Å; N251-D321 PolarHBondContact N-O 3.35Å; N251-S322 WeakPolarHBondContact OD1-CA 3.48Å; N251-S322 WeakPolarHBondContact OD1-CB 3.3Å
252	V	79.4	Confident	78.2	Confident	17 Å²	17	60.9 Å²	60.9	10%	0.103	30%	0.303	C	S	.	.			trans	-94	133.4	-179.1	171.7	0	0	0	0	110.8	P226 N249 N250 C254 T319 S320	P226-V252 HydrophobicContact CG-CG1 4.08Å; N249-V252 HydrophobicContact CB-CG2 3.57Å; N249-V252 WeakPolarHBondContact O-CB 3.33Å; N249-V252 WeakPolarHBondContact O-CG2 3.42Å; N250-V252 VanDerWaalsContact C-N 3.3Å; N250-V252 PolarHBondContact O-N 2.88Å; V252-C254 WeakPolarHBondContact CG1-SG 3.14Å; V252-T319 WeakPolarHBondContact O-CA 3.46Å; V252-S320 PolarHBondContact N-OG 3.32Å; V252-S320 PolarHBondContact O-N 3.28Å
253	F	82.8	Confident	77.7	Confident	100 Å²	100	63.6 Å²	63.6	44%	0.439	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	121.6	164.7	179.6	-107	0	0	0	109.4	P226 R255 E317 F318 T319	P226-F253 WeakPolarHBondContact CG-O 2.98Å; F253-R255 HydrophobicContact CE1-CB 4.23Å; F253-R255 HydrophobicContact CZ-CB 4.41Å; F253-E317 HydrophobicContact CE2-CB 4.29Å; F253-E317 HydrophobicContact CE2-CG 4.44Å; F253-E317 HydrophobicContact CZ-CG 4.25Å; F253-F318 WeakPolarHBondContact CA-O 3.36Å; F253-T319 HydrophobicContact CD2-CG2 3.56Å; F253-T319 HydrophobicContact CE2-CG2 3.99Å
254	C	84.8	Confident	78.1	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	142.8	177.1	-66.6	0	0	0	0	111	T225 C227 V252 W256 E317 F318	T225-C254 HydrophobicContact CG2-CB 4.34Å; C227-C254 HydrophobicContact CB-CB 3.9Å; C227-C254 WeakPolarHBondContact CB-SG 3.47Å; C227-C254 PolarHBondContact N-SG 3.31Å; C227-C254 WeakPolarHBondContact SG-CB 3.38Å; C227-C254 CovalentContact SG-SG 2Å; C227-C254 PolarHBondContact SG-SG 2.9Å; V252-C254 WeakPolarHBondContact CG1-SG 3.14Å; C254-W256 HydrophobicContact CB-CH2 3.36Å; C254-W256 HydrophobicContact CB-CZ2 3.77Å; C254-W256 HydrophobicContact CB-CZ3 3.77Å; C254-E317 CarbonylContact O-C 3.56Å; C254-E317 VanDerWaalsContact O-CA 3.29Å; C254-E317 WeakPolarHBondContact O-CA 3.35Å; C254-F318 HydrophobicContact CB-CB 4.39Å; C254-F318 PolarHBondContact N-O 3.47Å; C254-F318 PolarHBondContact O-N 3.31Å
255	R	85.8	Confident	79.2	Confident	42 Å²	42	58 Å²	58	16%	0.158	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	125.1	-178.1	178	168.8	53	177.8	-4.9	111.3	F205 C206 T225 F231 F253 T315 V316 E317	F205-R255 PolarHBondContact O-NH2 2.98Å; C206-R255 PolarHBondContact O-NE 3.32Å; C206-R255 PolarHBondContact O-NH1 3.23Å; C206-R255 PolarHBondContact O-NH2 3.46Å; T225-R255 VanDerWaalsContact CG2-N 3.35Å; T225-R255 WeakPolarHBondContact CG2-O 3.47Å; F231-R255 WeakPolarHBondContact CD2-O 3.4Å; F231-R255 HydrophobicContact CE2-CG 4.46Å; F253-R255 HydrophobicContact CE1-CB 4.23Å; F253-R255 HydrophobicContact CZ-CB 4.41Å; R255-T315 HydrophobicContact CG-CG2 3.92Å; R255-V316 CarbonylContact C-O 3.57Å; R255-V316 VanDerWaalsContact CA-O 3.23Å; R255-V316 WeakPolarHBondContact CA-O 3.19Å; R255-E317 HydrophobicContact CB-CG 4.26Å; R255-E317 WeakPolarHBondContact CD-OE1 3.32Å; R255-E317 HydrophobicContact CG-CG 4.01Å
256	W	88.1	Confident	80.5	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	145	176.6	-57.2	-88.4	0	0	0	110.7	C227 D228 F231 L233 F240 R241 C254 T315 V316 F318 F329	C227-W256 HydrophobicContact CB-CH2 4.14Å; C227-W256 HydrophobicContact CB-CZ2 3.66Å; D228-W256 VanDerWaalsContact CG-NE1 3.34Å; D228-W256 PolarHBondContact OD1-NE1 2.78Å; D228-W256 PolarHBondContact OD2-NE1 3.25Å; F231-W256 CarbonylContact O-C 3.52Å; F231-W256 WeakPolarHBondContact O-CA 3.23Å; L233-W256 HydrophobicContact CD1-CB 4.24Å; F240-W256 HydrophobicContact CB-CD2 4.28Å; F240-W256 HydrophobicContact CB-CG 4.17Å; F240-W256 HydrophobicContact CD2-CD2 4.07Å; F240-W256 HydrophobicContact CD2-CE3 4.13Å; F240-W256 HydrophobicContact CD2-CG 4.49Å; F240-W256 HydrophobicContact CD2-CZ3 4.45Å; F240-W256 HydrophobicContact CG-CD2 4.45Å; F240-W256 HydrophobicContact CG-CG 4.47Å; R241-W256 VanDerWaalsContact O-CZ2 3.32Å; R241-W256 WeakPolarHBondContact O-CZ2 3.27Å; C254-W256 HydrophobicContact CB-CH2 3.36Å; C254-W256 HydrophobicContact CB-CZ2 3.77Å; C254-W256 HydrophobicContact CB-CZ3 3.77Å; W256-T315 CarbonylContact O-C 3.55Å; W256-T315 WeakPolarHBondContact O-CA 3.29Å; W256-V316 HydrophobicContact CB-CB 4.36Å; W256-V316 HydrophobicContact CE3-CB 4.18Å; W256-V316 HydrophobicContact CE3-CG1 3.96Å; W256-V316 HydrophobicContact CZ3-CG1 4.42Å; W256-V316 PolarHBondContact N-O 3.27Å; W256-V316 PolarHBondContact O-N 2.8Å; W256-F318 HydrophobicContact CH2-CB 4.17Å; W256-F318 HydrophobicContact CZ3-CB 3.87Å; W256-F329 AromaticContact CH2-CZ 3.87Å; W256-F329 HydrophobicContact CH2-CZ 3.87Å; W256-F329 AromaticContact CZ3-CZ 3.97Å; W256-F329 HydrophobicContact CZ3-CZ 3.97Å
257	I	85.2	Confident	81.8	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	119.9	173.6	-60	161.7	0	0	0	108.2	F231 L233 R259 V288 S314	F231-I257 HydrophobicContact CE1-CD1 3.79Å; F231-I257 HydrophobicContact CE2-CD1 3.8Å; F231-I257 HydrophobicContact CE2-CG1 4.35Å; F231-I257 HydrophobicContact CZ-CD1 3.28Å; F231-I257 HydrophobicContact CZ-CG1 4.28Å; F231-I257 PolarHBondContact O-N 3.4Å; L233-I257 PolarHBondContact N-O 3.32Å; I257-R259 HydrophobicContact CG2-CG 4.1Å; I257-V288 HydrophobicContact CG2-CG1 3.74Å; I257-S314 CarbonylContact C-O 3.43Å; I257-S314 WeakPolarHBondContact CA-O 2.97Å
258	I	86.3	Confident	82.7	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	121.7	176.3	-60.3	173.1	0	0	0	107.6	L233 F240 V260 A266 V268 L309 Q313 S314 V316 F333	L233-I258 HydrophobicContact CD1-CG1 4.29Å; F240-I258 HydrophobicContact CE1-CD1 4.16Å; I258-V260 HydrophobicContact CG2-CG1 4.17Å; I258-A266 HydrophobicContact CG2-CB 4.06Å; I258-V268 HydrophobicContact CD1-CG2 4.4Å; I258-L309 HydrophobicContact CD1-CD1 4.43Å; I258-Q313 CarbonylContact O-C 3.49Å; I258-Q313 WeakPolarHBondContact O-CA 3.12Å; I258-S314 PolarHBondContact N-O 2.97Å; I258-S314 PolarHBondContact O-N 2.78Å; I258-V316 HydrophobicContact CD1-CG2 3.94Å; I258-F333 HydrophobicContact CD1-CB 4.24Å; I258-F333 HydrophobicContact CD1-CD1 4.08Å; I258-F333 HydrophobicContact CD1-CG 4.17Å; I258-F333 HydrophobicContact CG1-CD1 4.21Å; I258-F333 HydrophobicContact CG1-CE1 4.36Å; I258-F333 HydrophobicContact CG2-CD1 4.24Å; I258-F333 HydrophobicContact CG2-CD2 3.64Å; I258-F333 HydrophobicContact CG2-CE1 4.23Å; I258-F333 HydrophobicContact CG2-CE2 3.65Å; I258-F333 HydrophobicContact CG2-CG 3.95Å; I258-F333 HydrophobicContact CG2-CZ 3.95Å
259	R	86.9	Confident	83.2	Confident	69 Å²	69	48 Å²	48	26%	0.26	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	111.6	173	-65.7	-172.8	174.5	158.4	0.9	109.9	G208 V232 L233 E234 G235 I257 Q313	G208-R259 PolarHBondContact O-NH2 3.42Å; V232-R259 HydrophobicContact CG1-CG 4.34Å; L233-R259 PolarHBondContact O-N 3.39Å; E234-R259 HydrophobicContact CG-CB 4.38Å; E234-R259 IonicContact OE1-NH1 3.37Å; G235-R259 PolarHBondContact N-O 2.86Å; I257-R259 HydrophobicContact CG2-CG 4.1Å; R259-Q313 HydrophobicContact CG-CG 4.3Å
260	V	86.9	Confident	83.8	Confident	13 Å²	13	45 Å²	45	8%	0.079	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-103.2	168	172.8	-63.3	0	0	0	0	110.3	I258 R262 L264 A266 D312 F333 A335	I258-V260 HydrophobicContact CG2-CG1 4.17Å; V260-R262 PolarHBondContact O-N 3.16Å; V260-L264 HydrophobicContact CG2-CB 4.29Å; V260-L264 VanDerWaalsContact CG2-O 3.23Å; V260-L264 WeakPolarHBondContact CG2-O 3.27Å; V260-A266 HydrophobicContact CG1-CB 4.17Å; V260-D312 HydrophobicContact CG2-CB 4.34Å; V260-D312 WeakPolarHBondContact CG2-O 3.49Å; V260-D312 PolarHBondContact N-O 2.88Å; V260-F333 HydrophobicContact CG1-CD2 4.31Å; V260-F333 HydrophobicContact CG1-CE2 4.13Å; V260-A335 HydrophobicContact CB-CB 4.17Å; V260-A335 HydrophobicContact CG1-CB 3.95Å
261	N	84.6	Confident	84.2	Confident	103 Å²	103	47.5 Å²	47.5	55%	0.551	24%	0.236	S	C	*	.	P	Polyproline II helix	trans	-61.4	140.7	178.1	-65.7	-34.5	0	0	0	110.3	G263 L264	N261-G263 PolarHBondContact O-N 3.36Å; N261-L264 HydrophobicContact CB-CD1 3.95Å; N261-L264 HydrophobicContact CB-CG 4.4Å; N261-L264 WeakPolarHBondContact O-CB 3.48Å; N261-L264 PolarHBondContact O-N 3.08Å
262	R	79.7	Confident	84.5	Confident	227 Å²	227	45.5 Å²	45.5	86%	0.857	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.5	126.3	179.2	-71.7	-174	175.7	178.1	-0.1	111.7	V260	V260-R262 PolarHBondContact O-N 3.16Å
263	G	72.1	Confident	84.6	Confident	61 Å²	61	45.4 Å²	45.4	63%	0.629	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.3	-1.2	-179.1	0	0	0	0	0	114.9	N261	N261-G263 PolarHBondContact O-N 3.36Å
264	L	83.4	Confident	84.5	Confident	46 Å²	46	44.4 Å²	44.4	24%	0.241	22%	0.217	C	C	.	.			trans	-100	153.1	167.7	-58.7	-179.5	0	0	0	110.3	V260 N261 A335 D337	V260-L264 HydrophobicContact CG2-CB 4.29Å; V260-L264 VanDerWaalsContact CG2-O 3.23Å; V260-L264 WeakPolarHBondContact CG2-O 3.27Å; N261-L264 HydrophobicContact CB-CD1 3.95Å; N261-L264 HydrophobicContact CB-CG 4.4Å; N261-L264 WeakPolarHBondContact O-CB 3.48Å; N261-L264 PolarHBondContact O-N 3.08Å; L264-A335 HydrophobicContact CB-CB 4.29Å; L264-A335 HydrophobicContact CD1-CB 3.9Å; L264-D337 HydrophobicContact CD2-CB 3.92Å
265	S	85.3	Confident	84.3	Confident	4 Å²	4	44.5 Å²	44.5	3%	0.028	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	155.1	175.3	-63.1	0	0	0	0	109.9	L309 L310 A335 A336 T338	S265-L309 CarbonylContact C-O 3.56Å; S265-L309 WeakPolarHBondContact CA-O 3.45Å; S265-L309 VanDerWaalsContact CB-O 3.29Å; S265-L309 WeakPolarHBondContact CB-O 3.27Å; S265-L310 WeakPolarHBondContact OG-CA 3.36Å; S265-A335 CarbonylContact O-C 3.52Å; S265-A335 WeakPolarHBondContact O-CA 3.23Å; S265-A336 PolarHBondContact N-O 2.68Å; S265-A336 PolarHBondContact O-N 3.34Å; S265-T338 PolarHBondContact OG-OG1 2.89Å
266	A	87.3	Confident	84	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	120.3	176.8	0	0	0	0	0	110.8	I258 V260 L309	I258-A266 HydrophobicContact CG2-CB 4.06Å; V260-A266 HydrophobicContact CG1-CB 4.17Å; A266-L309 HydrophobicContact CB-CB 4.26Å; A266-L309 PolarHBondContact N-O 2.89Å; A266-L309 PolarHBondContact O-N 3.31Å
267	Q	88.6	Confident	83.3	Confident	12 Å²	12	46.9 Å²	46.9	6%	0.056	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	114.5	171.3	-179	179	3.1	0	0	109.4	T306 W308 F333 R334	Q267-T306 HydrophobicContact CG-CG2 3.45Å; Q267-T306 VanDerWaalsContact CG-CG2 3.45Å; Q267-W308 HydrophobicContact CB-CD2 4.33Å; Q267-W308 HydrophobicContact CB-CE3 3.93Å; Q267-W308 HydrophobicContact CB-CH2 4.1Å; Q267-W308 HydrophobicContact CB-CZ2 4.46Å; Q267-W308 HydrophobicContact CB-CZ3 3.84Å; Q267-W308 HydrophobicContact CG-CD2 4.2Å; Q267-W308 HydrophobicContact CG-CE3 4.27Å; Q267-W308 HydrophobicContact CG-CH2 4.06Å; Q267-W308 HydrophobicContact CG-CZ2 3.96Å; Q267-W308 HydrophobicContact CG-CZ3 4.23Å; Q267-F333 CarbonylContact O-C 3.33Å; Q267-F333 WeakPolarHBondContact O-CA 3.46Å; Q267-R334 HydrophobicContact CB-CG 3.86Å; Q267-R334 VanDerWaalsContact CD-NE 3.29Å; Q267-R334 HydrophobicContact CG-CG 4.39Å; Q267-R334 PolarHBondContact N-O 2.88Å; Q267-R334 PolarHBondContact O-N 2.99Å
268	V	88.7	Confident	82.4	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	132.3	180	-173.2	0	0	0	0	109.9	F240 I258 F270 L284 V307 L309 A331 F333	F240-V268 HydrophobicContact CE1-CG1 4.26Å; F240-V268 HydrophobicContact CZ-CG1 4.02Å; I258-V268 HydrophobicContact CD1-CG2 4.4Å; V268-F270 HydrophobicContact CG1-CE2 3.98Å; V268-F270 HydrophobicContact CG1-CZ 3.99Å; V268-L284 HydrophobicContact CB-CD2 4.29Å; V268-L284 HydrophobicContact CG1-CD2 4.22Å; V268-L284 HydrophobicContact CG2-CD2 4.14Å; V268-V307 HydrophobicContact CB-CB 4.49Å; V268-V307 PolarHBondContact N-O 3.2Å; V268-V307 PolarHBondContact O-N 2.83Å; V268-L309 HydrophobicContact CG2-CD1 3.77Å; V268-L309 HydrophobicContact CG2-CG 4.42Å; V268-A331 HydrophobicContact CG1-CB 4.2Å; V268-F333 HydrophobicContact CG2-CB 4.12Å
269	T	87.7	Confident	81.9	Confident	37 Å²	37	57.3 Å²	57.3	23%	0.227	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	141.8	-179.3	50.3	0	0	0	0	109.4	T306 A331 S332	T269-T306 HydrophobicContact CG2-CG2 4.48Å; T269-A331 CarbonylContact O-C 3.49Å; T269-A331 VanDerWaalsContact O-CA 3.31Å; T269-A331 WeakPolarHBondContact O-CA 3.37Å; T269-S332 PolarHBondContact N-O 3.08Å; T269-S332 PolarHBondContact O-N 3.22Å; T269-S332 PolarHBondContact OG1-O 2.97Å; T269-S332 PolarHBondContact OG1-OG 3.01Å
270	F	86.3	Confident	81.6	Confident	34 Å²	34	54 Å²	54	15%	0.149	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	124.7	-176.2	-62.9	-94.9	0	0	0	109.6	V268 F273 L282 L284 L298 P304 G305 V307 F329 A331	V268-F270 HydrophobicContact CG1-CE2 3.98Å; V268-F270 HydrophobicContact CG1-CZ 3.99Å; F270-F273 AromaticContact CD1-CD2 3.83Å; F270-F273 HydrophobicContact CD1-CD2 3.83Å; F270-F273 HydrophobicContact CE1-CD2 4.11Å; F270-F273 HydrophobicContact CE1-CE2 4.37Å; F270-L282 HydrophobicContact CE1-CD2 3.52Å; F270-L282 HydrophobicContact CZ-CD2 3.94Å; F270-L284 HydrophobicContact CZ-CD1 4.49Å; F270-L298 HydrophobicContact CE1-CD1 4.25Å; F270-L298 HydrophobicContact CE2-CD1 3.9Å; F270-L298 HydrophobicContact CZ-CD1 3.53Å; F270-P304 HydrophobicContact CB-CG 3.91Å; F270-P304 HydrophobicContact CD1-CG 4.03Å; F270-P304 HydrophobicContact CD2-CB 4.28Å; F270-P304 HydrophobicContact CD2-CG 3.42Å; F270-P304 VanDerWaalsContact CD2-CG 3.42Å; F270-P304 HydrophobicContact CE1-CG 4.42Å; F270-P304 HydrophobicContact CE2-CB 4.35Å; F270-P304 HydrophobicContact CE2-CG 3.86Å; F270-P304 HydrophobicContact CG-CG 3.5Å; F270-P304 HydrophobicContact CZ-CG 4.34Å; F270-G305 WeakPolarHBondContact CD2-O 3.38Å; F270-V307 HydrophobicContact CE2-CG2 4.05Å; F270-F329 HydrophobicContact CE1-CD2 4.48Å; F270-A331 HydrophobicContact CD1-CB 3.75Å; F270-A331 HydrophobicContact CE1-CB 3.8Å; F270-A331 HydrophobicContact CG-CB 4.44Å
271	Q	83.3	Confident	81.5	Confident	114 Å²	114	53.8 Å²	53.8	53%	0.533	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-28.9	173.6	-63.7	109.7	12.2	0	0	112.2	R330 S332	Q271-R330 PolarHBondContact N-O 3.28Å; Q271-R330 VanDerWaalsContact OE1-CG 3.27Å; Q271-R330 PolarHBondContact OE1-O 3.26Å; Q271-S332 PolarHBondContact NE2-OG 3.42Å
272	Q	81.1	Confident	81.6	Confident	77 Å²	77	48.9 Å²	48.9	36%	0.36	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	137.6	179.8	-176.4	178.6	11.7	0	0	107.3	F329 R330	Q272-F329 CarbonylContact O-C 3.56Å; Q272-F329 WeakPolarHBondContact O-CA 3.21Å; Q272-F329 WeakPolarHBondContact O-CB 3.07Å; Q272-R330 HydrophobicContact CB-CB 4.36Å; Q272-R330 PolarHBondContact O-N 2.96Å
273	F	82.8	Confident	82	Confident	14 Å²	14	41.1 Å²	41.1	6%	0.061	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	100.8	179.4	-169.8	-91.1	0	0	0	110.4	F270 T275 L282 L298 G300 P304 F329	F270-F273 AromaticContact CD1-CD2 3.83Å; F270-F273 HydrophobicContact CD1-CD2 3.83Å; F270-F273 HydrophobicContact CE1-CD2 4.11Å; F270-F273 HydrophobicContact CE1-CE2 4.37Å; F273-T275 HydrophobicContact CZ-CG2 4.36Å; F273-L282 HydrophobicContact CE2-CB 4.36Å; F273-L282 HydrophobicContact CE2-CD2 3.91Å; F273-L298 HydrophobicContact CE1-CB 4.4Å; F273-L298 HydrophobicContact CE2-CB 4.09Å; F273-L298 HydrophobicContact CE2-CD1 4.48Å; F273-L298 HydrophobicContact CZ-CB 3.61Å; F273-G300 WeakPolarHBondContact CE1-O 3.32Å; F273-P304 HydrophobicContact CB-CG 4.19Å; F273-P304 HydrophobicContact CD1-CG 4.22Å; F273-P304 HydrophobicContact CD2-CG 3.96Å; F273-P304 HydrophobicContact CE2-CG 4.46Å; F273-P304 HydrophobicContact CG-CG 3.85Å; F273-F329 HydrophobicContact CB-CB 4.46Å; F273-F329 HydrophobicContact CD2-CB 3.55Å; F273-F329 HydrophobicContact CD2-CG 4.26Å; F273-F329 HydrophobicContact CE2-CB 4.15Å; F273-F329 HydrophobicContact CE2-CG 4.45Å; F273-F329 HydrophobicContact CG-CB 4.35Å
274	E	79.8	Confident	82.7	Confident	79 Å²	79	38.2 Å²	38.2	37%	0.369	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	103.5	176.5	-70.9	177.7	-154.2	0	0	109.7	L326 P327 G328	E274-L326 WeakPolarHBondContact O-CB 3Å; E274-P327 WeakPolarHBondContact OE2-CD 3.45Å; E274-P327 VanDerWaalsContact OE2-CG 3.29Å; E274-P327 WeakPolarHBondContact OE2-CG 3.44Å; E274-G328 PolarHBondContact N-O 3.41Å; E274-G328 CarbonylContact O-C 3.59Å; E274-G328 WeakPolarHBondContact O-CA 3.16Å; E274-G328 PolarHBondContact O-N 2.87Å
275	T	81.3	Confident	82.9	Confident	3 Å²	3	37.2 Å²	37.2	2%	0.018	19%	0.19	C	C	.	.			trans	-131.9	157.8	-179.4	54.4	0	0	0	0	109.8	F273 A277 G300 F318 F329	F273-T275 HydrophobicContact CZ-CG2 4.36Å; T275-A277 PolarHBondContact O-N 2.95Å; T275-G300 PolarHBondContact N-O 3.23Å; T275-G300 CarbonylContact O-C 3.56Å; T275-G300 WeakPolarHBondContact O-CA 3.32Å; T275-G300 PolarHBondContact O-N 3.47Å; T275-G300 PolarHBondContact OG1-N 3.22Å; T275-G300 PolarHBondContact OG1-O 3.16Å; T275-F318 HydrophobicContact CG2-CE2 3.95Å; T275-F318 HydrophobicContact CG2-CZ 4.4Å; T275-F329 HydrophobicContact CG2-CD1 4.39Å
276	E	78.4	Confident	83	Confident	34 Å²	34	38.3 Å²	38.3	16%	0.159	19%	0.194	C	C	.	.			trans	-65.3	125.2	177.6	-168.4	172.5	-148.9	0	0	110.9	N278 I279 D280 N324	E276-N278 PolarHBondContact O-N 3.32Å; E276-I279 HydrophobicContact CB-CB 4.3Å; E276-I279 HydrophobicContact CG-CB 4Å; E276-I279 HydrophobicContact CG-CD1 4.02Å; E276-I279 HydrophobicContact CG-CG1 4.4Å; E276-I279 PolarHBondContact O-N 3.07Å; E276-I279 WeakPolarHBondContact OE2-CG2 3.49Å; E276-D280 HydrophobicContact CB-CB 4.08Å; E276-D280 PolarHBondContact O-N 3.18Å; E276-D280 VanDerWaalsContact O-N 3.12Å; E276-N324 PolarHBondContact OE1-ND2 2.85Å
277	A	73.4	Confident	82.8	Confident	58 Å²	58	39.3 Å²	39.3	48%	0.479	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	126.1	-173.6	0	0	0	0	0	112	T275 I279	T275-A277 PolarHBondContact O-N 2.95Å; A277-I279 PolarHBondContact O-N 2.95Å
278	N	67.3	Low	82.5	Confident	138 Å²	138	40.1 Å²	40.1	74%	0.738	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.3	9	-179.7	-49.2	-59	0	0	0	116.3	E276 S299	E276-N278 PolarHBondContact O-N 3.32Å; N278-S299 PolarHBondContact N-OG 2.82Å; N278-S299 VanDerWaalsContact N-OG 3.13Å
279	I	74.6	Confident	81.9	Confident	80 Å²	80	40.5 Å²	40.5	41%	0.41	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.9	-55.1	179.4	-62.4	173.7	0	0	0	109.4	E276 A277 D321	E276-I279 HydrophobicContact CB-CB 4.3Å; E276-I279 HydrophobicContact CG-CB 4Å; E276-I279 HydrophobicContact CG-CD1 4.02Å; E276-I279 HydrophobicContact CG-CG1 4.4Å; E276-I279 PolarHBondContact O-N 3.07Å; E276-I279 WeakPolarHBondContact OE2-CG2 3.49Å; A277-I279 PolarHBondContact O-N 2.95Å; I279-D321 HydrophobicContact CG2-CB 3.68Å; I279-D321 WeakPolarHBondContact CG2-OD2 3.01Å
280	D	82.1	Confident	81	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.231	C	C	.	.	S	Bend	trans	-95.5	117.6	177.1	-66.5	-19.8	0	0	0	110	Y248 E276 S299 F318 T319 S320 D321	Y248-D280 WeakPolarHBondContact CE2-OD2 3.2Å; Y248-D280 PolarHBondContact OH-OD2 3.31Å; E276-D280 HydrophobicContact CB-CB 4.08Å; E276-D280 PolarHBondContact O-N 3.18Å; E276-D280 VanDerWaalsContact O-N 3.12Å; D280-S299 VanDerWaalsContact O-CB 3.3Å; D280-S299 WeakPolarHBondContact O-CB 3.29Å; D280-F318 HydrophobicContact CB-CE2 4.41Å; D280-T319 WeakPolarHBondContact CA-O 3.15Å; D280-S320 WeakPolarHBondContact OD1-CA 3.46Å; D280-D321 PolarHBondContact OD1-N 2.98Å
281	V	83.4	Confident	80.5	Confident	9 Å²	9	48.6 Å²	48.6	6%	0.055	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	130.4	-163.8	-174.4	0	0	0	0	111.3	R283 E297 T319	V281-R283 HydrophobicContact CG1-CG 3.95Å; V281-E297 HydrophobicContact CG1-CG 3.28Å; V281-T319 PolarHBondContact N-O 2.87Å; V281-T319 VanDerWaalsContact N-O 3.11Å; V281-T319 PolarHBondContact O-N 2.85Å; V281-T319 VanDerWaalsContact O-N 3.09Å; V281-T319 PolarHBondContact O-OG1 3.36Å
282	L	87.9	Confident	80.3	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	118.5	169.1	-179.6	67.9	0	0	0	109.8	F270 F273 L284 L298 V316 E317 F318 F329	F270-L282 HydrophobicContact CE1-CD2 3.52Å; F270-L282 HydrophobicContact CZ-CD2 3.94Å; F273-L282 HydrophobicContact CE2-CB 4.36Å; F273-L282 HydrophobicContact CE2-CD2 3.91Å; L282-L284 HydrophobicContact CD2-CD1 4.15Å; L282-L284 HydrophobicContact CG-CD1 3.99Å; L282-L298 HydrophobicContact CB-CB 4.35Å; L282-L298 HydrophobicContact CD2-CD1 4.28Å; L282-L298 PolarHBondContact N-O 3.45Å; L282-L298 PolarHBondContact O-N 3.33Å; L282-V316 HydrophobicContact CD1-CG1 3.59Å; L282-V316 HydrophobicContact CG-CG1 4.45Å; L282-E317 CarbonylContact C-O 3.57Å; L282-E317 WeakPolarHBondContact CA-O 3.43Å; L282-F318 HydrophobicContact CB-CD2 4.29Å; L282-F318 HydrophobicContact CD1-CB 4Å; L282-F318 HydrophobicContact CD1-CD2 4.49Å; L282-F329 HydrophobicContact CD1-CE1 3.81Å; L282-F329 HydrophobicContact CD1-CE2 4.15Å; L282-F329 HydrophobicContact CD1-CZ 3.51Å; L282-F329 HydrophobicContact CD2-CD1 4.28Å; L282-F329 HydrophobicContact CD2-CD2 4.17Å; L282-F329 HydrophobicContact CD2-CE1 4.17Å; L282-F329 HydrophobicContact CD2-CE2 4.07Å; L282-F329 HydrophobicContact CD2-CG 4.29Å; L282-F329 HydrophobicContact CD2-CZ 4.07Å; L282-F329 HydrophobicContact CG-CE1 4.41Å; L282-F329 HydrophobicContact CG-CZ 4.38Å
283	R	87.1	Confident	80.3	Confident	64 Å²	64	45.6 Å²	45.6	24%	0.242	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	129.2	178.5	-62.5	-172.4	176.9	85.5	8.1	110.6	V281 Y285 L294 A296 E297 V316 E317	V281-R283 HydrophobicContact CG1-CG 3.95Å; R283-Y285 HydrophobicContact CB-CD2 4.25Å; R283-Y285 HydrophobicContact CB-CE2 3.49Å; R283-Y285 VanDerWaalsContact CB-CE2 3.49Å; R283-Y285 WeakPolarHBondContact CD-OH 3.47Å; R283-L294 HydrophobicContact CB-CD1 3.84Å; R283-L294 HydrophobicContact CG-CD1 4.22Å; R283-A296 WeakPolarHBondContact CA-O 3.46Å; R283-E297 HydrophobicContact CG-CG 4.28Å; R283-E297 IonicContact CZ-OE2 2.64Å; R283-E297 IonicContact NE-OE2 3.34Å; R283-E297 PolarHBondContact NE-OE2 2.84Å; R283-E297 IonicContact NH2-OE2 2.78Å; R283-E297 PolarHBondContact NH2-OE2 3.27Å; R283-E297 VanDerWaalsContact NH2-OE2 3.07Å; R283-V316 CarbonylContact O-C 3.48Å; R283-V316 WeakPolarHBondContact O-CA 3.02Å; R283-E317 PolarHBondContact N-O 2.97Å; R283-E317 PolarHBondContact O-N 3.13Å
284	L	88.1	Confident	80.2	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	124.2	174.5	-63.8	86.7	0	0	0	108.6	V268 F270 L282 A295 A296 L298 V307 L309 V316	V268-L284 HydrophobicContact CB-CD2 4.29Å; V268-L284 HydrophobicContact CG1-CD2 4.22Å; V268-L284 HydrophobicContact CG2-CD2 4.14Å; F270-L284 HydrophobicContact CZ-CD1 4.49Å; L282-L284 HydrophobicContact CD2-CD1 4.15Å; L282-L284 HydrophobicContact CG-CD1 3.99Å; L284-A295 PolarHBondContact O-N 2.76Å; L284-A296 HydrophobicContact CB-CB 4.5Å; L284-A296 HydrophobicContact CD1-CB 4.38Å; L284-A296 PolarHBondContact N-O 2.79Å; L284-A296 PolarHBondContact O-N 3.37Å; L284-L298 HydrophobicContact CD1-CD1 3.76Å; L284-L298 HydrophobicContact CD1-CG 4.29Å; L284-V307 HydrophobicContact CD2-CB 4.38Å; L284-V307 HydrophobicContact CD2-CG1 4.1Å; L284-L309 HydrophobicContact CB-CD2 4.06Å; L284-L309 HydrophobicContact CD2-CD1 4.31Å; L284-V316 HydrophobicContact CD2-CG2 4.4Å; L284-V316 HydrophobicContact CG-CG1 4.26Å; L284-V316 HydrophobicContact CG-CG2 4.24Å
285	Y	86.9	Confident	80.2	Confident	25 Å²	25	42.9 Å²	42.9	10%	0.098	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	140.6	-178.1	-60.5	-90.8	0	0	0	111.2	R283 K292 V293 L294 S314 T315 E317	R283-Y285 HydrophobicContact CB-CD2 4.25Å; R283-Y285 HydrophobicContact CB-CE2 3.49Å; R283-Y285 VanDerWaalsContact CB-CE2 3.49Å; R283-Y285 WeakPolarHBondContact CD-OH 3.47Å; Y285-K292 HydrophobicContact CD1-CB 4.34Å; Y285-K292 HydrophobicContact CD1-CD 3.83Å; Y285-K292 HydrophobicContact CD1-CG 3.67Å; Y285-K292 HydrophobicContact CD2-CD 4.03Å; Y285-K292 HydrophobicContact CE1-CD 4.31Å; Y285-K292 HydrophobicContact CE1-CG 4.27Å; Y285-K292 HydrophobicContact CE2-CD 4.48Å; Y285-K292 HydrophobicContact CG-CB 4.4Å; Y285-K292 HydrophobicContact CG-CD 3.69Å; Y285-K292 HydrophobicContact CG-CG 3.94Å; Y285-V293 CarbonylContact C-O 3.48Å; Y285-V293 WeakPolarHBondContact CA-O 3.48Å; Y285-L294 HydrophobicContact CD1-CB 3.95Å; Y285-L294 HydrophobicContact CD1-CD1 3.96Å; Y285-L294 HydrophobicContact CE1-CB 3.82Å; Y285-L294 HydrophobicContact CE1-CD1 3.61Å; Y285-L294 HydrophobicContact CE1-CG 4.29Å; Y285-L294 HydrophobicContact CE2-CD1 4.29Å; Y285-L294 HydrophobicContact CG-CD1 4.43Å; Y285-S314 CarbonylContact O-C 3.53Å; Y285-S314 WeakPolarHBondContact O-CA 3.41Å; Y285-S314 VanDerWaalsContact O-CB 3.27Å; Y285-S314 WeakPolarHBondContact O-CB 3.32Å; Y285-T315 WeakPolarHBondContact CA-O 3.21Å; Y285-T315 WeakPolarHBondContact CB-O 3.45Å; Y285-T315 PolarHBondContact N-O 3.46Å; Y285-T315 PolarHBondContact O-N 3.36Å; Y285-E317 HydrophobicContact CD2-CG 4.5Å; Y285-E317 HydrophobicContact CE2-CB 4.27Å; Y285-E317 HydrophobicContact CE2-CG 4.21Å; Y285-E317 WeakPolarHBondContact CE2-OE2 3.5Å
286	E	86.6	Confident	80.2	Confident	27 Å²	27	43.3 Å²	43.3	13%	0.126	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	128.9	166.9	-73.4	176.7	167	0	0	109.6	K292 V293 A295 L309 L310 T311 R359	E286-K292 WeakPolarHBondContact O-CA 3.49Å; E286-V293 PolarHBondContact N-O 3.11Å; E286-V293 PolarHBondContact O-N 2.92Å; E286-A295 HydrophobicContact CG-CB 3.99Å; E286-L309 HydrophobicContact CG-CB 4.33Å; E286-L309 HydrophobicContact CG-CD2 4.01Å; E286-L309 WeakPolarHBondContact OE1-CA 3.5Å; E286-L310 PolarHBondContact OE1-N 3Å; E286-T311 WeakPolarHBondContact CA-OG1 3.46Å; E286-T311 HydrophobicContact CB-CG2 3.86Å; E286-T311 HydrophobicContact CG-CG2 4.35Å; E286-R359 IonicContact OE1-CZ 2.8Å; E286-R359 IonicContact OE1-NE 3.44Å; E286-R359 IonicContact OE1-NH2 3.54Å; E286-R359 PolarHBondContact OE1-NH2 2.71Å; E286-R359 IonicContact OE2-NE 3.03Å
287	G	83.8	Confident	80.4	Confident	21 Å²	21	46 Å²	46	22%	0.216	26%	0.259	C	S	.	.	S	Bend	trans	90.5	176.6	-172.2	0	0	0	0	0	114.8	T311 Q313 T315	G287-T311 PolarHBondContact N-OG1 3.38Å; G287-Q313 WeakPolarHBondContact CA-O 3.42Å; G287-Q313 PolarHBondContact N-O 2.82Å; G287-T315 PolarHBondContact O-N 2.89Å; G287-T315 PolarHBondContact O-OG1 2.9Å
288	V	82.2	Confident	80.8	Confident	29 Å²	29	44.4 Å²	44.4	18%	0.176	24%	0.243	C	C	.	.	S	Bend	trans	-127.9	157.7	178.8	-69.6	0	0	0	0	109.9	V209 I257 Q313	V209-V288 HydrophobicContact CG2-CB 4.43Å; V209-V288 HydrophobicContact CG2-CG2 4Å; I257-V288 HydrophobicContact CG2-CG1 3.74Å; V288-Q313 HydrophobicContact CG1-CB 4.04Å; V288-Q313 HydrophobicContact CG2-CB 4.47Å
289	G	75.9	Confident	81.5	Confident	7 Å²	7	39.6 Å²	39.6	7%	0.072	22%	0.22	C	C	.	.	S	Bend	trans	76.7	-160.2	-178.9	0	0	0	0	0	115.1	D207 N291 K292	D207-G289 PolarHBondContact O-N 3Å; G289-N291 VanDerWaalsContact C-N 3.34Å; G289-N291 PolarHBondContact O-N 3.07Å; G289-K292 WeakPolarHBondContact O-CG 3.23Å
290	P	68.7	Low	81.7	Confident	91 Å²	91	36 Å²	36	59%	0.591	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-16.4	-170.9	27.6	-34.9	0	0	0	114.9
291	N	75.3	Confident	81.2	Confident	151 Å²	151	40.5 Å²	40.5	81%	0.807	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.8	24.7	-178.8	-64.9	-28.1	0	0	0	112.8	G289	G289-N291 VanDerWaalsContact C-N 3.34Å; G289-N291 PolarHBondContact O-N 3.07Å
292	K	80.3	Confident	80.5	Confident	45 Å²	45	42.3 Å²	42.3	20%	0.196	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-70.9	140.9	178.3	67.5	-175.1	-175	173.3	0	111.1	Y285 E286 G289 E317	Y285-K292 HydrophobicContact CD1-CB 4.34Å; Y285-K292 HydrophobicContact CD1-CD 3.83Å; Y285-K292 HydrophobicContact CD1-CG 3.67Å; Y285-K292 HydrophobicContact CD2-CD 4.03Å; Y285-K292 HydrophobicContact CE1-CD 4.31Å; Y285-K292 HydrophobicContact CE1-CG 4.27Å; Y285-K292 HydrophobicContact CE2-CD 4.48Å; Y285-K292 HydrophobicContact CG-CB 4.4Å; Y285-K292 HydrophobicContact CG-CD 3.69Å; Y285-K292 HydrophobicContact CG-CG 3.94Å; E286-K292 WeakPolarHBondContact O-CA 3.49Å; G289-K292 WeakPolarHBondContact O-CG 3.23Å; K292-E317 IonicContact NZ-OE1 2.67Å; K292-E317 PolarHBondContact NZ-OE1 2.74Å; K292-E317 IonicContact NZ-OE2 3.65Å; K292-E317 PolarHBondContact NZ-OE2 3.36Å
293	V	80.8	Confident	79.8	Confident	82 Å²	82	46 Å²	46	50%	0.497	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	126.9	-178.4	179.5	0	0	0	0	109.2	Y285 E286 A295	Y285-V293 CarbonylContact C-O 3.48Å; Y285-V293 WeakPolarHBondContact CA-O 3.48Å; E286-V293 PolarHBondContact N-O 3.11Å; E286-V293 PolarHBondContact O-N 2.92Å; V293-A295 PolarHBondContact O-N 3.09Å
294	L	80.5	Confident	79.1	Confident	25 Å²	25	43.6 Å²	43.6	13%	0.131	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	121.9	177.2	-176.2	68.6	0	0	0	109.5	R283 Y285	R283-L294 HydrophobicContact CB-CD1 3.84Å; R283-L294 HydrophobicContact CG-CD1 4.22Å; Y285-L294 HydrophobicContact CD1-CB 3.95Å; Y285-L294 HydrophobicContact CD1-CD1 3.96Å; Y285-L294 HydrophobicContact CE1-CB 3.82Å; Y285-L294 HydrophobicContact CE1-CD1 3.61Å; Y285-L294 HydrophobicContact CE1-CG 4.29Å; Y285-L294 HydrophobicContact CE2-CD1 4.29Å; Y285-L294 HydrophobicContact CG-CD1 4.43Å
295	A	80.8	Confident	78.7	Confident	12 Å²	12	44.4 Å²	44.4	10%	0.099	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	-34.9	179.1	0	0	0	0	0	112.4	L284 E286 V293 L309	L284-A295 PolarHBondContact O-N 2.76Å; E286-A295 HydrophobicContact CG-CB 3.99Å; V293-A295 PolarHBondContact O-N 3.09Å; A295-L309 HydrophobicContact CB-CD2 3.78Å
296	A	79.6	Confident	78.6	Confident	11 Å²	11	43.7 Å²	43.7	9%	0.091	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	141.9	176.6	0	0	0	0	0	111.9	R283 L284 V307	R283-A296 WeakPolarHBondContact CA-O 3.46Å; L284-A296 HydrophobicContact CB-CB 4.5Å; L284-A296 HydrophobicContact CD1-CB 4.38Å; L284-A296 PolarHBondContact N-O 2.79Å; L284-A296 PolarHBondContact O-N 3.37Å; A296-V307 HydrophobicContact CB-CG1 3.89Å; A296-V307 HydrophobicContact CB-CG2 4.41Å
297	E	83.4	Confident	78.5	Confident	90 Å²	90	42.7 Å²	42.7	42%	0.421	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	123.7	168.7	-173.4	168.3	110.2	0	0	108.8	V281 R283	V281-E297 HydrophobicContact CG1-CG 3.28Å; R283-E297 HydrophobicContact CG-CG 4.28Å; R283-E297 IonicContact CZ-OE2 2.64Å; R283-E297 IonicContact NE-OE2 3.34Å; R283-E297 PolarHBondContact NE-OE2 2.84Å; R283-E297 IonicContact NH2-OE2 2.78Å; R283-E297 PolarHBondContact NH2-OE2 3.27Å; R283-E297 VanDerWaalsContact NH2-OE2 3.07Å
298	L	82.6	Confident	78.6	Confident	26 Å²	26	43.9 Å²	43.9	14%	0.136	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	133.6	-172.8	-54	174	0	0	0	110	F270 F273 L282 L284 P304 V307	F270-L298 HydrophobicContact CE1-CD1 4.25Å; F270-L298 HydrophobicContact CE2-CD1 3.9Å; F270-L298 HydrophobicContact CZ-CD1 3.53Å; F273-L298 HydrophobicContact CE1-CB 4.4Å; F273-L298 HydrophobicContact CE2-CB 4.09Å; F273-L298 HydrophobicContact CE2-CD1 4.48Å; F273-L298 HydrophobicContact CZ-CB 3.61Å; L282-L298 HydrophobicContact CB-CB 4.35Å; L282-L298 HydrophobicContact CD2-CD1 4.28Å; L282-L298 PolarHBondContact N-O 3.45Å; L282-L298 PolarHBondContact O-N 3.33Å; L284-L298 HydrophobicContact CD1-CD1 3.76Å; L284-L298 HydrophobicContact CD1-CG 4.29Å; L298-P304 HydrophobicContact CD1-CB 3.63Å; L298-P304 HydrophobicContact CD1-CG 4.14Å; L298-P304 HydrophobicContact CD2-CB 3.67Å; L298-P304 HydrophobicContact CG-CB 4.17Å; L298-V307 HydrophobicContact CD1-CG2 4.38Å
299	S	81.8	Confident	78.8	Confident	36 Å²	36	42.5 Å²	42.5	25%	0.252	26%	0.259	S	S	.	.			trans	-151.9	165	172.2	68.5	0	0	0	0	110.9	N278 D280	N278-S299 PolarHBondContact N-OG 2.82Å; N278-S299 VanDerWaalsContact N-OG 3.13Å; D280-S299 VanDerWaalsContact O-CB 3.3Å; D280-S299 WeakPolarHBondContact O-CB 3.29Å
300	G	78.2	Confident	79.2	Confident	6 Å²	6	44.3 Å²	44.3	6%	0.062	27%	0.267	C	S	.	.	S	Bend	trans	89.7	-160.4	178.4	0	0	0	0	0	114.4	F273 T275	F273-G300 WeakPolarHBondContact CE1-O 3.32Å; T275-G300 PolarHBondContact N-O 3.23Å; T275-G300 CarbonylContact O-C 3.56Å; T275-G300 WeakPolarHBondContact O-CA 3.32Å; T275-G300 PolarHBondContact O-N 3.47Å; T275-G300 PolarHBondContact OG1-N 3.22Å; T275-G300 PolarHBondContact OG1-O 3.16Å
301	S	71.1	Confident	79.9	Confident	94 Å²	94	41.9 Å²	41.9	66%	0.657	25%	0.25	S	S	*	.	S	Bend	trans	-109.1	-2.8	-177.6	54.5	0	0	0	0	114
302	A	69	Low	80.3	Confident	46 Å²	46	37.1 Å²	37.1	38%	0.38	23%	0.225	S	C	.	.	S	Bend	trans	-70.6	134	176.8	0	0	0	0	0	109.8	P304	A302-P304 WeakPolarHBondContact O-CD 3.46Å
303	P	72.9	Confident	80.7	Confident	77 Å²	77	37.9 Å²	37.9	50%	0.5	23%	0.229	S	C	.	.			trans	-63	122.9	177.6	24.7	-31.7	0	0	0	108.9	G305 R370 F394	P303-G305 PolarHBondContact O-N 2.87Å; P303-R370 PolarHBondContact O-NH2 2.85Å; P303-F394 HydrophobicContact CG-CZ 3.82Å
304	P	73.7	Confident	81.1	Confident	15 Å²	15	34 Å²	34	10%	0.097	21%	0.205	C	C	.	.			trans	-74.7	-11.3	-173.4	28.4	-36.5	0	0	0	113.8	F270 F273 L298 A302	F270-P304 HydrophobicContact CB-CG 3.91Å; F270-P304 HydrophobicContact CD1-CG 4.03Å; F270-P304 HydrophobicContact CD2-CB 4.28Å; F270-P304 HydrophobicContact CD2-CG 3.42Å; F270-P304 VanDerWaalsContact CD2-CG 3.42Å; F270-P304 HydrophobicContact CE1-CG 4.42Å; F270-P304 HydrophobicContact CE2-CB 4.35Å; F270-P304 HydrophobicContact CE2-CG 3.86Å; F270-P304 HydrophobicContact CG-CG 3.5Å; F270-P304 HydrophobicContact CZ-CG 4.34Å; F273-P304 HydrophobicContact CB-CG 4.19Å; F273-P304 HydrophobicContact CD1-CG 4.22Å; F273-P304 HydrophobicContact CD2-CG 3.96Å; F273-P304 HydrophobicContact CE2-CG 4.46Å; F273-P304 HydrophobicContact CG-CG 3.85Å; L298-P304 HydrophobicContact CD1-CB 3.63Å; L298-P304 HydrophobicContact CD1-CG 4.14Å; L298-P304 HydrophobicContact CD2-CB 3.67Å; L298-P304 HydrophobicContact CG-CB 4.17Å; A302-P304 WeakPolarHBondContact O-CD 3.46Å
305	G	79.6	Confident	81.5	Confident	17 Å²	17	32.9 Å²	32.9	18%	0.175	20%	0.199	C	C	.	.			trans	72.7	-157.3	-176.8	0	0	0	0	0	112.7	F270 P303	F270-G305 WeakPolarHBondContact CD2-O 3.38Å; P303-G305 PolarHBondContact O-N 2.87Å
306	T	83.6	Confident	81.9	Confident	9 Å²	9	32.3 Å²	32.3	6%	0.055	20%	0.195	C	C	.	.			trans	-86.2	129.5	177.8	-62.5	0	0	0	0	111.1	Q267 T269 D353	Q267-T306 HydrophobicContact CG-CG2 3.45Å; Q267-T306 VanDerWaalsContact CG-CG2 3.45Å; T269-T306 HydrophobicContact CG2-CG2 4.48Å; T306-D353 WeakPolarHBondContact CB-O 2.95Å; T306-D353 PolarHBondContact N-O 2.87Å; T306-D353 PolarHBondContact N-OD1 2.84Å; T306-D353 PolarHBondContact OG1-OD1 2.82Å
307	V	85.8	Confident	82.4	Confident	7 Å²	7	32.8 Å²	32.8	4%	0.042	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	126.9	173.5	-178	0	0	0	0	110.2	V268 F270 L284 A296 L298	V268-V307 HydrophobicContact CB-CB 4.49Å; V268-V307 PolarHBondContact N-O 3.2Å; V268-V307 PolarHBondContact O-N 2.83Å; F270-V307 HydrophobicContact CE2-CG2 4.05Å; L284-V307 HydrophobicContact CD2-CB 4.38Å; L284-V307 HydrophobicContact CD2-CG1 4.1Å; A296-V307 HydrophobicContact CB-CG1 3.89Å; A296-V307 HydrophobicContact CB-CG2 4.41Å; L298-V307 HydrophobicContact CD1-CG2 4.38Å
308	W	85.8	Confident	82.6	Confident	46 Å²	46	28.5 Å²	28.5	17%	0.174	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	121.1	179.6	-70.3	91.6	0	0	0	111.4	Q267 A336 T338 F357 R359	Q267-W308 HydrophobicContact CB-CD2 4.33Å; Q267-W308 HydrophobicContact CB-CE3 3.93Å; Q267-W308 HydrophobicContact CB-CH2 4.1Å; Q267-W308 HydrophobicContact CB-CZ2 4.46Å; Q267-W308 HydrophobicContact CB-CZ3 3.84Å; Q267-W308 HydrophobicContact CG-CD2 4.2Å; Q267-W308 HydrophobicContact CG-CE3 4.27Å; Q267-W308 HydrophobicContact CG-CH2 4.06Å; Q267-W308 HydrophobicContact CG-CZ2 3.96Å; Q267-W308 HydrophobicContact CG-CZ3 4.23Å; W308-A336 HydrophobicContact CH2-CB 4.11Å; W308-A336 HydrophobicContact CZ3-CB 3.64Å; W308-T338 HydrophobicContact CE3-CG2 4.02Å; W308-T338 HydrophobicContact CZ3-CG2 3.82Å; W308-F357 HydrophobicContact CB-CD1 4.26Å; W308-F357 HydrophobicContact CB-CE1 4.16Å; W308-F357 AromaticContact CD2-CE1 3.69Å; W308-F357 HydrophobicContact CD2-CE1 3.69Å; W308-F357 HydrophobicContact CD2-CZ 4.03Å; W308-F357 AromaticContact CE2-CZ 3.97Å; W308-F357 AromaticContact CE3-CE1 3.98Å; W308-F357 HydrophobicContact CE3-CE1 3.98Å; W308-F357 HydrophobicContact CE3-CZ 4.39Å; W308-F357 HydrophobicContact CG-CD1 4.21Å; W308-F357 AromaticContact CG-CE1 3.76Å; W308-F357 HydrophobicContact CG-CE1 3.76Å; W308-F357 HydrophobicContact CG-CZ 4.37Å; W308-F357 HydrophobicContact CZ2-CZ 4.3Å; W308-R359 PolarHBondContact O-NH2 2.8Å
309	L	86.3	Confident	82.8	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	111.8	173.3	-56.9	168.8	0	0	0	108.7	I258 S265 A266 V268 L284 E286 A295 T311	I258-L309 HydrophobicContact CD1-CD1 4.43Å; S265-L309 CarbonylContact C-O 3.56Å; S265-L309 WeakPolarHBondContact CA-O 3.45Å; S265-L309 VanDerWaalsContact CB-O 3.29Å; S265-L309 WeakPolarHBondContact CB-O 3.27Å; A266-L309 HydrophobicContact CB-CB 4.26Å; A266-L309 PolarHBondContact N-O 2.89Å; A266-L309 PolarHBondContact O-N 3.31Å; V268-L309 HydrophobicContact CG2-CD1 3.77Å; V268-L309 HydrophobicContact CG2-CG 4.42Å; L284-L309 HydrophobicContact CB-CD2 4.06Å; L284-L309 HydrophobicContact CD2-CD1 4.31Å; E286-L309 HydrophobicContact CG-CB 4.33Å; E286-L309 HydrophobicContact CG-CD2 4.01Å; E286-L309 WeakPolarHBondContact OE1-CA 3.5Å; A295-L309 HydrophobicContact CB-CD2 3.78Å; L309-T311 PolarHBondContact O-N 2.8Å
310	L	83.1	Confident	82.9	Confident	45 Å²	45	28.4 Å²	28.4	24%	0.236	18%	0.175	C	C	.	.			trans	-87	15.3	-168.6	-61.9	171.5	0	0	0	114.1	S265 E286 T338 F357 R359 L414	S265-L310 WeakPolarHBondContact OG-CA 3.36Å; E286-L310 PolarHBondContact OE1-N 3Å; L310-T338 HydrophobicContact CD2-CG2 4.16Å; L310-F357 HydrophobicContact CD2-CD1 4.24Å; L310-F357 HydrophobicContact CD2-CE1 4.3Å; L310-R359 VanDerWaalsContact CD1-NH2 3.3Å; L310-R359 VanDerWaalsContact CG-NH2 3.35Å; L310-L414 HydrophobicContact CD1-CD1 3.79Å; L310-L414 HydrophobicContact CD1-CD2 3.38Å; L310-L414 HydrophobicContact CD1-CG 4.19Å
311	T	84.4	Confident	82.9	Confident	40 Å²	40	30.4 Å²	30.4	25%	0.245	18%	0.184	C	C	.	.	S	Bend	trans	-115	153.1	-178.5	47.4	0	0	0	0	110.2	E286 G287 L309 Q313 S314	E286-T311 WeakPolarHBondContact CA-OG1 3.46Å; E286-T311 HydrophobicContact CB-CG2 3.86Å; E286-T311 HydrophobicContact CG-CG2 4.35Å; G287-T311 PolarHBondContact N-OG1 3.38Å; L309-T311 PolarHBondContact O-N 2.8Å; T311-Q313 WeakPolarHBondContact CB-O 3.28Å; T311-Q313 PolarHBondContact O-N 2.7Å; T311-Q313 PolarHBondContact OG1-O 2.69Å; T311-S314 PolarHBondContact OG1-OG 3.23Å; T311-S314 VanDerWaalsContact OG1-OG 3.11Å
312	D	83.3	Confident	82.8	Confident	51 Å²	51	28.5 Å²	28.5	27%	0.273	17%	0.171	S	C	.	.	S	Bend	trans	-73.3	-18.2	175.5	64	-34.9	0	0	0	112.4	V260	V260-D312 HydrophobicContact CG2-CB 4.34Å; V260-D312 WeakPolarHBondContact CG2-O 3.49Å; V260-D312 PolarHBondContact N-O 2.88Å
313	Q	88.5	Confident	82.2	Confident	60 Å²	60	32.9 Å²	32.9	28%	0.28	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	128.5	176.6	-60.2	-178.6	65	0	0	109.7	I258 R259 G287 V288 T311	I258-Q313 CarbonylContact O-C 3.49Å; I258-Q313 WeakPolarHBondContact O-CA 3.12Å; R259-Q313 HydrophobicContact CG-CG 4.3Å; G287-Q313 WeakPolarHBondContact CA-O 3.42Å; G287-Q313 PolarHBondContact N-O 2.82Å; V288-Q313 HydrophobicContact CG1-CB 4.04Å; V288-Q313 HydrophobicContact CG2-CB 4.47Å; T311-Q313 WeakPolarHBondContact CB-O 3.28Å; T311-Q313 PolarHBondContact O-N 2.7Å; T311-Q313 PolarHBondContact OG1-O 2.69Å
314	S	89.7	Confident	81.7	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	150.4	-177.5	-50.7	0	0	0	0	111.3	I257 I258 Y285 T311	I257-S314 CarbonylContact C-O 3.43Å; I257-S314 WeakPolarHBondContact CA-O 2.97Å; I258-S314 PolarHBondContact N-O 2.97Å; I258-S314 PolarHBondContact O-N 2.78Å; Y285-S314 CarbonylContact O-C 3.53Å; Y285-S314 WeakPolarHBondContact O-CA 3.41Å; Y285-S314 VanDerWaalsContact O-CB 3.27Å; Y285-S314 WeakPolarHBondContact O-CB 3.32Å; T311-S314 PolarHBondContact OG1-OG 3.23Å; T311-S314 VanDerWaalsContact OG1-OG 3.11Å
315	T	88.8	Confident	81.5	Confident	2 Å²	2	36.5 Å²	36.5	1%	0.012	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	133.4	-179.1	-52.3	0	0	0	0	109.8	R255 W256 Y285 G287 E317	R255-T315 HydrophobicContact CG-CG2 3.92Å; W256-T315 CarbonylContact O-C 3.55Å; W256-T315 WeakPolarHBondContact O-CA 3.29Å; Y285-T315 WeakPolarHBondContact CA-O 3.21Å; Y285-T315 WeakPolarHBondContact CB-O 3.45Å; Y285-T315 PolarHBondContact N-O 3.46Å; Y285-T315 PolarHBondContact O-N 3.36Å; G287-T315 PolarHBondContact O-N 2.89Å; G287-T315 PolarHBondContact O-OG1 2.9Å; T315-E317 HydrophobicContact CG2-CG 4.17Å
316	V	89.9	Confident	81.2	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	130.1	176.2	-178.5	0	0	0	0	108.3	F240 R255 W256 I258 L282 R283 L284	F240-V316 HydrophobicContact CE2-CG1 3.79Å; F240-V316 HydrophobicContact CZ-CG1 4.19Å; F240-V316 HydrophobicContact CZ-CG2 4.31Å; R255-V316 CarbonylContact C-O 3.57Å; R255-V316 VanDerWaalsContact CA-O 3.23Å; R255-V316 WeakPolarHBondContact CA-O 3.19Å; W256-V316 HydrophobicContact CB-CB 4.36Å; W256-V316 HydrophobicContact CE3-CB 4.18Å; W256-V316 HydrophobicContact CE3-CG1 3.96Å; W256-V316 HydrophobicContact CZ3-CG1 4.42Å; W256-V316 PolarHBondContact N-O 3.27Å; W256-V316 PolarHBondContact O-N 2.8Å; I258-V316 HydrophobicContact CD1-CG2 3.94Å; L282-V316 HydrophobicContact CD1-CG1 3.59Å; L282-V316 HydrophobicContact CG-CG1 4.45Å; R283-V316 CarbonylContact O-C 3.48Å; R283-V316 WeakPolarHBondContact O-CA 3.02Å; L284-V316 HydrophobicContact CD2-CG2 4.4Å; L284-V316 HydrophobicContact CG-CG1 4.26Å; L284-V316 HydrophobicContact CG-CG2 4.24Å
317	E	89.1	Confident	80.9	Confident	22 Å²	22	40.7 Å²	40.7	10%	0.103	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	133.1	-177.8	-66.9	-177.9	161.7	0	0	111.3	F253 C254 R255 L282 R283 Y285 K292 T315	F253-E317 HydrophobicContact CE2-CB 4.29Å; F253-E317 HydrophobicContact CE2-CG 4.44Å; F253-E317 HydrophobicContact CZ-CG 4.25Å; C254-E317 CarbonylContact O-C 3.56Å; C254-E317 VanDerWaalsContact O-CA 3.29Å; C254-E317 WeakPolarHBondContact O-CA 3.35Å; R255-E317 HydrophobicContact CB-CG 4.26Å; R255-E317 WeakPolarHBondContact CD-OE1 3.32Å; R255-E317 HydrophobicContact CG-CG 4.01Å; L282-E317 CarbonylContact C-O 3.57Å; L282-E317 WeakPolarHBondContact CA-O 3.43Å; R283-E317 PolarHBondContact N-O 2.97Å; R283-E317 PolarHBondContact O-N 3.13Å; Y285-E317 HydrophobicContact CD2-CG 4.5Å; Y285-E317 HydrophobicContact CE2-CB 4.27Å; Y285-E317 HydrophobicContact CE2-CG 4.21Å; Y285-E317 WeakPolarHBondContact CE2-OE2 3.5Å; K292-E317 IonicContact NZ-OE1 2.67Å; K292-E317 PolarHBondContact NZ-OE1 2.74Å; K292-E317 IonicContact NZ-OE2 3.65Å; K292-E317 PolarHBondContact NZ-OE2 3.36Å; T315-E317 HydrophobicContact CG2-CG 4.17Å
318	F	88.3	Confident	80.8	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	131.4	174.9	178.4	-116.3	0	0	0	110	Y248 F253 C254 W256 T275 D280 L282 F329	Y248-F318 HydrophobicContact CD1-CZ 4.32Å; Y248-F318 AromaticContact CD2-CE1 3.93Å; Y248-F318 HydrophobicContact CD2-CE1 3.93Å; Y248-F318 AromaticContact CD2-CZ 3.91Å; Y248-F318 HydrophobicContact CD2-CZ 3.91Å; Y248-F318 HydrophobicContact CE1-CZ 4.39Å; Y248-F318 HydrophobicContact CE2-CE1 4.46Å; Y248-F318 HydrophobicContact CE2-CZ 4.01Å; Y248-F318 HydrophobicContact CG-CE1 4.05Å; Y248-F318 HydrophobicContact CG-CZ 4.09Å; F253-F318 WeakPolarHBondContact CA-O 3.36Å; C254-F318 HydrophobicContact CB-CB 4.39Å; C254-F318 PolarHBondContact N-O 3.47Å; C254-F318 PolarHBondContact O-N 3.31Å; W256-F318 HydrophobicContact CH2-CB 4.17Å; W256-F318 HydrophobicContact CZ3-CB 3.87Å; T275-F318 HydrophobicContact CG2-CE2 3.95Å; T275-F318 HydrophobicContact CG2-CZ 4.4Å; D280-F318 HydrophobicContact CB-CE2 4.41Å; L282-F318 HydrophobicContact CB-CD2 4.29Å; L282-F318 HydrophobicContact CD1-CB 4Å; L282-F318 HydrophobicContact CD1-CD2 4.49Å; F318-F329 HydrophobicContact CB-CE1 4.08Å; F318-F329 HydrophobicContact CB-CZ 4.25Å; F318-F329 HydrophobicContact CD1-CE1 4.21Å; F318-F329 HydrophobicContact CD2-CD1 4.36Å; F318-F329 AromaticContact CD2-CE1 3.6Å; F318-F329 HydrophobicContact CD2-CE1 3.6Å; F318-F329 HydrophobicContact CE2-CD1 4.41Å; F318-F329 HydrophobicContact CE2-CE1 4.04Å; F318-F329 AromaticContact CG-CE1 3.69Å; F318-F329 HydrophobicContact CG-CE1 3.69Å; F318-F329 HydrophobicContact CG-CZ 4.33Å
319	T	85.4	Confident	80.8	Confident	44 Å²	44	38.4 Å²	38.4	27%	0.27	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	127.2	177.9	47	0	0	0	0	109.8	V252 F253 D280 V281	V252-T319 WeakPolarHBondContact O-CA 3.46Å; F253-T319 HydrophobicContact CD2-CG2 3.56Å; F253-T319 HydrophobicContact CE2-CG2 3.99Å; D280-T319 WeakPolarHBondContact CA-O 3.15Å; V281-T319 PolarHBondContact N-O 2.87Å; V281-T319 VanDerWaalsContact N-O 3.11Å; V281-T319 PolarHBondContact O-N 2.85Å; V281-T319 VanDerWaalsContact O-N 3.09Å; V281-T319 PolarHBondContact O-OG1 3.36Å
320	S	84.3	Confident	80.8	Confident	16 Å²	16	43.4 Å²	43.4	11%	0.112	23%	0.231	C	C	.	.			trans	-115.2	154.2	169.8	66.4	0	0	0	0	114.1	N249 N251 V252 D280	N249-S320 PolarHBondContact O-OG 3.25Å; N251-S320 WeakPolarHBondContact CA-O 3.43Å; N251-S320 PolarHBondContact N-OG 3.19Å; V252-S320 PolarHBondContact N-OG 3.32Å; V252-S320 PolarHBondContact O-N 3.28Å; D280-S320 WeakPolarHBondContact OD1-CA 3.46Å
321	D	79.5	Confident	81.1	Confident	47 Å²	47	41.3 Å²	41.3	25%	0.251	22%	0.219	S	C	.	.			trans	-89.6	-172.5	178.2	98.9	-16.9	0	0	0	113.6	N250 N251 I279 D280 F323	N250-D321 CarbonylContact C-O 3.48Å; N250-D321 VanDerWaalsContact CA-O 3.29Å; N250-D321 WeakPolarHBondContact CA-O 3.3Å; N250-D321 VanDerWaalsContact CB-O 3.32Å; N250-D321 WeakPolarHBondContact CB-O 3.41Å; N251-D321 PolarHBondContact N-O 3.35Å; I279-D321 HydrophobicContact CG2-CB 3.68Å; I279-D321 WeakPolarHBondContact CG2-OD2 3.01Å; D280-D321 PolarHBondContact OD1-N 2.98Å; D321-F323 PolarHBondContact OD1-N 3.21Å
322	S	68.9	Low	81.3	Confident	54 Å²	54	40.6 Å²	40.6	38%	0.378	22%	0.216	S	C	.	.	S	Bend	trans	-84.5	-3.6	-176.6	55.2	0	0	0	0	116	N250 N251	N250-S322 PolarHBondContact ND2-O 3Å; N251-S322 WeakPolarHBondContact OD1-CA 3.48Å; N251-S322 WeakPolarHBondContact OD1-CB 3.3Å
323	F	56.2	Low	81.7	Confident	139 Å²	139	38.4 Å²	38.4	61%	0.61	20%	0.204	S	C	*	.	S	Bend	trans	-127.3	167.8	-174.9	-61	-78.6	0	0	0	110.2	D321	D321-F323 PolarHBondContact OD1-N 3.21Å
324	N	61.9	Low	81.7	Confident	105 Å²	105	42 Å²	42	56%	0.561	22%	0.215	S	C	*	.			trans	45.1	86	170.8	-61.4	-21.3	0	0	0	119	E276	E276-N324 PolarHBondContact OE1-ND2 2.85Å
325	S	68.9	Low	81.6	Confident	62 Å²	62	43.3 Å²	43.3	43%	0.434	23%	0.226	S	C	.	.			trans	-86.8	115	169.4	55.3	0	0	0	0	112.7	Y248 N250	Y248-S325 WeakPolarHBondContact O-CB 3.48Å; N250-S325 WeakPolarHBondContact OD1-CB 3.3Å
326	L	73.9	Confident	81.3	Confident	69 Å²	69	44.1 Å²	44.1	36%	0.361	23%	0.233	S	C	.	.			trans	-92.9	176.2	171.4	-75	178.6	0	0	0	112.4	A247 Y248 E274 G328	A247-L326 VanDerWaalsContact CA-O 3.29Å; A247-L326 WeakPolarHBondContact CA-O 3.24Å; A247-L326 WeakPolarHBondContact CB-O 3.45Å; Y248-L326 WeakPolarHBondContact CD1-O 3.27Å; Y248-L326 HydrophobicContact CE1-CB 3.9Å; Y248-L326 WeakPolarHBondContact CE1-O 3.47Å; Y248-L326 PolarHBondContact N-O 3.44Å; E274-L326 WeakPolarHBondContact O-CB 3Å; L326-G328 PolarHBondContact O-N 2.8Å; L326-G328 VanDerWaalsContact O-N 3.09Å
327	P	77.5	Confident	80.9	Confident	46 Å²	46	49.5 Å²	49.5	30%	0.299	26%	0.262	S	S	.	.			trans	-61.8	-15.8	179.4	-25.8	37.1	0	0	0	115.1	D246 E274	D246-P327 VanDerWaalsContact O-CA 3.25Å; D246-P327 WeakPolarHBondContact O-CA 3.33Å; E274-P327 WeakPolarHBondContact OE2-CD 3.45Å; E274-P327 VanDerWaalsContact OE2-CG 3.29Å; E274-P327 WeakPolarHBondContact OE2-CG 3.44Å
328	G	83	Confident	80.2	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	77.1	-152	175.2	0	0	0	0	0	112.8	S242 Y248 E274 L326	S242-G328 WeakPolarHBondContact OG-CA 3.4Å; Y248-G328 VanDerWaalsContact CD1-CA 3.45Å; E274-G328 PolarHBondContact N-O 3.41Å; E274-G328 CarbonylContact O-C 3.59Å; E274-G328 WeakPolarHBondContact O-CA 3.16Å; E274-G328 PolarHBondContact O-N 2.87Å; L326-G328 PolarHBondContact O-N 2.8Å; L326-G328 VanDerWaalsContact O-N 3.09Å
329	F	85.8	Confident	79.4	Confident	4 Å²	4	54 Å²	54	2%	0.018	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	153.5	-179.1	69.5	-90.2	0	0	0	114	F240 R241 S242 W256 F270 Q272 F273 T275 L282 F318 A331	F240-F329 AromaticContact CD2-CE2 3.74Å; F240-F329 HydrophobicContact CD2-CE2 3.74Å; F240-F329 HydrophobicContact CE2-CD2 4.49Å; F240-F329 AromaticContact CE2-CE2 3.67Å; F240-F329 HydrophobicContact CE2-CE2 3.67Å; F240-F329 HydrophobicContact CE2-CZ 4.47Å; R241-F329 WeakPolarHBondContact CA-O 3.47Å; S242-F329 PolarHBondContact N-O 2.99Å; S242-F329 VanDerWaalsContact N-O 3.08Å; S242-F329 PolarHBondContact OG-N 3.28Å; S242-F329 PolarHBondContact OG-O 2.88Å; W256-F329 AromaticContact CH2-CZ 3.87Å; W256-F329 HydrophobicContact CH2-CZ 3.87Å; W256-F329 AromaticContact CZ3-CZ 3.97Å; W256-F329 HydrophobicContact CZ3-CZ 3.97Å; F270-F329 HydrophobicContact CE1-CD2 4.48Å; Q272-F329 CarbonylContact O-C 3.56Å; Q272-F329 WeakPolarHBondContact O-CA 3.21Å; Q272-F329 WeakPolarHBondContact O-CB 3.07Å; F273-F329 HydrophobicContact CB-CB 4.46Å; F273-F329 HydrophobicContact CD2-CB 3.55Å; F273-F329 HydrophobicContact CD2-CG 4.26Å; F273-F329 HydrophobicContact CE2-CB 4.15Å; F273-F329 HydrophobicContact CE2-CG 4.45Å; F273-F329 HydrophobicContact CG-CB 4.35Å; T275-F329 HydrophobicContact CG2-CD1 4.39Å; L282-F329 HydrophobicContact CD1-CE1 3.81Å; L282-F329 HydrophobicContact CD1-CE2 4.15Å; L282-F329 HydrophobicContact CD1-CZ 3.51Å; L282-F329 HydrophobicContact CD2-CD1 4.28Å; L282-F329 HydrophobicContact CD2-CD2 4.17Å; L282-F329 HydrophobicContact CD2-CE1 4.17Å; L282-F329 HydrophobicContact CD2-CE2 4.07Å; L282-F329 HydrophobicContact CD2-CG 4.29Å; L282-F329 HydrophobicContact CD2-CZ 4.07Å; L282-F329 HydrophobicContact CG-CE1 4.41Å; L282-F329 HydrophobicContact CG-CZ 4.38Å; F318-F329 HydrophobicContact CB-CE1 4.08Å; F318-F329 HydrophobicContact CB-CZ 4.25Å; F318-F329 HydrophobicContact CD1-CE1 4.21Å; F318-F329 HydrophobicContact CD2-CD1 4.36Å; F318-F329 AromaticContact CD2-CE1 3.6Å; F318-F329 HydrophobicContact CD2-CE1 3.6Å; F318-F329 HydrophobicContact CE2-CD1 4.41Å; F318-F329 HydrophobicContact CE2-CE1 4.04Å; F318-F329 AromaticContact CG-CE1 3.69Å; F318-F329 HydrophobicContact CG-CE1 3.69Å; F318-F329 HydrophobicContact CG-CZ 4.33Å; F329-A331 HydrophobicContact CD2-CB 4.29Å
330	R	87.1	Confident	78.5	Confident	106 Å²	106	55.3 Å²	55.3	40%	0.4	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	118.2	168.4	-168.5	-173.5	-67.8	-171.4	1.3	109.3	Q271 Q272	Q271-R330 PolarHBondContact N-O 3.28Å; Q271-R330 VanDerWaalsContact OE1-CG 3.27Å; Q271-R330 PolarHBondContact OE1-O 3.26Å; Q272-R330 HydrophobicContact CB-CB 4.36Å; Q272-R330 PolarHBondContact O-N 2.96Å
331	A	88.3	Confident	78.2	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	148.7	-176.6	0	0	0	0	0	111.8	S239 F240 V268 T269 F270 F329	S239-A331 VanDerWaalsContact CA-O 3.27Å; S239-A331 WeakPolarHBondContact CA-O 3.44Å; S239-A331 WeakPolarHBondContact CB-O 3.27Å; F240-A331 HydrophobicContact CD1-CB 4.34Å; F240-A331 HydrophobicContact CD2-CB 4.25Å; F240-A331 HydrophobicContact CE1-CB 3.81Å; F240-A331 HydrophobicContact CE2-CB 3.7Å; F240-A331 HydrophobicContact CZ-CB 3.46Å; F240-A331 VanDerWaalsContact CZ-CB 3.46Å; F240-A331 PolarHBondContact N-O 3.18Å; F240-A331 PolarHBondContact O-N 2.97Å; F240-A331 VanDerWaalsContact O-O 3.1Å; V268-A331 HydrophobicContact CG1-CB 4.2Å; T269-A331 CarbonylContact O-C 3.49Å; T269-A331 VanDerWaalsContact O-CA 3.31Å; T269-A331 WeakPolarHBondContact O-CA 3.37Å; F270-A331 HydrophobicContact CD1-CB 3.75Å; F270-A331 HydrophobicContact CE1-CB 3.8Å; F270-A331 HydrophobicContact CG-CB 4.44Å; F329-A331 HydrophobicContact CD2-CB 4.29Å
332	S	89.4	Confident	78.2	Confident	26 Å²	26	56.6 Å²	56.6	18%	0.182	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	139.7	170.5	51.6	0	0	0	0	111.1	G238 T269 Q271	G238-S332 CarbonylContact O-C 3.55Å; G238-S332 VanDerWaalsContact O-CA 3.23Å; G238-S332 WeakPolarHBondContact O-CA 3.22Å; G238-S332 WeakPolarHBondContact O-CB 3.14Å; T269-S332 PolarHBondContact N-O 3.08Å; T269-S332 PolarHBondContact O-N 3.22Å; T269-S332 PolarHBondContact OG1-O 2.97Å; T269-S332 PolarHBondContact OG1-OG 3.01Å; Q271-S332 PolarHBondContact NE2-OG 3.42Å
333	F	90.8	Very high	78.7	Confident	4 Å²	4	55.1 Å²	55.1	2%	0.018	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	148.9	172.7	74.7	-88.5	0	0	0	111.1	L233 S237 G238 I258 V260 Q267 V268	L233-F333 HydrophobicContact CB-CE1 3.65Å; L233-F333 HydrophobicContact CB-CZ 3.88Å; L233-F333 HydrophobicContact CD1-CD1 4.42Å; L233-F333 HydrophobicContact CD1-CE1 3.88Å; L233-F333 HydrophobicContact CG-CE1 4.32Å; S237-F333 WeakPolarHBondContact CA-O 3.34Å; G238-F333 PolarHBondContact N-O 3.29Å; G238-F333 WeakPolarHBondContact O-CD1 3.42Å; G238-F333 PolarHBondContact O-N 2.93Å; I258-F333 HydrophobicContact CD1-CB 4.24Å; I258-F333 HydrophobicContact CD1-CD1 4.08Å; I258-F333 HydrophobicContact CD1-CG 4.17Å; I258-F333 HydrophobicContact CG1-CD1 4.21Å; I258-F333 HydrophobicContact CG1-CE1 4.36Å; I258-F333 HydrophobicContact CG2-CD1 4.24Å; I258-F333 HydrophobicContact CG2-CD2 3.64Å; I258-F333 HydrophobicContact CG2-CE1 4.23Å; I258-F333 HydrophobicContact CG2-CE2 3.65Å; I258-F333 HydrophobicContact CG2-CG 3.95Å; I258-F333 HydrophobicContact CG2-CZ 3.95Å; V260-F333 HydrophobicContact CG1-CD2 4.31Å; V260-F333 HydrophobicContact CG1-CE2 4.13Å; Q267-F333 CarbonylContact O-C 3.33Å; Q267-F333 WeakPolarHBondContact O-CA 3.46Å; V268-F333 HydrophobicContact CG2-CB 4.12Å
334	R	89.3	Confident	79.9	Confident	136 Å²	136	50.7 Å²	50.7	51%	0.513	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	139.3	170.1	66.8	-174.6	-168.9	-158.4	4.6	110.1	P236 Q267	P236-R334 CarbonylContact O-C 3.54Å; P236-R334 WeakPolarHBondContact O-CA 3.48Å; Q267-R334 HydrophobicContact CB-CG 3.86Å; Q267-R334 VanDerWaalsContact CD-NE 3.29Å; Q267-R334 HydrophobicContact CG-CG 4.39Å; Q267-R334 PolarHBondContact N-O 2.88Å; Q267-R334 PolarHBondContact O-N 2.99Å
335	A	87.4	Confident	80.8	Confident	27 Å²	27	50.3 Å²	50.3	22%	0.223	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	132.5	174.3	0	0	0	0	0	109.8	P236 V260 L264 S265	P236-A335 PolarHBondContact O-N 3.06Å; V260-A335 HydrophobicContact CB-CB 4.17Å; V260-A335 HydrophobicContact CG1-CB 3.95Å; L264-A335 HydrophobicContact CB-CB 4.29Å; L264-A335 HydrophobicContact CD1-CB 3.9Å; S265-A335 CarbonylContact O-C 3.52Å; S265-A335 WeakPolarHBondContact O-CA 3.23Å
336	A	83.3	Confident	81.3	Confident	20 Å²	20	49 Å²	49	17%	0.165	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	143.2	-178.5	0	0	0	0	0	110.2	S265 W308	S265-A336 PolarHBondContact N-O 2.68Å; S265-A336 PolarHBondContact O-N 3.34Å; W308-A336 HydrophobicContact CH2-CB 4.11Å; W308-A336 HydrophobicContact CZ3-CB 3.64Å
337	D	81.5	Confident	81.7	Confident	113 Å²	113	45.7 Å²	45.7	60%	0.604	27%	0.269	S	S	*	.			trans	-86.3	114	174.8	-175.4	0.9	0	0	0	109.5	L264 A339	L264-D337 HydrophobicContact CD2-CB 3.92Å; D337-A339 WeakPolarHBondContact OD1-CB 3.21Å; D337-A339 PolarHBondContact OD1-N 2.48Å
338	T	74.4	Confident	81.9	Confident	25 Å²	25	46.1 Å²	46.1	15%	0.153	27%	0.273	C	S	.	.			trans	-106.5	3.6	178.6	55.7	0	0	0	0	112.6	S265 W308 L310 G340 L341 F357	S265-T338 PolarHBondContact OG-OG1 2.89Å; W308-T338 HydrophobicContact CE3-CG2 4.02Å; W308-T338 HydrophobicContact CZ3-CG2 3.82Å; L310-T338 HydrophobicContact CD2-CG2 4.16Å; T338-G340 VanDerWaalsContact C-N 3.27Å; T338-G340 PolarHBondContact O-N 3.39Å; T338-L341 HydrophobicContact CG2-CD1 4.06Å; T338-F357 HydrophobicContact CG2-CE1 4.32Å
339	A	69.6	Low	81.9	Confident	91 Å²	91	46.3 Å²	46.3	75%	0.752	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-20.2	-176.9	0	0	0	0	0	113.3	D337	D337-A339 WeakPolarHBondContact OD1-CB 3.21Å; D337-A339 PolarHBondContact OD1-N 2.48Å
340	G	67.8	Low	81.5	Confident	72 Å²	72	48.4 Å²	48.4	74%	0.742	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	6.2	-178.9	0	0	0	0	0	116.2	T338 S342	T338-G340 VanDerWaalsContact C-N 3.27Å; T338-G340 PolarHBondContact O-N 3.39Å; G340-S342 PolarHBondContact O-N 3.02Å
341	L	76.9	Confident	81.3	Confident	40 Å²	40	43.4 Å²	43.4	21%	0.209	27%	0.271	C	S	.	.			trans	-65.4	131.7	-174.5	-70.8	167.6	0	0	0	112.2	T338 E345 K346 F357	T338-L341 HydrophobicContact CG2-CD1 4.06Å; L341-E345 HydrophobicContact CD2-CB 4.1Å; L341-K346 HydrophobicContact CB-CG 4.08Å; L341-K346 WeakPolarHBondContact O-CE 3.21Å; L341-F357 HydrophobicContact CD1-CD1 4.44Å; L341-F357 HydrophobicContact CD1-CE1 3.81Å; L341-F357 HydrophobicContact CD1-CE2 4.03Å; L341-F357 HydrophobicContact CD1-CZ 3.58Å; L341-F357 HydrophobicContact CD2-CE2 4.45Å; L341-F357 HydrophobicContact CD2-CZ 4.34Å
342	S	80.2	Confident	80.8	Confident	50 Å²	50	45.5 Å²	45.5	35%	0.35	28%	0.28	S	S	.	.			trans	-74.5	156.6	174.8	66.8	0	0	0	0	111.8	G340 P344 E345 K346	G340-S342 PolarHBondContact O-N 3.02Å; S342-P344 VanDerWaalsContact C-CD 3.49Å; S342-P344 VanDerWaalsContact C-N 3.32Å; S342-E345 WeakPolarHBondContact CB-OE2 3.31Å; S342-E345 PolarHBondContact N-OE2 2.87Å; S342-E345 PolarHBondContact O-N 2.84Å; S342-E345 VanDerWaalsContact O-N 3.12Å; S342-E345 VanDerWaalsContact OG-CG 3.29Å; S342-E345 WeakPolarHBondContact OG-CG 3.41Å; S342-E345 PolarHBondContact OG-OE2 2.79Å; S342-K346 WeakPolarHBondContact O-CG 3.48Å; S342-K346 PolarHBondContact O-N 3.12Å; S342-K346 VanDerWaalsContact O-N 3.08Å
343	N	79.6	Confident	80.1	Confident	22 Å²	22	49.4 Å²	49.4	12%	0.118	30%	0.299	C	S	.	.	H	α-helix	trans	-54.6	-39.7	177.5	-74.3	-8.6	0	0	0	113.9	K346 L347 L416 T417 L502	N343-K346 PolarHBondContact O-N 3.19Å; N343-L347 PolarHBondContact O-N 3.33Å; N343-L416 HydrophobicContact CB-CD2 3.9Å; N343-T417 PolarHBondContact ND2-O 3Å; N343-T417 PolarHBondContact OD1-N 2.74Å; N343-T417 PolarHBondContact OD1-OG1 2.97Å; N343-L502 HydrophobicContact CB-CD2 4.24Å
344	P	81.3	Confident	79.5	Confident	47 Å²	47	49.2 Å²	49.2	31%	0.305	30%	0.298	S	S	.	.	H	α-helix	trans	-59.5	-46.5	173.2	-26.2	36.1	0	0	0	113	S342 K346 L347 S348	S342-P344 VanDerWaalsContact C-CD 3.49Å; S342-P344 VanDerWaalsContact C-N 3.32Å; P344-K346 VanDerWaalsContact C-N 3.26Å; P344-K346 PolarHBondContact O-N 3.35Å; P344-L347 PolarHBondContact O-N 3.13Å; P344-S348 VanDerWaalsContact O-CB 3.24Å; P344-S348 WeakPolarHBondContact O-CB 3.37Å; P344-S348 PolarHBondContact O-N 2.82Å; P344-S348 PolarHBondContact O-OG 2.81Å
345	E	79.8	Confident	79.1	Confident	96 Å²	96	44.3 Å²	44.3	45%	0.449	28%	0.284	S	S	.	.	H	α-helix	trans	-65.8	-27.9	-179.9	-68.3	164.2	150.7	0	0	112.9	L341 S342 F357	L341-E345 HydrophobicContact CD2-CB 4.1Å; S342-E345 WeakPolarHBondContact CB-OE2 3.31Å; S342-E345 PolarHBondContact N-OE2 2.87Å; S342-E345 PolarHBondContact O-N 2.84Å; S342-E345 VanDerWaalsContact O-N 3.12Å; S342-E345 VanDerWaalsContact OG-CG 3.29Å; S342-E345 WeakPolarHBondContact OG-CG 3.41Å; S342-E345 PolarHBondContact OG-OE2 2.79Å; E345-F357 WeakPolarHBondContact O-CD2 3.42Å
346	K	80.6	Confident	78.9	Confident	34 Å²	34	44.2 Å²	44.2	15%	0.148	28%	0.281	C	S	.	.	H	α-helix	trans	-71.3	-28.2	175.9	-70.5	175.2	178.9	179.3	0	113.4	L341 S342 N343 P344 L414 P415 L416	L341-K346 HydrophobicContact CB-CG 4.08Å; L341-K346 WeakPolarHBondContact O-CE 3.21Å; S342-K346 WeakPolarHBondContact O-CG 3.48Å; S342-K346 PolarHBondContact O-N 3.12Å; S342-K346 VanDerWaalsContact O-N 3.08Å; N343-K346 PolarHBondContact O-N 3.19Å; P344-K346 VanDerWaalsContact C-N 3.26Å; P344-K346 PolarHBondContact O-N 3.35Å; K346-L414 HydrophobicContact CD-CB 4.41Å; K346-L414 HydrophobicContact CG-CD1 4.47Å; K346-P415 PolarHBondContact NZ-O 3.36Å; K346-P415 VanDerWaalsContact NZ-O 3.13Å; K346-L416 HydrophobicContact CB-CD2 4.35Å; K346-L416 HydrophobicContact CD-CD2 4.34Å
347	L	81.8	Confident	78.9	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-108.8	-29.4	-176.8	-95.1	84.1	0	0	0	114.2	N343 P344 C349 W358 L416 L425 V481 L502	N343-L347 PolarHBondContact O-N 3.33Å; P344-L347 PolarHBondContact O-N 3.13Å; L347-C349 PolarHBondContact O-N 2.83Å; L347-C349 VanDerWaalsContact O-N 3.16Å; L347-W358 HydrophobicContact CB-CZ2 4.25Å; L347-W358 HydrophobicContact CD2-CH2 4.11Å; L347-W358 HydrophobicContact CD2-CZ2 4.25Å; L347-W358 HydrophobicContact CG-CH2 4.01Å; L347-W358 HydrophobicContact CG-CZ2 3.86Å; L347-W358 PolarHBondContact O-NE1 3.36Å; L347-L416 HydrophobicContact CD1-CD1 3.69Å; L347-L416 HydrophobicContact CD1-CD2 3.18Å; L347-L416 HydrophobicContact CD1-CG 3.79Å; L347-L416 HydrophobicContact CD2-CD1 4.44Å; L347-L425 HydrophobicContact CD2-CD1 3.7Å; L347-V481 HydrophobicContact CD2-CB 4.21Å; L347-V481 HydrophobicContact CD2-CG2 4.05Å; L347-L502 HydrophobicContact CB-CB 4.31Å
348	S	82.3	Confident	79	Confident	54 Å²	54	39 Å²	39	38%	0.378	25%	0.249	S	C	.	.			trans	-66.7	116.5	-173.7	61.7	0	0	0	0	110.1	P344 I500	P344-S348 VanDerWaalsContact O-CB 3.24Å; P344-S348 WeakPolarHBondContact O-CB 3.37Å; P344-S348 PolarHBondContact O-N 2.82Å; P344-S348 PolarHBondContact O-OG 2.81Å; S348-I500 CarbonylContact C-O 3.43Å; S348-I500 VanDerWaalsContact CA-O 3.23Å; S348-I500 WeakPolarHBondContact CA-O 3.31Å
349	C	82.5	Confident	79.4	Confident	5 Å²	5	39.5 Å²	39.5	3%	0.034	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-147.6	122.1	178.4	-163.4	0	0	0	0	110.3	L347 F351 C356 I500	L347-C349 PolarHBondContact O-N 2.83Å; L347-C349 VanDerWaalsContact O-N 3.16Å; C349-F351 HydrophobicContact CB-CE1 4.33Å; C349-F351 HydrophobicContact CB-CZ 4.46Å; C349-F351 VanDerWaalsContact SG-CD1 3.56Å; C349-C356 WeakPolarHBondContact CA-SG 3.01Å; C349-C356 HydrophobicContact CB-CB 3.7Å; C349-C356 WeakPolarHBondContact CB-SG 3.31Å; C349-C356 WeakPolarHBondContact SG-CB 3.37Å; C349-C356 CovalentContact SG-SG 2.04Å; C349-C356 PolarHBondContact SG-SG 3.24Å; C349-I500 PolarHBondContact N-O 2.76Å; C349-I500 PolarHBondContact O-N 3.05Å
350	S	78.5	Confident	80	Confident	48 Å²	48	37.5 Å²	37.5	34%	0.336	22%	0.224	S	C	.	.			trans	-96	8.1	170.6	65	0	0	0	0	112.3	E352	S350-E352 PolarHBondContact O-N 2.84Å
351	F	82.1	Confident	80.2	Confident	1 Å²	1	37.1 Å²	37.1	0%	0.004	20%	0.202	C	C	.	.	S	Bend	trans	55.2	3.4	-179.7	-56.6	-70.1	0	0	0	118.1	C349 G354 R370 F394 L396 I500	C349-F351 HydrophobicContact CB-CE1 4.33Å; C349-F351 HydrophobicContact CB-CZ 4.46Å; C349-F351 VanDerWaalsContact SG-CD1 3.56Å; F351-G354 WeakPolarHBondContact CA-O 3.3Å; F351-R370 PolarHBondContact O-NH1 2.84Å; F351-F394 WeakPolarHBondContact CB-O 3.32Å; F351-F394 WeakPolarHBondContact O-CB 3.35Å; F351-L396 HydrophobicContact CD1-CB 4.44Å; F351-L396 HydrophobicContact CD1-CD1 3.78Å; F351-L396 HydrophobicContact CE1-CB 4.29Å; F351-L396 HydrophobicContact CE1-CD1 3.86Å; F351-L396 HydrophobicContact CE1-CD2 4.29Å; F351-L396 HydrophobicContact CE1-CG 4.38Å; F351-L396 HydrophobicContact CE2-CB 4.44Å; F351-L396 HydrophobicContact CG-CD1 4.5Å; F351-L396 HydrophobicContact CZ-CB 4.28Å; F351-I500 HydrophobicContact CE2-CD1 3.93Å; F351-I500 HydrophobicContact CE2-CG1 4.05Å; F351-I500 HydrophobicContact CZ-CD1 3.64Å; F351-I500 HydrophobicContact CZ-CG1 4.25Å
352	E	77.9	Confident	79.4	Confident	43 Å²	43	40.9 Å²	40.9	20%	0.201	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-42.1	177.3	-68.6	-57.6	136.3	0	0	114	S350 R370 M388 G393 F394	S350-E352 PolarHBondContact O-N 2.84Å; E352-R370 PolarHBondContact O-NH1 2.78Å; E352-M388 HydrophobicContact CG-CE 4.05Å; E352-M388 VanDerWaalsContact OE2-CE 3.24Å; E352-M388 WeakPolarHBondContact OE2-CE 3.34Å; E352-G393 VanDerWaalsContact OE1-CA 3.23Å; E352-G393 WeakPolarHBondContact OE1-CA 3.2Å; E352-F394 PolarHBondContact OE1-N 2.87Å
353	D	75.3	Confident	78.4	Confident	108 Å²	108	45.9 Å²	45.9	58%	0.578	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108	41.1	-177.3	-162.2	-2.3	0	0	0	112.5	T306	T306-D353 WeakPolarHBondContact CB-O 2.95Å; T306-D353 PolarHBondContact N-O 2.87Å; T306-D353 PolarHBondContact N-OD1 2.84Å; T306-D353 PolarHBondContact OG1-OD1 2.82Å
354	G	78.1	Confident	77.5	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.243	C	C	.	.	S	Bend	trans	103.8	-166.3	178.5	0	0	0	0	0	113.3	F351 C356 R370	F351-G354 WeakPolarHBondContact CA-O 3.3Å; G354-C356 PolarHBondContact O-N 3.04Å; G354-R370 VanDerWaalsContact CA-NH1 3.35Å
355	V	79.6	Confident	76.6	Confident	33 Å²	33	49 Å²	49	20%	0.2	25%	0.253	C	S	.	.	S	Bend	trans	-84.1	11.6	177	-64.5	0	0	0	0	113.5	F357 W358 L396	V355-F357 PolarHBondContact O-N 3.17Å; V355-W358 PolarHBondContact O-N 3.29Å; V355-W358 VanDerWaalsContact O-N 3.17Å; V355-L396 HydrophobicContact CG1-CD1 3.95Å
356	C	84.3	Confident	75.9	Confident	26 Å²	26	45.6 Å²	45.6	18%	0.176	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	-122.9	-178.5	-48.4	0	0	0	0	112.4	C349 G354	C349-C356 WeakPolarHBondContact CA-SG 3.01Å; C349-C356 HydrophobicContact CB-CB 3.7Å; C349-C356 WeakPolarHBondContact CB-SG 3.31Å; C349-C356 WeakPolarHBondContact SG-CB 3.37Å; C349-C356 CovalentContact SG-SG 2.04Å; C349-C356 PolarHBondContact SG-SG 3.24Å; G354-C356 PolarHBondContact O-N 3.04Å
357	F	83.8	Confident	75.5	Confident	20 Å²	20	46.5 Å²	46.5	9%	0.088	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105	9.9	179	-62.9	-72.7	0	0	0	113.7	W308 L310 T338 L341 E345 V355 L414	W308-F357 HydrophobicContact CB-CD1 4.26Å; W308-F357 HydrophobicContact CB-CE1 4.16Å; W308-F357 AromaticContact CD2-CE1 3.69Å; W308-F357 HydrophobicContact CD2-CE1 3.69Å; W308-F357 HydrophobicContact CD2-CZ 4.03Å; W308-F357 AromaticContact CE2-CZ 3.97Å; W308-F357 AromaticContact CE3-CE1 3.98Å; W308-F357 HydrophobicContact CE3-CE1 3.98Å; W308-F357 HydrophobicContact CE3-CZ 4.39Å; W308-F357 HydrophobicContact CG-CD1 4.21Å; W308-F357 AromaticContact CG-CE1 3.76Å; W308-F357 HydrophobicContact CG-CE1 3.76Å; W308-F357 HydrophobicContact CG-CZ 4.37Å; W308-F357 HydrophobicContact CZ2-CZ 4.3Å; L310-F357 HydrophobicContact CD2-CD1 4.24Å; L310-F357 HydrophobicContact CD2-CE1 4.3Å; T338-F357 HydrophobicContact CG2-CE1 4.32Å; L341-F357 HydrophobicContact CD1-CD1 4.44Å; L341-F357 HydrophobicContact CD1-CE1 3.81Å; L341-F357 HydrophobicContact CD1-CE2 4.03Å; L341-F357 HydrophobicContact CD1-CZ 3.58Å; L341-F357 HydrophobicContact CD2-CE2 4.45Å; L341-F357 HydrophobicContact CD2-CZ 4.34Å; E345-F357 WeakPolarHBondContact O-CD2 3.42Å; V355-F357 PolarHBondContact O-N 3.17Å; F357-L414 HydrophobicContact CB-CD1 3.84Å; F357-L414 HydrophobicContact CB-CG 4.21Å; F357-L414 HydrophobicContact CD1-CD1 4.12Å; F357-L414 HydrophobicContact CG-CD1 4.18Å
358	W	83.1	Confident	75.4	Confident	3 Å²	3	46.7 Å²	46.7	1%	0.011	25%	0.25	C	S	.	.			trans	-72.7	151.6	177.3	-67.5	95.7	0	0	0	111.2	L347 V355 L411 Q412 V481 F483 I500	L347-W358 HydrophobicContact CB-CZ2 4.25Å; L347-W358 HydrophobicContact CD2-CH2 4.11Å; L347-W358 HydrophobicContact CD2-CZ2 4.25Å; L347-W358 HydrophobicContact CG-CH2 4.01Å; L347-W358 HydrophobicContact CG-CZ2 3.86Å; L347-W358 PolarHBondContact O-NE1 3.36Å; V355-W358 PolarHBondContact O-N 3.29Å; V355-W358 VanDerWaalsContact O-N 3.17Å; W358-L411 HydrophobicContact CB-CD1 3.85Å; W358-L411 HydrophobicContact CB-CD2 4.32Å; W358-L411 HydrophobicContact CB-CG 4.07Å; W358-L411 HydrophobicContact CD2-CD2 4.11Å; W358-L411 HydrophobicContact CD2-CG 4.23Å; W358-L411 HydrophobicContact CE3-CD2 4.04Å; W358-L411 HydrophobicContact CE3-CG 3.82Å; W358-L411 HydrophobicContact CG-CD2 4.23Å; W358-L411 HydrophobicContact CG-CG 4.35Å; W358-Q412 VanDerWaalsContact CE3-C 3.44Å; W358-V481 HydrophobicContact CH2-CG1 4.4Å; W358-F483 AromaticContact CH2-CD2 3.96Å; W358-F483 HydrophobicContact CH2-CD2 3.96Å; W358-F483 AromaticContact CH2-CE2 3.53Å; W358-F483 HydrophobicContact CH2-CE2 3.53Å; W358-F483 HydrophobicContact CZ2-CE2 4.13Å; W358-F483 AromaticContact CZ3-CD2 3.87Å; W358-F483 HydrophobicContact CZ3-CD2 3.87Å; W358-F483 AromaticContact CZ3-CE2 3.96Å; W358-F483 HydrophobicContact CZ3-CE2 3.96Å; W358-I500 HydrophobicContact CZ2-CD1 4Å; W358-I500 HydrophobicContact CZ2-CG2 3.93Å
359	R	83.2	Confident	75.1	Confident	35 Å²	35	47.9 Å²	47.9	13%	0.132	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	138	-179.9	-67.2	-67.9	178.4	-91.9	11.8	110.5	E286 W308 L310 Q412	E286-R359 IonicContact OE1-CZ 2.8Å; E286-R359 IonicContact OE1-NE 3.44Å; E286-R359 IonicContact OE1-NH2 3.54Å; E286-R359 PolarHBondContact OE1-NH2 2.71Å; E286-R359 IonicContact OE2-NE 3.03Å; W308-R359 PolarHBondContact O-NH2 2.8Å; L310-R359 VanDerWaalsContact CD1-NH2 3.3Å; L310-R359 VanDerWaalsContact CG-NH2 3.35Å; R359-Q412 PolarHBondContact N-O 3.19Å; R359-Q412 PolarHBondContact O-N 3.43Å
360	Q	81.1	Confident	75	Confident	50 Å²	50	49.4 Å²	49.4	23%	0.234	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	145.2	176.1	-45.2	-151.9	66.9	0	0	108.8	D367 W368 L411	Q360-D367 WeakPolarHBondContact CB-OD1 3.44Å; Q360-W368 PolarHBondContact NE2-O 3.14Å; Q360-W368 VanDerWaalsContact OE1-CA 3.28Å; Q360-W368 PolarHBondContact OE1-O 3.16Å; Q360-L411 HydrophobicContact CG-CD1 4.13Å
361	Q	71.4	Confident	74.6	Confident	63 Å²	63	48.8 Å²	48.8	29%	0.294	25%	0.251	S	S	.	.			trans	-95.3	125.1	-174.3	-171.8	175.8	-13.6	0	0	111.2	D363 D364 W410	Q361-D363 VanDerWaalsContact C-N 3.34Å; Q361-D363 PolarHBondContact O-N 3.48Å; Q361-D364 VanDerWaalsContact O-OD1 3.07Å; Q361-W410 HydrophobicContact CB-CB 4.01Å
362	Q	60.5	Low	74	Confident	120 Å²	120	51.1 Å²	51.1	56%	0.561	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-18.1	-171.2	-160	174.7	21.4	0	0	115.9
363	D	59.5	Low	73.5	Confident	154 Å²	154	49.2 Å²	49.2	82%	0.824	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	7.8	-177	-80.5	-26.4	0	0	0	113.4	Q361	Q361-D363 VanDerWaalsContact C-N 3.34Å; Q361-D363 PolarHBondContact O-N 3.48Å
364	D	60.8	Low	73	Confident	29 Å²	29	47.7 Å²	47.7	16%	0.155	26%	0.255	C	S	.	.	S	Bend	trans	-95.4	177.7	179.8	76.9	8.1	0	0	0	113	Q361 G366 W410	Q361-D364 VanDerWaalsContact O-OD1 3.07Å; D364-G366 PolarHBondContact O-N 3.47Å; D364-G366 PolarHBondContact OD1-N 2.84Å; D364-W410 PolarHBondContact OD2-N 2.78Å
365	E	61.8	Low	72.1	Confident	107 Å²	107	48.6 Å²	48.6	50%	0.5	26%	0.261	S	S	.	.	S	Bend	trans	-87.6	14.1	-169.4	-61.7	-173.2	177.7	0	0	113.6	K407 R408	E365-K407 HydrophobicContact CB-CB 4.35Å; E365-K407 HydrophobicContact CB-CD 4Å; E365-K407 HydrophobicContact CB-CG 4.37Å; E365-K407 PolarHBondContact O-NZ 3.27Å; E365-K407 WeakPolarHBondContact OE2-CA 3.46Å; E365-K407 VanDerWaalsContact OE2-CG 3.27Å; E365-K407 WeakPolarHBondContact OE2-CG 3.29Å; E365-R408 PolarHBondContact N-O 2.89Å
366	G	66.1	Low	70.7	Confident	24 Å²	24	55 Å²	55	25%	0.247	29%	0.286	C	S	.	.			trans	154.1	159.9	172.1	0	0	0	0	0	113.6	D364 F409	D364-G366 PolarHBondContact O-N 3.47Å; D364-G366 PolarHBondContact OD1-N 2.84Å; G366-F409 WeakPolarHBondContact O-CD1 3.48Å; G366-F409 WeakPolarHBondContact O-CE1 2.95Å
367	D	72.3	Confident	69.2	Low	53 Å²	53	54.7 Å²	54.7	28%	0.283	28%	0.284	S	S	.	.			trans	-91.1	153.2	179.8	-69.6	-48.8	0	0	0	113.1	Q360 P399	Q360-D367 WeakPolarHBondContact CB-OD1 3.44Å; D367-P399 WeakPolarHBondContact O-CD 3.48Å; D367-P399 VanDerWaalsContact O-CG 3.31Å; D367-P399 WeakPolarHBondContact O-CG 3.5Å
368	W	79.6	Confident	67.7	Low	5 Å²	5	58.4 Å²	58.4	2%	0.019	31%	0.312	C	S	.	.			trans	-66.7	141.4	164.4	-63.1	74.8	0	0	0	111.3	Q360 L396 T398 A485 I495 L497	Q360-W368 PolarHBondContact NE2-O 3.14Å; Q360-W368 VanDerWaalsContact OE1-CA 3.28Å; Q360-W368 PolarHBondContact OE1-O 3.16Å; W368-L396 HydrophobicContact CB-CD2 3.46Å; W368-L396 VanDerWaalsContact CB-CD2 3.46Å; W368-L396 HydrophobicContact CB-CG 3.88Å; W368-L396 HydrophobicContact CD2-CD2 3.88Å; W368-L396 HydrophobicContact CE3-CB 4.29Å; W368-L396 HydrophobicContact CE3-CD2 3.85Å; W368-L396 HydrophobicContact CE3-CG 4.22Å; W368-L396 HydrophobicContact CG-CD2 3.76Å; W368-T398 HydrophobicContact CD2-CG2 3.78Å; W368-T398 HydrophobicContact CE3-CG2 3.72Å; W368-T398 HydrophobicContact CH2-CG2 3.78Å; W368-T398 HydrophobicContact CZ2-CG2 3.84Å; W368-T398 HydrophobicContact CZ3-CG2 3.73Å; W368-A485 HydrophobicContact CH2-CB 3.81Å; W368-A485 HydrophobicContact CZ2-CB 3.46Å; W368-A485 VanDerWaalsContact CZ2-CB 3.46Å; W368-I495 HydrophobicContact CH2-CG2 4.26Å; W368-L497 HydrophobicContact CH2-CD1 3.47Å; W368-L497 VanDerWaalsContact CH2-CD1 3.47Å; W368-L497 HydrophobicContact CH2-CG 3.82Å; W368-L497 HydrophobicContact CZ2-CD1 4.03Å; W368-L497 HydrophobicContact CZ3-CB 4.41Å; W368-L497 HydrophobicContact CZ3-CD1 3.79Å; W368-L497 HydrophobicContact CZ3-CG 3.86Å
369	I	75.4	Confident	66.5	Low	78 Å²	78	60.5 Å²	60.5	40%	0.4	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	130.5	-178.1	-59.2	-179.7	0	0	0	108.9	V397 P399	I369-V397 HydrophobicContact CB-CG1 4.39Å; I369-V397 PolarHBondContact N-O 3.25Å; I369-V397 PolarHBondContact O-N 2.85Å; I369-P399 HydrophobicContact CD1-CB 3.69Å; I369-P399 HydrophobicContact CG1-CB 4.36Å
370	R	80.7	Confident	65.3	Low	38 Å²	38	58.8 Å²	58.8	14%	0.143	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	121	167.9	-169.8	179.2	99.5	132.4	1.2	108.8	P303 F351 E352 G354 F394 Y395 L396	P303-R370 PolarHBondContact O-NH2 2.85Å; F351-R370 PolarHBondContact O-NH1 2.84Å; E352-R370 PolarHBondContact O-NH1 2.78Å; G354-R370 VanDerWaalsContact CA-NH1 3.35Å; R370-F394 HydrophobicContact CG-CB 4.17Å; R370-F394 HydrophobicContact CG-CD1 4.12Å; R370-Y395 WeakPolarHBondContact CA-O 3.32Å; R370-L396 HydrophobicContact CB-CD1 4.16Å
371	T	70.6	Confident	64.4	Low	35 Å²	35	56.6 Å²	56.6	22%	0.215	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	157.2	-178	-165.8	0	0	0	0	111.4	T375 Y395 V397	T371-T375 HydrophobicContact CG2-CG2 3.93Å; T371-Y395 HydrophobicContact CG2-CD2 4.29Å; T371-Y395 HydrophobicContact CG2-CE1 4.12Å; T371-Y395 HydrophobicContact CG2-CE2 3.64Å; T371-Y395 PolarHBondContact N-O 2.85Å; T371-Y395 PolarHBondContact O-N 3.28Å; T371-V397 HydrophobicContact CG2-CB 4.38Å; T371-V397 HydrophobicContact CG2-CG1 3.53Å
372	S	70.1	Confident	64.1	Low	49 Å²	49	53.7 Å²	53.7	34%	0.343	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	136.2	172.7	58.3	0	0	0	0	109.7	G393	S372-G393 WeakPolarHBondContact CA-O 3.07Å; S372-G393 VanDerWaalsContact CB-O 3.31Å; S372-G393 WeakPolarHBondContact CB-O 3.34Å
373	G	67.4	Low	64.2	Low	3 Å²	3	51.9 Å²	51.9	3%	0.031	29%	0.292	C	S	.	.	S	Bend	trans	80.1	-166.8	-179.5	0	0	0	0	0	114.3	S391 Y395	G373-S391 PolarHBondContact N-O 2.95Å; G373-Y395 WeakPolarHBondContact O-CE1 3.15Å; G373-Y395 PolarHBondContact O-OH 3.41Å
374	P	63.4	Low	64.1	Low	77 Å²	77	46.7 Å²	46.7	50%	0.5	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-72.8	135.6	-172.9	28.8	-34.1	0	0	0	112.1
375	T	59.8	Low	64.1	Low	19 Å²	19	45.3 Å²	45.3	12%	0.117	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-76.3	155.6	171.1	56.6	0	0	0	0	111.7	T371 P377 S378 G381 V397 D494	T371-T375 HydrophobicContact CG2-CG2 3.93Å; T375-P377 CarbonylContact O-C 3.59Å; T375-S378 WeakPolarHBondContact O-CA 3.48Å; T375-S378 PolarHBondContact O-N 3Å; T375-G381 VanDerWaalsContact OG1-CA 3.25Å; T375-G381 WeakPolarHBondContact OG1-CA 3.24Å; T375-G381 PolarHBondContact OG1-N 3.04Å; T375-V397 HydrophobicContact CG2-CB 4.47Å; T375-V397 HydrophobicContact CG2-CG1 3.89Å; T375-V397 HydrophobicContact CG2-CG2 4.14Å; T375-D494 PolarHBondContact OG1-OD2 3.03Å; T375-D494 VanDerWaalsContact OG1-OD2 3.13Å
376	F	49.3	Very low	64.1	Low	166 Å²	166	42.6 Å²	42.6	73%	0.728	25%	0.248	S	C	*	.	S	Bend	trans	-94.6	129.9	169.9	-174.8	-92.6	0	0	0	109.8
377	P	53.7	Low	63.7	Low	21 Å²	21	44.2 Å²	44.2	14%	0.136	25%	0.253	C	S	.	.	S	Bend	cis	-71.2	144.3	1.6	28	-33	0	0	0	113.2	T375 S379	T375-P377 CarbonylContact O-C 3.59Å; P377-S379 PolarHBondContact O-N 2.85Å
378	S	52	Low	63	Low	97 Å²	97	46.6 Å²	46.6	68%	0.678	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	37.6	-170.7	57.2	0	0	0	0	115.3	T375	T375-S378 WeakPolarHBondContact O-CA 3.48Å; T375-S378 PolarHBondContact O-N 3Å
379	S	57.7	Low	61.9	Low	47 Å²	47	49 Å²	49	33%	0.329	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-151.7	10.9	-172.6	64.7	0	0	0	0	114.5	P377 F432	P377-S379 PolarHBondContact O-N 2.85Å; S379-F432 WeakPolarHBondContact O-CD1 3.41Å; S379-F432 WeakPolarHBondContact O-CE1 3.48Å
380	T	58.6	Low	61.1	Low	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.9	-32.7	178.8	46.1	0	0	0	0	115.7	H430 F432 W492 D494	T380-H430 PolarHBondContact O-CE1 2.8Å; T380-F432 WeakPolarHBondContact CB-O 3.3Å; T380-F432 VanDerWaalsContact O-O 3.05Å; T380-W492 HydrophobicContact CG2-CB 3.59Å; T380-W492 HydrophobicContact CG2-CD2 4.49Å; T380-W492 HydrophobicContact CG2-CG 4.11Å; T380-D494 PolarHBondContact OG1-OD2 3.49Å
381	G	61.7	Low	60.1	Low	4 Å²	4	49 Å²	49	4%	0.041	30%	0.299	C	S	.	.	S	Bend	trans	-86.3	164.8	172.2	0	0	0	0	0	113.5	T375 D494	T375-G381 VanDerWaalsContact OG1-CA 3.25Å; T375-G381 WeakPolarHBondContact OG1-CA 3.24Å; T375-G381 PolarHBondContact OG1-N 3.04Å; G381-D494 PolarHBondContact N-OD2 3.48Å
382	P	66	Low	59.6	Low	2 Å²	2	50.1 Å²	50.1	1%	0.013	31%	0.308	C	S	.	.			trans	-66.3	136.9	178	26	-30.2	0	0	0	111.1	S384 Y395 H430 W466 A496	P382-S384 VanDerWaalsContact C-N 3.28Å; P382-S384 PolarHBondContact O-N 2.97Å; P382-Y395 HydrophobicContact CG-CD1 4.42Å; P382-Y395 HydrophobicContact CG-CD2 3.92Å; P382-Y395 HydrophobicContact CG-CE1 4.04Å; P382-Y395 HydrophobicContact CG-CE2 3.46Å; P382-Y395 VanDerWaalsContact CG-CE2 3.46Å; P382-Y395 HydrophobicContact CG-CG 4.37Å; P382-Y395 PolarHBondContact O-OH 2.8Å; P382-H430 HydrophobicContact CB-CB 4.48Å; P382-H430 HydrophobicContact CG-CB 4.42Å; P382-W466 HydrophobicContact CB-CZ2 3.71Å; P382-W466 HydrophobicContact CG-CH2 4.04Å; P382-W466 HydrophobicContact CG-CZ2 3.58Å; P382-A496 HydrophobicContact CG-CB 3.91Å
383	N	60.9	Low	59.4	Low	82 Å²	82	47.8 Å²	47.8	44%	0.439	29%	0.292	S	S	.	.	S	Bend	trans	-72.4	-23.3	179.2	-69	-54.6	0	0	0	113.3	D464	N383-D464 PolarHBondContact ND2-OD2 3.16Å
384	S	58.3	Low	59.8	Low	44 Å²	44	48.8 Å²	48.8	31%	0.308	30%	0.296	S	S	.	.	S	Bend	trans	-145.3	147.5	-177.6	-61.8	0	0	0	0	110	P382 N390 W466	P382-S384 VanDerWaalsContact C-N 3.28Å; P382-S384 PolarHBondContact O-N 2.97Å; S384-N390 WeakPolarHBondContact CA-O 3.49Å; S384-N390 WeakPolarHBondContact CB-O 3.08Å; S384-W466 PolarHBondContact O-NE1 2.77Å
385	D	60.7	Low	60.7	Low	1 Å²	1	45.1 Å²	45.1	1%	0.005	27%	0.272	C	S	.	.			trans	-63.3	153.1	171	176.8	64.5	0	0	0	112.5	T387 M388 G389 N390 Y395	D385-T387 WeakPolarHBondContact OD2-CA 3.43Å; D385-T387 WeakPolarHBondContact OD2-CB 3.49Å; D385-T387 PolarHBondContact OD2-N 3.09Å; D385-M388 PolarHBondContact OD2-N 3.43Å; D385-G389 WeakPolarHBondContact O-CA 3.25Å; D385-G389 PolarHBondContact O-N 3.48Å; D385-N390 PolarHBondContact N-O 2.83Å; D385-Y395 HydrophobicContact CB-CD1 4.42Å
386	H	61.7	Low	61.9	Low	50 Å²	50	44.3 Å²	44.3	23%	0.231	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-41	179.1	178.4	-86.5	0	0	0	112.4	M388 W428 W466 D498 D499	H386-M388 VanDerWaalsContact C-N 3.29Å; H386-M388 PolarHBondContact O-N 2.83Å; H386-W428 AromaticContact CD2-CD2 3.81Å; H386-W428 AromaticContact CD2-CE3 3.78Å; H386-W428 AromaticContact CE1-CD1 3.9Å; H386-W428 AromaticContact CE1-CD2 3.52Å; H386-W428 AromaticContact CE1-CE2 3.1Å; H386-W428 AromaticContact CE1-CG 3.97Å; H386-W428 AromaticContact CE1-CH2 3.97Å; H386-W428 AromaticContact CE1-CZ2 3.38Å; H386-W428 WeakPolarHBondContact CE1-CZ2 3.43Å; H386-W428 AromaticContact CE1-NE1 3.34Å; H386-W428 PolarHBondContact CE1-NE1 3.08Å; H386-W428 VanDerWaalsContact CE1-NE1 3.34Å; H386-W428 AromaticContact CG-CD2 3.95Å; H386-W428 AromaticContact ND1-CD1 3.72Å; H386-W428 AromaticContact ND1-CD2 3.76Å; H386-W428 AromaticContact ND1-CE2 3.7Å; H386-W428 AromaticContact ND1-CG 3.75Å; H386-W428 AromaticContact ND1-NE1 3.64Å; H386-W428 AromaticContact NE2-CD2 3.55Å; H386-W428 AromaticContact NE2-CE2 3.39Å; H386-W428 AromaticContact NE2-CE3 3.66Å; H386-W428 AromaticContact NE2-CH2 3.45Å; H386-W428 WeakPolarHBondContact NE2-CH2 3.38Å; H386-W428 AromaticContact NE2-CZ2 3.36Å; H386-W428 WeakPolarHBondContact NE2-CZ2 3.29Å; H386-W428 AromaticContact NE2-CZ3 3.6Å; H386-W466 HydrophobicContact CB-CB 4.45Å; H386-W466 HydrophobicContact CB-CD2 3.77Å; H386-W466 HydrophobicContact CB-CE3 4.29Å; H386-W466 HydrophobicContact CB-CG 3.83Å; H386-W466 HydrophobicContact CB-CZ2 4.46Å; H386-D498 WeakPolarHBondContact CA-OD2 3.26Å; H386-D498 HydrophobicContact CB-CB 4.5Å; H386-D498 VanDerWaalsContact CB-OD2 3.26Å; H386-D498 WeakPolarHBondContact CB-OD2 3.32Å; H386-D498 PolarHBondContact N-OD2 2.81Å; H386-D499 IonicContact CE1-OD2 2.66Å; H386-D499 IonicContact ND1-OD2 2.67Å; H386-D499 PolarHBondContact ND1-OD2 3.28Å
387	T	58.3	Low	63.6	Low	58 Å²	58	36.6 Å²	36.6	36%	0.356	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-42.8	179.2	-48.3	0	0	0	0	112	D385 D498 D499	D385-T387 WeakPolarHBondContact OD2-CA 3.43Å; D385-T387 WeakPolarHBondContact OD2-CB 3.49Å; D385-T387 PolarHBondContact OD2-N 3.09Å; T387-D498 PolarHBondContact N-OD2 3.49Å; T387-D498 VanDerWaalsContact N-OD2 3.16Å; T387-D498 PolarHBondContact OG1-OD2 3.36Å; T387-D499 PolarHBondContact OG1-OD1 3.18Å; T387-D499 PolarHBondContact OG1-OD2 2.82Å
388	M	56	Low	65	Low	102 Å²	102	35.7 Å²	35.7	50%	0.502	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-17.7	-178.4	-61.8	-158.1	-176.3	0	0	115	E352 D385 H386 N390	E352-M388 HydrophobicContact CG-CE 4.05Å; E352-M388 VanDerWaalsContact OE2-CE 3.24Å; E352-M388 WeakPolarHBondContact OE2-CE 3.34Å; D385-M388 PolarHBondContact OD2-N 3.43Å; H386-M388 VanDerWaalsContact C-N 3.29Å; H386-M388 PolarHBondContact O-N 2.83Å; M388-N390 PolarHBondContact O-N 2.87Å
389	G	56.5	Low	66	Low	55 Å²	55	32.5 Å²	32.5	57%	0.567	20%	0.204	S	C	*	.	S	Bend	trans	69.1	14.1	-178.1	0	0	0	0	0	114.9	D385	D385-G389 WeakPolarHBondContact O-CA 3.25Å; D385-G389 PolarHBondContact O-N 3.48Å
390	N	59.1	Low	66.6	Low	48 Å²	48	33.9 Å²	33.9	26%	0.257	21%	0.206	S	C	.	.	S	Bend	trans	-131.8	176.5	-177.1	70.7	19.1	0	0	0	111.9	S384 D385 M388 S392 G393	S384-N390 WeakPolarHBondContact CA-O 3.49Å; S384-N390 WeakPolarHBondContact CB-O 3.08Å; D385-N390 PolarHBondContact N-O 2.83Å; M388-N390 PolarHBondContact O-N 2.87Å; N390-S392 PolarHBondContact O-N 3.31Å; N390-S392 WeakPolarHBondContact OD1-CA 3.37Å; N390-S392 WeakPolarHBondContact OD1-CB 3.29Å; N390-S392 PolarHBondContact OD1-N 3.42Å; N390-G393 PolarHBondContact OD1-N 2.68Å
391	S	59.1	Low	66.8	Low	69 Å²	69	34 Å²	34	48%	0.483	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	3	177	59.8	0	0	0	0	114.4	G373	G373-S391 PolarHBondContact N-O 2.95Å
392	S	61.4	Low	66.5	Low	59 Å²	59	38.8 Å²	38.8	41%	0.413	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-20.8	-178.5	-56.5	0	0	0	0	113.5	N390	N390-S392 PolarHBondContact O-N 3.31Å; N390-S392 WeakPolarHBondContact OD1-CA 3.37Å; N390-S392 WeakPolarHBondContact OD1-CB 3.29Å; N390-S392 PolarHBondContact OD1-N 3.42Å
393	G	66.2	Low	66.1	Low	0 Å²	0	40.2 Å²	40.2	0%	0	25%	0.253	C	S	.	.	S	Bend	trans	-72.2	160.1	172.3	0	0	0	0	0	112.4	E352 S372 N390	E352-G393 VanDerWaalsContact OE1-CA 3.23Å; E352-G393 WeakPolarHBondContact OE1-CA 3.2Å; S372-G393 WeakPolarHBondContact CA-O 3.07Å; S372-G393 VanDerWaalsContact CB-O 3.31Å; S372-G393 WeakPolarHBondContact CB-O 3.34Å; N390-G393 PolarHBondContact OD1-N 2.68Å
394	F	75.4	Confident	65.9	Low	24 Å²	24	44.7 Å²	44.7	11%	0.105	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	125.8	-175.6	-72.8	-84.5	0	0	0	111.1	P303 F351 E352 R370	P303-F394 HydrophobicContact CG-CZ 3.82Å; F351-F394 WeakPolarHBondContact CB-O 3.32Å; F351-F394 WeakPolarHBondContact O-CB 3.35Å; E352-F394 PolarHBondContact OE1-N 2.87Å; R370-F394 HydrophobicContact CG-CB 4.17Å; R370-F394 HydrophobicContact CG-CD1 4.12Å
395	Y	83.1	Confident	66.1	Low	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	165.4	172.4	61.9	-88.2	0	0	0	110.9	R370 T371 G373 P382 D385 V397 W466 A496	R370-Y395 WeakPolarHBondContact CA-O 3.32Å; T371-Y395 HydrophobicContact CG2-CD2 4.29Å; T371-Y395 HydrophobicContact CG2-CE1 4.12Å; T371-Y395 HydrophobicContact CG2-CE2 3.64Å; T371-Y395 PolarHBondContact N-O 2.85Å; T371-Y395 PolarHBondContact O-N 3.28Å; G373-Y395 WeakPolarHBondContact O-CE1 3.15Å; G373-Y395 PolarHBondContact O-OH 3.41Å; P382-Y395 HydrophobicContact CG-CD1 4.42Å; P382-Y395 HydrophobicContact CG-CD2 3.92Å; P382-Y395 HydrophobicContact CG-CE1 4.04Å; P382-Y395 HydrophobicContact CG-CE2 3.46Å; P382-Y395 VanDerWaalsContact CG-CE2 3.46Å; P382-Y395 HydrophobicContact CG-CG 4.37Å; P382-Y395 PolarHBondContact O-OH 2.8Å; D385-Y395 HydrophobicContact CB-CD1 4.42Å; Y395-V397 HydrophobicContact CD2-CB 4.14Å; Y395-V397 HydrophobicContact CE2-CB 3.8Å; Y395-V397 HydrophobicContact CE2-CG1 4.32Å; Y395-V397 HydrophobicContact CE2-CG2 4.3Å; Y395-W466 HydrophobicContact CD2-CH2 4.42Å; Y395-W466 HydrophobicContact CG-CH2 4.2Å; Y395-W466 HydrophobicContact CG-CZ2 4.29Å; Y395-A496 HydrophobicContact CD2-CB 3.74Å; Y395-A496 HydrophobicContact CE2-CB 3.99Å
396	L	84.8	Confident	66.6	Low	1 Å²	1	56.9 Å²	56.9	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	129.8	176.1	-138.7	84.9	0	0	0	110	F351 V355 W368 R370 L411 A496 L497	F351-L396 HydrophobicContact CD1-CB 4.44Å; F351-L396 HydrophobicContact CD1-CD1 3.78Å; F351-L396 HydrophobicContact CE1-CB 4.29Å; F351-L396 HydrophobicContact CE1-CD1 3.86Å; F351-L396 HydrophobicContact CE1-CD2 4.29Å; F351-L396 HydrophobicContact CE1-CG 4.38Å; F351-L396 HydrophobicContact CE2-CB 4.44Å; F351-L396 HydrophobicContact CG-CD1 4.5Å; F351-L396 HydrophobicContact CZ-CB 4.28Å; V355-L396 HydrophobicContact CG1-CD1 3.95Å; W368-L396 HydrophobicContact CB-CD2 3.46Å; W368-L396 VanDerWaalsContact CB-CD2 3.46Å; W368-L396 HydrophobicContact CB-CG 3.88Å; W368-L396 HydrophobicContact CD2-CD2 3.88Å; W368-L396 HydrophobicContact CE3-CB 4.29Å; W368-L396 HydrophobicContact CE3-CD2 3.85Å; W368-L396 HydrophobicContact CE3-CG 4.22Å; W368-L396 HydrophobicContact CG-CD2 3.76Å; R370-L396 HydrophobicContact CB-CD1 4.16Å; L396-L411 HydrophobicContact CD2-CD1 4.13Å; L396-L411 HydrophobicContact CD2-CD2 3.74Å; L396-A496 CarbonylContact O-C 3.46Å; L396-A496 WeakPolarHBondContact O-CA 3.4Å; L396-A496 WeakPolarHBondContact O-CB 3.42Å; L396-L497 PolarHBondContact N-O 3.09Å; L396-L497 VanDerWaalsContact N-O 3.08Å; L396-L497 PolarHBondContact O-N 2.92Å
397	V	84.9	Confident	67.2	Low	5 Å²	5	57.5 Å²	57.5	3%	0.03	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	147.9	-180	71.5	0	0	0	0	111.8	I369 T371 T375 Y395 D494 A496	I369-V397 HydrophobicContact CB-CG1 4.39Å; I369-V397 PolarHBondContact N-O 3.25Å; I369-V397 PolarHBondContact O-N 2.85Å; T371-V397 HydrophobicContact CG2-CB 4.38Å; T371-V397 HydrophobicContact CG2-CG1 3.53Å; T375-V397 HydrophobicContact CG2-CB 4.47Å; T375-V397 HydrophobicContact CG2-CG1 3.89Å; T375-V397 HydrophobicContact CG2-CG2 4.14Å; Y395-V397 HydrophobicContact CD2-CB 4.14Å; Y395-V397 HydrophobicContact CE2-CB 3.8Å; Y395-V397 HydrophobicContact CE2-CG1 4.32Å; Y395-V397 HydrophobicContact CE2-CG2 4.3Å; V397-D494 HydrophobicContact CG2-CB 4.22Å; V397-A496 HydrophobicContact CB-CB 4.31Å; V397-A496 HydrophobicContact CG2-CB 4.15Å
398	T	81.8	Confident	68.2	Low	2 Å²	2	60.8 Å²	60.8	1%	0.012	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-78.6	138.4	173.4	46.9	0	0	0	0	111.4	W368 F409 A485 K487 I495	W368-T398 HydrophobicContact CD2-CG2 3.78Å; W368-T398 HydrophobicContact CE3-CG2 3.72Å; W368-T398 HydrophobicContact CH2-CG2 3.78Å; W368-T398 HydrophobicContact CZ2-CG2 3.84Å; W368-T398 HydrophobicContact CZ3-CG2 3.73Å; T398-F409 HydrophobicContact CG2-CB 4.03Å; T398-F409 HydrophobicContact CG2-CD1 4.25Å; T398-F409 HydrophobicContact CG2-CD2 4.03Å; T398-F409 HydrophobicContact CG2-CG 3.83Å; T398-A485 HydrophobicContact CG2-CB 4.07Å; T398-K487 HydrophobicContact CG2-CD 4.49Å; T398-K487 PolarHBondContact O-NZ 2.9Å; T398-K487 WeakPolarHBondContact OG1-CE 3.46Å; T398-K487 PolarHBondContact OG1-NZ 2.9Å; T398-I495 PolarHBondContact N-O 2.84Å; T398-I495 PolarHBondContact OG1-N 2.51Å; T398-I495 PolarHBondContact OG1-O 3.29Å; T398-I495 VanDerWaalsContact OG1-O 3.1Å
399	P	74.3	Confident	69.6	Low	30 Å²	30	56 Å²	56	20%	0.195	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-65.1	162.3	-176.4	24.4	-34.9	0	0	0	113.7	D367 I369 S401 F409 K487	D367-P399 WeakPolarHBondContact O-CD 3.48Å; D367-P399 VanDerWaalsContact O-CG 3.31Å; D367-P399 WeakPolarHBondContact O-CG 3.5Å; I369-P399 HydrophobicContact CD1-CB 3.69Å; I369-P399 HydrophobicContact CG1-CB 4.36Å; P399-S401 PolarHBondContact O-N 2.92Å; P399-F409 HydrophobicContact CG-CD1 4.36Å; P399-F409 HydrophobicContact CG-CE1 3.48Å; P399-F409 VanDerWaalsContact CG-CE1 3.48Å; P399-F409 HydrophobicContact CG-CZ 4.05Å; P399-K487 PolarHBondContact O-NZ 3.36Å
400	M	69.1	Low	70.9	Confident	75 Å²	75	55.2 Å²	55.2	37%	0.369	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-60.7	133.6	171.2	-171.5	-172.8	175.8	0	0	110.3	P402 M491	M400-P402 WeakPolarHBondContact O-CD 3.03Å; M400-M491 HydrophobicContact CE-CB 3.89Å; M400-M491 HydrophobicContact CE-CG 3.4Å; M400-M491 VanDerWaalsContact CE-CG 3.4Å; M400-M491 HydrophobicContact CE-SD 3.4Å; M400-M491 WeakPolarHBondContact CE-SD 3.4Å
401	S	63.4	Low	72.2	Confident	4 Å²	4	53 Å²	53	3%	0.028	27%	0.267	C	S	.	.			trans	-122.6	78.2	-178	47.7	0	0	0	0	111.8	P399 G403 N493	P399-S401 PolarHBondContact O-N 2.92Å; S401-G403 VanDerWaalsContact C-N 3.35Å; S401-G403 PolarHBondContact O-N 3.38Å; S401-N493 PolarHBondContact OG-ND2 2.98Å; S401-N493 PolarHBondContact OG-OD1 2.85Å
402	P	55.5	Low	73.5	Confident	103 Å²	103	51.7 Å²	51.7	67%	0.669	25%	0.253	S	S	*	.			trans	-69.3	90.2	175.8	28.9	-32.1	0	0	0	109.9	M400	M400-P402 WeakPolarHBondContact O-CD 3.03Å
403	G	57	Low	74.7	Confident	32 Å²	32	49 Å²	49	33%	0.33	24%	0.235	S	C	.	.	S	Bend	trans	-165.8	165	-178.9	0	0	0	0	0	112.7	S401 G489 G490	S401-G403 VanDerWaalsContact C-N 3.35Å; S401-G403 PolarHBondContact O-N 3.38Å; G403-G489 CarbonylContact O-C 3.53Å; G403-G489 WeakPolarHBondContact O-CA 3.03Å; G403-G490 PolarHBondContact O-N 2.81Å; G403-G490 VanDerWaalsContact O-N 3.16Å
404	Q	56.6	Low	75.5	Confident	177 Å²	177	50.3 Å²	50.3	83%	0.827	24%	0.242	S	C	*	.	S	Bend	trans	-93.1	-1.9	178.3	-76.1	-173.8	-20.9	0	0	113.9
405	W	63.8	Low	75.9	Confident	202 Å²	202	52.4 Å²	52.4	77%	0.765	26%	0.257	S	S	*	.	S	Bend	trans	-113.2	158.4	-173.3	-54.6	-69.2	0	0	0	112.2	G489	W405-G489 WeakPolarHBondContact O-CA 3.43Å; W405-G489 PolarHBondContact O-N 3.32Å
406	E	71.3	Confident	75.8	Confident	98 Å²	98	52.4 Å²	52.4	46%	0.458	26%	0.257	S	S	.	.			trans	-73.9	129.8	177.4	-64.8	-177.9	162.1	0	0	110.6	H437 K487	E406-H437 IonicContact OE1-CD2 3.47Å; E406-H437 IonicContact OE1-NE2 2.64Å; E406-K487 CarbonylContact C-O 3.59Å; E406-K487 WeakPolarHBondContact CA-O 3.4Å
407	K	72.9	Confident	75.7	Confident	64 Å²	64	55.9 Å²	55.9	28%	0.278	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	147.5	176.9	-64.1	-146.8	168.7	-169.9	0	111.8	E365 F409 K487	E365-K407 HydrophobicContact CB-CB 4.35Å; E365-K407 HydrophobicContact CB-CD 4Å; E365-K407 HydrophobicContact CB-CG 4.37Å; E365-K407 PolarHBondContact O-NZ 3.27Å; E365-K407 WeakPolarHBondContact OE2-CA 3.46Å; E365-K407 VanDerWaalsContact OE2-CG 3.27Å; E365-K407 WeakPolarHBondContact OE2-CG 3.29Å; K407-F409 HydrophobicContact CB-CE2 3.68Å; K407-F409 HydrophobicContact CB-CZ 4.09Å; K407-F409 HydrophobicContact CD-CZ 4.29Å; K407-K487 PolarHBondContact N-O 2.9Å; K407-K487 PolarHBondContact O-N 3.03Å
408	R	81.1	Confident	75.4	Confident	127 Å²	127	58.8 Å²	58.8	48%	0.479	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	136.3	179.2	-45.3	-158.7	168	176	-3.2	110.6	E365 L486	E365-R408 PolarHBondContact N-O 2.89Å; R408-L486 HydrophobicContact CB-CD2 4.29Å; R408-L486 HydrophobicContact CG-CD2 3.57Å
409	F	84.1	Confident	75	Confident	2 Å²	2	60.6 Å²	60.6	1%	0.009	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	132.2	-179.8	-59.1	-94.9	0	0	0	109.5	G366 T398 P399 K407 A485 K487	G366-F409 WeakPolarHBondContact O-CD1 3.48Å; G366-F409 WeakPolarHBondContact O-CE1 2.95Å; T398-F409 HydrophobicContact CG2-CB 4.03Å; T398-F409 HydrophobicContact CG2-CD1 4.25Å; T398-F409 HydrophobicContact CG2-CD2 4.03Å; T398-F409 HydrophobicContact CG2-CG 3.83Å; P399-F409 HydrophobicContact CG-CD1 4.36Å; P399-F409 HydrophobicContact CG-CE1 3.48Å; P399-F409 VanDerWaalsContact CG-CE1 3.48Å; P399-F409 HydrophobicContact CG-CZ 4.05Å; K407-F409 HydrophobicContact CB-CE2 3.68Å; K407-F409 HydrophobicContact CB-CZ 4.09Å; K407-F409 HydrophobicContact CD-CZ 4.29Å; F409-A485 HydrophobicContact CB-CB 4.32Å; F409-A485 PolarHBondContact N-O 2.96Å; F409-A485 PolarHBondContact O-N 2.85Å; F409-K487 HydrophobicContact CD2-CD 4.02Å; F409-K487 HydrophobicContact CD2-CG 4.21Å; F409-K487 HydrophobicContact CE2-CB 4.37Å; F409-K487 HydrophobicContact CE2-CD 3.41Å; F409-K487 VanDerWaalsContact CE2-CD 3.41Å; F409-K487 HydrophobicContact CE2-CG 3.87Å; F409-K487 HydrophobicContact CZ-CD 4.1Å
410	W	84.3	Confident	74.8	Confident	37 Å²	37	64.9 Å²	64.9	14%	0.14	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	133.9	-177.3	-64.7	89	0	0	0	112.9	Q361 D364 E482 F483 E484	Q361-W410 HydrophobicContact CB-CB 4.01Å; D364-W410 PolarHBondContact OD2-N 2.78Å; W410-E482 HydrophobicContact CE3-CB 4.15Å; W410-E482 HydrophobicContact CZ3-CB 4.22Å; W410-E482 WeakPolarHBondContact CZ3-OE2 3.4Å; W410-F483 WeakPolarHBondContact CA-O 3.43Å; W410-E484 HydrophobicContact CD2-CB 4.47Å; W410-E484 HydrophobicContact CE3-CB 3.97Å; W410-E484 HydrophobicContact CE3-CG 4.4Å; W410-E484 HydrophobicContact CH2-CB 3.78Å; W410-E484 VanDerWaalsContact CH2-CD 3.42Å; W410-E484 HydrophobicContact CH2-CG 3.63Å; W410-E484 WeakPolarHBondContact CH2-OE1 3.35Å; W410-E484 HydrophobicContact CZ2-CB 4.29Å; W410-E484 HydrophobicContact CZ2-CG 3.72Å; W410-E484 WeakPolarHBondContact CZ2-OE1 3.05Å; W410-E484 HydrophobicContact CZ3-CB 3.62Å; W410-E484 HydrophobicContact CZ3-CG 4.01Å
411	L	87	Confident	75.2	Confident	2 Å²	2	67.4 Å²	67.4	1%	0.01	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	118.8	170.3	-170.2	73.1	0	0	0	109.5	W358 Q360 L396 E482 F483	W358-L411 HydrophobicContact CB-CD1 3.85Å; W358-L411 HydrophobicContact CB-CD2 4.32Å; W358-L411 HydrophobicContact CB-CG 4.07Å; W358-L411 HydrophobicContact CD2-CD2 4.11Å; W358-L411 HydrophobicContact CD2-CG 4.23Å; W358-L411 HydrophobicContact CE3-CD2 4.04Å; W358-L411 HydrophobicContact CE3-CG 3.82Å; W358-L411 HydrophobicContact CG-CD2 4.23Å; W358-L411 HydrophobicContact CG-CG 4.35Å; Q360-L411 HydrophobicContact CG-CD1 4.13Å; L396-L411 HydrophobicContact CD2-CD1 4.13Å; L396-L411 HydrophobicContact CD2-CD2 3.74Å; L411-E482 CarbonylContact O-C 3.55Å; L411-E482 VanDerWaalsContact O-CA 3.32Å; L411-E482 WeakPolarHBondContact O-CA 3.24Å; L411-F483 HydrophobicContact CB-CB 4.24Å; L411-F483 PolarHBondContact N-O 2.8Å; L411-F483 PolarHBondContact O-N 3.33Å
412	Q	86.3	Confident	76	Confident	41 Å²	41	69.3 Å²	69.3	19%	0.192	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	140.4	-172.1	-57.9	-173.9	-12.7	0	0	112.1	W358 R359 E482	W358-Q412 VanDerWaalsContact CE3-C 3.44Å; R359-Q412 PolarHBondContact N-O 3.19Å; R359-Q412 PolarHBondContact O-N 3.43Å; Q412-E482 HydrophobicContact CG-CG 4.05Å; Q412-E482 PolarHBondContact NE2-OE1 2.82Å
413	S	86.1	Confident	77.3	Confident	4 Å²	4	65 Å²	65	3%	0.028	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-86.2	164.5	173.2	79.9	0	0	0	0	111.9	V481	S413-V481 PolarHBondContact N-O 2.78Å; S413-V481 PolarHBondContact OG-N 2.85Å
414	L	83.4	Confident	78.6	Confident	27 Å²	27	63.9 Å²	63.9	14%	0.141	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-62.1	155.1	163.3	-62.9	-178.4	0	0	0	111.7	L310 K346 F357 L416	L310-L414 HydrophobicContact CD1-CD1 3.79Å; L310-L414 HydrophobicContact CD1-CD2 3.38Å; L310-L414 HydrophobicContact CD1-CG 4.19Å; K346-L414 HydrophobicContact CD-CB 4.41Å; K346-L414 HydrophobicContact CG-CD1 4.47Å; F357-L414 HydrophobicContact CB-CD1 3.84Å; F357-L414 HydrophobicContact CB-CG 4.21Å; F357-L414 HydrophobicContact CD1-CD1 4.12Å; F357-L414 HydrophobicContact CG-CD1 4.18Å; L414-L416 PolarHBondContact O-N 2.04Å
415	P	82.8	Confident	80	Confident	67 Å²	67	55.4 Å²	55.4	44%	0.435	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-61.2	125.9	177.1	24.2	-33.7	0	0	0	111.1	K346 M480	K346-P415 PolarHBondContact NZ-O 3.36Å; K346-P415 VanDerWaalsContact NZ-O 3.13Å; P415-M480 HydrophobicContact CB-CG 4.26Å
416	L	82.5	Confident	81.1	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-90.1	138.1	178.6	-62.2	171.4	0	0	0	110.5	N343 K346 L347 L414 L475 D478 A479 V481	N343-L416 HydrophobicContact CB-CD2 3.9Å; K346-L416 HydrophobicContact CB-CD2 4.35Å; K346-L416 HydrophobicContact CD-CD2 4.34Å; L347-L416 HydrophobicContact CD1-CD1 3.69Å; L347-L416 HydrophobicContact CD1-CD2 3.18Å; L347-L416 HydrophobicContact CD1-CG 3.79Å; L347-L416 HydrophobicContact CD2-CD1 4.44Å; L414-L416 PolarHBondContact O-N 2.04Å; L416-L475 HydrophobicContact CB-CD1 3.92Å; L416-L475 HydrophobicContact CB-CD2 4.37Å; L416-L475 HydrophobicContact CD1-CD1 4.03Å; L416-L475 HydrophobicContact CD1-CD2 4.35Å; L416-D478 WeakPolarHBondContact O-CA 3.38Å; L416-A479 WeakPolarHBondContact CB-O 3.4Å; L416-A479 PolarHBondContact N-O 2.93Å; L416-A479 PolarHBondContact O-N 3.1Å; L416-V481 HydrophobicContact CD1-CG2 3.89Å
417	T	81	Confident	81.9	Confident	75 Å²	75	41.5 Å²	41.5	46%	0.46	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-82.2	141.9	174.5	53	0	0	0	0	110.3	N343 S419	N343-T417 PolarHBondContact ND2-O 3Å; N343-T417 PolarHBondContact OD1-N 2.74Å; N343-T417 PolarHBondContact OD1-OG1 2.97Å; T417-S419 PolarHBondContact O-N 2.86Å
418	P	79.6	Confident	82.5	Confident	65 Å²	65	40.8 Å²	40.8	42%	0.422	22%	0.22	S	C	.	.	P	Polyproline II helix	trans	-61.9	137.1	-178.5	24.5	-35.1	0	0	0	111.6	D478	P418-D478 WeakPolarHBondContact CD-OD1 3.12Å
419	S	73.4	Confident	82.7	Confident	40 Å²	40	34.7 Å²	34.7	28%	0.28	20%	0.197	S	C	.	.			trans	-115.9	139.4	177.7	170.8	0	0	0	0	109.6	T417 H421	T417-S419 PolarHBondContact O-N 2.86Å; S419-H421 PolarHBondContact O-N 3.19Å; S419-H421 PolarHBondContact OG-N 2.92Å; S419-H421 PolarHBondContact OG-O 3.04Å
420	P	70.1	Confident	82.7	Confident	120 Å²	120	34.7 Å²	34.7	78%	0.779	20%	0.197	S	C	*	.	S	Bend	trans	-70.5	-14.1	177.1	27.6	-32.8	0	0	0	113.6
421	H	76.9	Confident	82.5	Confident	129 Å²	129	33 Å²	33	60%	0.597	19%	0.191	S	C	*	.	S	Bend	trans	-110.4	140.5	179.1	-55.8	96.2	0	0	0	110.6	S419	S419-H421 PolarHBondContact O-N 3.19Å; S419-H421 PolarHBondContact OG-N 2.92Å; S419-H421 PolarHBondContact OG-O 3.04Å
422	P	79.4	Confident	81.9	Confident	44 Å²	44	35.6 Å²	35.6	29%	0.286	20%	0.202	S	C	.	.			trans	-61.2	139.6	172	28.4	-35.2	0	0	0	109.9	T472 N474 P506	P422-T472 HydrophobicContact CB-CG2 3.84Å; P422-N474 VanDerWaalsContact CB-OD1 3.3Å; P422-N474 WeakPolarHBondContact CB-OD1 3.25Å; P422-P506 HydrophobicContact CB-CB 4.35Å; P422-P506 HydrophobicContact CG-CB 3.95Å; P422-P506 HydrophobicContact CG-CG 4.33Å
423	T	83.9	Confident	81.1	Confident	13 Å²	13	33.9 Å²	33.9	8%	0.08	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	150.5	178.7	54.5	0	0	0	0	110	T472 L473 T503 E505	T423-T472 CarbonylContact O-C 3.56Å; T423-T472 WeakPolarHBondContact O-CA 3.33Å; T423-L473 PolarHBondContact N-O 3.28Å; T423-L473 VanDerWaalsContact N-O 3.09Å; T423-L473 PolarHBondContact O-N 2.81Å; T423-T503 WeakPolarHBondContact CA-O 3.1Å; T423-T503 WeakPolarHBondContact CB-O 2.74Å; T423-E505 CarbonylContact C-O 3.52Å
424	C	85	Confident	80.2	Confident	7 Å²	7	39.1 Å²	39.1	5%	0.047	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	117.7	179.8	-174	0	0	0	0	110.4	L502 T503 E505 C507	C424-L502 WeakPolarHBondContact O-CA 3.24Å; C424-T503 PolarHBondContact N-O 3.45Å; C424-T503 PolarHBondContact O-N 3.28Å; C424-T503 PolarHBondContact O-OG1 3.16Å; C424-E505 WeakPolarHBondContact CB-O 3.32Å; C424-E505 PolarHBondContact N-O 3.35Å; C424-C507 WeakPolarHBondContact CA-SG 3.5Å; C424-C507 HydrophobicContact CB-CB 3.97Å; C424-C507 WeakPolarHBondContact CB-SG 3.03Å; C424-C507 WeakPolarHBondContact SG-CA 3.33Å; C424-C507 WeakPolarHBondContact SG-CB 3.44Å; C424-C507 CovalentContact SG-SG 2.03Å; C424-C507 PolarHBondContact SG-SG 3.19Å
425	L	86.1	Confident	79.4	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	116.9	170.5	-179.1	70	0	0	0	108.5	L347 F427 V441 Q470 V471 L473 V481 F483 I500 L502	L347-L425 HydrophobicContact CD2-CD1 3.7Å; L425-F427 HydrophobicContact CG-CD1 4.47Å; L425-V441 HydrophobicContact CD2-CG1 4.06Å; L425-Q470 CarbonylContact O-C 3.58Å; L425-Q470 VanDerWaalsContact O-CA 3.31Å; L425-Q470 WeakPolarHBondContact O-CA 3.46Å; L425-V471 PolarHBondContact N-O 2.84Å; L425-V471 PolarHBondContact O-N 3.43Å; L425-L473 HydrophobicContact CB-CD1 4.04Å; L425-L473 HydrophobicContact CB-CD2 4.43Å; L425-L473 HydrophobicContact CB-CG 4.05Å; L425-V481 HydrophobicContact CD2-CG1 4.04Å; L425-F483 HydrophobicContact CD2-CZ 4.4Å; L425-I500 HydrophobicContact CD1-CG2 3.84Å; L425-L502 HydrophobicContact CB-CD1 4.06Å; L425-L502 HydrophobicContact CD1-CD1 4.25Å
426	S	86.6	Confident	78.9	Confident	8 Å²	8	37.1 Å²	37.1	6%	0.056	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	140.4	174.8	37.1	0	0	0	0	110.3	Y468 G469 T501	S426-Y468 WeakPolarHBondContact CB-OH 3.44Å; S426-G469 WeakPolarHBondContact CA-O 3.5Å; S426-T501 PolarHBondContact N-O 3.19Å; S426-T501 PolarHBondContact O-N 3.32Å; S426-T501 PolarHBondContact O-OG1 3.38Å; S426-T501 PolarHBondContact OG-O 3.41Å; S426-T501 PolarHBondContact OG-OG1 2.99Å
427	F	87.5	Confident	78.7	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	155.6	178.7	59.6	-87.9	0	0	0	110.1	L425 Y429 L439 V441 F456 G469 V471 F483 L497 I500	L425-F427 HydrophobicContact CG-CD1 4.47Å; F427-Y429 HydrophobicContact CD2-CD1 4.16Å; F427-Y429 AromaticContact CE2-CD1 3.74Å; F427-Y429 HydrophobicContact CE2-CD1 3.74Å; F427-Y429 HydrophobicContact CE2-CG 4.27Å; F427-L439 HydrophobicContact CE2-CD2 4.5Å; F427-V441 HydrophobicContact CE1-CG2 3.79Å; F427-V441 HydrophobicContact CZ-CG2 3.68Å; F427-F456 HydrophobicContact CE2-CD1 4.49Å; F427-F456 HydrophobicContact CE2-CE1 4.1Å; F427-F456 HydrophobicContact CE2-CZ 4.47Å; F427-F456 AromaticContact CZ-CD1 3.76Å; F427-F456 HydrophobicContact CZ-CD1 3.76Å; F427-F456 HydrophobicContact CZ-CD2 4.46Å; F427-F456 AromaticContact CZ-CE1 3.72Å; F427-F456 HydrophobicContact CZ-CE1 3.72Å; F427-F456 HydrophobicContact CZ-CE2 4.45Å; F427-F456 HydrophobicContact CZ-CG 4.12Å; F427-F456 HydrophobicContact CZ-CZ 4.07Å; F427-G469 PolarHBondContact N-O 2.86Å; F427-G469 PolarHBondContact O-N 3.15Å; F427-G469 VanDerWaalsContact O-O 3.14Å; F427-V471 HydrophobicContact CE1-CG2 4Å; F427-F483 HydrophobicContact CD1-CE1 4.09Å; F427-F483 HydrophobicContact CD1-CZ 4.21Å; F427-F483 HydrophobicContact CD2-CE1 4.13Å; F427-F483 HydrophobicContact CE1-CE1 4.25Å; F427-F483 HydrophobicContact CE2-CE1 4.28Å; F427-F483 HydrophobicContact CG-CE1 4.03Å; F427-F483 HydrophobicContact CG-CZ 4.28Å; F427-F483 HydrophobicContact CZ-CE1 4.35Å; F427-L497 HydrophobicContact CD2-CD2 4.27Å; F427-I500 HydrophobicContact CB-CG1 4.08Å
428	W	84.8	Confident	78.8	Confident	48 Å²	48	37.6 Å²	37.6	18%	0.182	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	138	171.7	-67.5	84	0	0	0	109.7	H386 W466 N467 Y468 L497 D498 D499	H386-W428 AromaticContact CD2-CD2 3.81Å; H386-W428 AromaticContact CD2-CE3 3.78Å; H386-W428 AromaticContact CE1-CD1 3.9Å; H386-W428 AromaticContact CE1-CD2 3.52Å; H386-W428 AromaticContact CE1-CE2 3.1Å; H386-W428 AromaticContact CE1-CG 3.97Å; H386-W428 AromaticContact CE1-CH2 3.97Å; H386-W428 AromaticContact CE1-CZ2 3.38Å; H386-W428 WeakPolarHBondContact CE1-CZ2 3.43Å; H386-W428 AromaticContact CE1-NE1 3.34Å; H386-W428 PolarHBondContact CE1-NE1 3.08Å; H386-W428 VanDerWaalsContact CE1-NE1 3.34Å; H386-W428 AromaticContact CG-CD2 3.95Å; H386-W428 AromaticContact ND1-CD1 3.72Å; H386-W428 AromaticContact ND1-CD2 3.76Å; H386-W428 AromaticContact ND1-CE2 3.7Å; H386-W428 AromaticContact ND1-CG 3.75Å; H386-W428 AromaticContact ND1-NE1 3.64Å; H386-W428 AromaticContact NE2-CD2 3.55Å; H386-W428 AromaticContact NE2-CE2 3.39Å; H386-W428 AromaticContact NE2-CE3 3.66Å; H386-W428 AromaticContact NE2-CH2 3.45Å; H386-W428 WeakPolarHBondContact NE2-CH2 3.38Å; H386-W428 AromaticContact NE2-CZ2 3.36Å; H386-W428 WeakPolarHBondContact NE2-CZ2 3.29Å; H386-W428 AromaticContact NE2-CZ3 3.6Å; W428-W466 HydrophobicContact CB-CE3 3.97Å; W428-W466 HydrophobicContact CB-CZ3 4.44Å; W428-W466 HydrophobicContact CE3-CB 3.96Å; W428-W466 HydrophobicContact CZ3-CB 4.45Å; W428-N467 WeakPolarHBondContact CA-O 3.47Å; W428-Y468 HydrophobicContact CD2-CD2 4.01Å; W428-Y468 AromaticContact CE2-CD2 3.5Å; W428-Y468 VanDerWaalsContact CE2-CD2 3.5Å; W428-Y468 HydrophobicContact CH2-CD2 4.19Å; W428-Y468 HydrophobicContact CH2-CG 4.37Å; W428-Y468 AromaticContact CZ2-CD2 3.6Å; W428-Y468 HydrophobicContact CZ2-CD2 3.6Å; W428-Y468 HydrophobicContact CZ2-CE2 4.41Å; W428-Y468 HydrophobicContact CZ2-CG 4.21Å; W428-Y468 AromaticContact NE1-CD2 3.72Å; W428-L497 WeakPolarHBondContact O-CA 2.97Å; W428-D498 HydrophobicContact CB-CB 4.44Å; W428-D498 PolarHBondContact N-O 2.78Å; W428-D498 PolarHBondContact O-N 3.28Å; W428-D499 VanDerWaalsContact CD1-CB 3.46Å; W428-D499 HydrophobicContact CG-CB 4.35Å
429	Y	86.8	Confident	79.2	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	144.7	178.9	69.4	-81.2	0	0	0	111	F427 M431 L439 F456 K458 N467 A496	F427-Y429 HydrophobicContact CD2-CD1 4.16Å; F427-Y429 AromaticContact CE2-CD1 3.74Å; F427-Y429 HydrophobicContact CE2-CD1 3.74Å; F427-Y429 HydrophobicContact CE2-CG 4.27Å; Y429-M431 HydrophobicContact CD2-CG 3.97Å; Y429-M431 HydrophobicContact CD2-SD 3.8Å; Y429-M431 HydrophobicContact CE2-SD 3.99Å; Y429-L439 HydrophobicContact CD2-CD2 4.11Å; Y429-L439 HydrophobicContact CG-CD2 4.02Å; Y429-F456 HydrophobicContact CE1-CE1 4.46Å; Y429-F456 AromaticContact CE1-CZ 3.9Å; Y429-F456 HydrophobicContact CE1-CZ 3.9Å; Y429-K458 HydrophobicContact CE2-CG 4.4Å; Y429-N467 HydrophobicContact CD1-CB 4.16Å; Y429-N467 VanDerWaalsContact CD1-O 3.25Å; Y429-N467 WeakPolarHBondContact CD1-O 3.27Å; Y429-N467 HydrophobicContact CD2-CB 4.33Å; Y429-N467 HydrophobicContact CE1-CB 3.69Å; Y429-N467 HydrophobicContact CE2-CB 3.92Å; Y429-N467 HydrophobicContact CG-CB 4.45Å; Y429-N467 PolarHBondContact N-O 3.12Å; Y429-N467 PolarHBondContact O-N 2.74Å; Y429-A496 WeakPolarHBondContact CA-O 3.48Å
430	H	83.8	Confident	80	Confident	2 Å²	2	35.1 Å²	35.1	1%	0.009	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	131	174.5	178.7	-77	0	0	0	109	T380 P382 F432 D464 W466 I495 A496	T380-H430 PolarHBondContact O-CE1 2.8Å; P382-H430 HydrophobicContact CB-CB 4.48Å; P382-H430 HydrophobicContact CG-CB 4.42Å; H430-F432 WeakPolarHBondContact CE1-CB 3.45Å; H430-D464 IonicContact CD2-OD1 3.57Å; H430-D464 IonicContact CE1-OD1 3.85Å; H430-D464 IonicContact NE2-OD1 2.76Å; H430-D464 PolarHBondContact NE2-OD1 3.13Å; H430-W466 HydrophobicContact CB-CD2 4.21Å; H430-W466 HydrophobicContact CB-CE3 3.88Å; H430-W466 HydrophobicContact CB-CH2 4.4Å; H430-W466 HydrophobicContact CB-CZ3 3.98Å; H430-I495 WeakPolarHBondContact O-CA 3.35Å; H430-A496 HydrophobicContact CB-CB 4.26Å; H430-A496 PolarHBondContact N-O 3.39Å; H430-A496 PolarHBondContact O-N 3.01Å
431	M	80	Confident	80.8	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	88.9	-174	-73.6	-179.1	75.4	0	0	108.7	Y429 V436 L439 K458 N461 Y462 I495	Y429-M431 HydrophobicContact CD2-CG 3.97Å; Y429-M431 HydrophobicContact CD2-SD 3.8Å; Y429-M431 HydrophobicContact CE2-SD 3.99Å; M431-V436 HydrophobicContact CB-CG1 4.19Å; M431-V436 HydrophobicContact CE-CG1 3.53Å; M431-V436 HydrophobicContact CG-CG1 4.43Å; M431-L439 HydrophobicContact CE-CB 4.1Å; M431-L439 HydrophobicContact SD-CB 3.74Å; M431-L439 HydrophobicContact SD-CD2 4.31Å; M431-K458 HydrophobicContact SD-CB 4.39Å; M431-N461 PolarHBondContact O-OD1 3.02Å; M431-Y462 HydrophobicContact CB-CD2 4.37Å; M431-Y462 PolarHBondContact O-N 3.3Å; M431-Y462 HydrophobicContact SD-CD2 4.36Å; M431-I495 HydrophobicContact CE-CD1 4.42Å; M431-I495 HydrophobicContact CG-CG1 4.36Å; M431-I495 HydrophobicContact CG-CG2 4.16Å
432	F	75	Confident	81.4	Confident	57 Å²	57	23.6 Å²	23.6	25%	0.25	12%	0.12	C	C	.	.			trans	-130.2	122.5	-177.9	-176.6	-120.1	0	0	0	111.6	S379 T380 H430 N461 D464	S379-F432 WeakPolarHBondContact O-CD1 3.41Å; S379-F432 WeakPolarHBondContact O-CE1 3.48Å; T380-F432 WeakPolarHBondContact CB-O 3.3Å; T380-F432 VanDerWaalsContact O-O 3.05Å; H430-F432 WeakPolarHBondContact CE1-CB 3.45Å; F432-N461 WeakPolarHBondContact CD2-OD1 3.47Å; F432-D464 HydrophobicContact CD1-CB 4Å; F432-D464 HydrophobicContact CD2-CB 4.16Å; F432-D464 HydrophobicContact CE1-CB 4.1Å; F432-D464 HydrophobicContact CE2-CB 4.27Å; F432-D464 HydrophobicContact CG-CB 4.05Å; F432-D464 HydrophobicContact CZ-CB 4.25Å
433	G	69	Low	81.7	Confident	5 Å²	5	22 Å²	22	5%	0.052	11%	0.109	C	C	.	.	S	Bend	trans	156	165.4	179	0	0	0	0	0	113.1	N461 W492	G433-N461 PolarHBondContact N-ND2 2.8Å; G433-N461 WeakPolarHBondContact O-CB 3.33Å; G433-N461 PolarHBondContact O-ND2 2.83Å; G433-W492 CarbonylContact C-O 3.6Å; G433-W492 WeakPolarHBondContact CA-O 3.5Å
434	V	66.1	Low	81.7	Confident	114 Å²	114	25.9 Å²	25.9	69%	0.691	12%	0.122	S	C	*	.	S	Bend	trans	-79	-29.9	-179.6	-176.6	0	0	0	0	110.8	W492	V434-W492 HydrophobicContact CG2-CE3 4.19Å; V434-W492 PolarHBondContact N-O 2.03Å; V434-W492 VanDerWaalsContact N-O 3.17Å
435	D	67.1	Low	81.6	Confident	45 Å²	45	26.4 Å²	26.4	24%	0.241	13%	0.126	C	C	.	.	S	Bend	trans	-109.9	13.4	-171.9	-58.6	-49.7	0	0	0	112.9	K488 G490 W492 N493	D435-K488 HydrophobicContact CB-CB 4.41Å; D435-K488 WeakPolarHBondContact O-CB 3.23Å; D435-K488 PolarHBondContact O-N 3.28Å; D435-K488 VanDerWaalsContact O-N 3.09Å; D435-G490 WeakPolarHBondContact OD2-CA 3.48Å; D435-W492 PolarHBondContact N-O 3.32Å; D435-N493 HydrophobicContact CB-CB 3.88Å; D435-N493 WeakPolarHBondContact O-CB 3.5Å
436	V	72.8	Confident	81.1	Confident	7 Å²	7	29.3 Å²	29.3	4%	0.042	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	132	173.5	179.9	0	0	0	0	109.7	M431 I495	M431-V436 HydrophobicContact CB-CG1 4.19Å; M431-V436 HydrophobicContact CE-CG1 3.53Å; M431-V436 HydrophobicContact CG-CG1 4.43Å; V436-I495 HydrophobicContact CG1-CD1 4.13Å; V436-I495 HydrophobicContact CG1-CG1 3.95Å
437	H	78	Confident	80.6	Confident	33 Å²	33	34.1 Å²	34.1	15%	0.153	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	-78.4	179.6	-160.7	8.8	0	0	0	113.6	E406 D459 G460 L486 K488	E406-H437 IonicContact OE1-CD2 3.47Å; E406-H437 IonicContact OE1-NE2 2.64Å; H437-D459 WeakPolarHBondContact O-CA 3.43Å; H437-G460 PolarHBondContact O-N 3.05Å; H437-G460 VanDerWaalsContact O-N 3.1Å; H437-L486 HydrophobicContact CB-CB 4.11Å; H437-L486 WeakPolarHBondContact CB-O 3.39Å; H437-L486 PolarHBondContact N-O 3.05Å; H437-K488 HydrophobicContact CB-CG 3.84Å; H437-K488 WeakPolarHBondContact ND1-CE 3.25Å
438	R	83.8	Confident	79.2	Confident	53 Å²	53	40.7 Å²	40.7	20%	0.2	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	137.2	-164.8	179.9	-176.1	-64	146.2	8.5	111.6	R440 Q457 K458 D459 L486	R438-R440 VanDerWaalsContact CD-NE 3.26Å; R438-R440 HydrophobicContact CG-CG 4.14Å; R438-R440 VanDerWaalsContact NH1-NH2 3.11Å; R438-Q457 HydrophobicContact CG-CG 4.06Å; R438-K458 VanDerWaalsContact CA-O 3.27Å; R438-K458 WeakPolarHBondContact CA-O 3.37Å; R438-K458 WeakPolarHBondContact CG-O 3.25Å; R438-D459 IonicContact CZ-OD1 2.8Å; R438-D459 IonicContact NE-OD1 3Å; R438-D459 PolarHBondContact NE-OD1 2.88Å; R438-D459 IonicContact NE-OD2 3.35Å; R438-D459 PolarHBondContact NE-OD2 3.1Å; R438-D459 IonicContact NH2-OD1 2.78Å; R438-D459 PolarHBondContact NH2-OD1 3Å; R438-L486 HydrophobicContact CB-CB 4.15Å; R438-L486 HydrophobicContact CB-CD1 4.07Å; R438-L486 HydrophobicContact CG-CD1 4.33Å; R438-L486 PolarHBondContact N-O 3.34Å; R438-L486 PolarHBondContact O-N 2.86Å
439	L	87.6	Confident	78.1	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	133.7	168.1	177.9	66.8	0	0	0	109.5	F427 Y429 M431 Q457 K458 A485 I495 L497	F427-L439 HydrophobicContact CE2-CD2 4.5Å; Y429-L439 HydrophobicContact CD2-CD2 4.11Å; Y429-L439 HydrophobicContact CG-CD2 4.02Å; M431-L439 HydrophobicContact CE-CB 4.1Å; M431-L439 HydrophobicContact SD-CB 3.74Å; M431-L439 HydrophobicContact SD-CD2 4.31Å; L439-Q457 WeakPolarHBondContact O-CA 3.38Å; L439-K458 PolarHBondContact N-O 3.19Å; L439-K458 PolarHBondContact O-N 3.34Å; L439-A485 HydrophobicContact CD1-CB 4.31Å; L439-I495 HydrophobicContact CD1-CG2 4.25Å; L439-L497 HydrophobicContact CD1-CD2 4.43Å; L439-L497 HydrophobicContact CD2-CD2 3.93Å
440	R	88.9	Confident	77.1	Confident	52 Å²	52	48.4 Å²	48.4	20%	0.196	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	144.9	179.1	-82.2	169.3	169.6	170.8	3.3	111.9	R438 V442 V454 F456 Q457 F483 E484	R438-R440 VanDerWaalsContact CD-NE 3.26Å; R438-R440 HydrophobicContact CG-CG 4.14Å; R438-R440 VanDerWaalsContact NH1-NH2 3.11Å; R440-V442 HydrophobicContact CB-CG2 4.18Å; R440-V454 HydrophobicContact CG-CG1 4.35Å; R440-F456 CarbonylContact C-O 3.21Å; R440-F456 VanDerWaalsContact CA-O 3.24Å; R440-F456 WeakPolarHBondContact CA-O 3.48Å; R440-Q457 HydrophobicContact CG-CB 3.97Å; R440-Q457 HydrophobicContact CG-CG 3.78Å; R440-F483 WeakPolarHBondContact O-CA 3.43Å; R440-E484 HydrophobicContact CB-CB 4.1Å; R440-E484 WeakPolarHBondContact CD-OE2 3.13Å; R440-E484 PolarHBondContact N-O 3.29Å; R440-E484 IonicContact NE-OE2 3.63Å; R440-E484 IonicContact NH1-OE2 3.96Å; R440-E484 PolarHBondContact NH1-OE2 2.84Å; R440-E484 PolarHBondContact O-N 2.7Å
441	V	88.3	Confident	76.5	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	120.1	166.1	-171.7	0	0	0	0	107.9	L425 F427 L455 F456 V481 E482 F483	L425-V441 HydrophobicContact CD2-CG1 4.06Å; F427-V441 HydrophobicContact CE1-CG2 3.79Å; F427-V441 HydrophobicContact CZ-CG2 3.68Å; V441-L455 PolarHBondContact O-N 2.64Å; V441-F456 HydrophobicContact CB-CB 3.9Å; V441-F456 HydrophobicContact CG2-CB 3.94Å; V441-F456 HydrophobicContact CG2-CD1 4.14Å; V441-F456 HydrophobicContact CG2-CG 4.4Å; V441-F456 PolarHBondContact N-O 3.06Å; V441-F456 PolarHBondContact O-N 3.17Å; V441-V481 HydrophobicContact CG1-CG1 3.82Å; V441-E482 WeakPolarHBondContact CA-O 3.08Å; V441-F483 HydrophobicContact CG1-CE1 4.48Å; V441-F483 HydrophobicContact CG2-CD1 3.71Å; V441-F483 HydrophobicContact CG2-CE1 3.5Å; V441-F483 VanDerWaalsContact CG2-CE1 3.5Å; V441-F483 HydrophobicContact CG2-CZ 4.29Å
442	V	88.5	Confident	76.4	Confident	7 Å²	7	57.6 Å²	57.6	4%	0.042	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	137.1	-173	-174	0	0	0	0	109	R440 A452 I453 V454 E482	R440-V442 HydrophobicContact CB-CG2 4.18Å; V442-A452 HydrophobicContact CG1-CB 3.55Å; V442-I453 CarbonylContact C-O 3.43Å; V442-I453 WeakPolarHBondContact CA-O 3.15Å; V442-V454 HydrophobicContact CG2-CG2 4.39Å; V442-E482 HydrophobicContact CB-CB 4.4Å; V442-E482 PolarHBondContact N-O 2.9Å; V442-E482 PolarHBondContact O-N 2.92Å
443	L	86.7	Confident	76.7	Confident	10 Å²	10	59 Å²	59	5%	0.052	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	114.7	171.7	-173.1	74	0	0	0	108.5	I453 L455 L475 A479 M480 V481	L443-I453 HydrophobicContact CB-CB 4.4Å; L443-I453 PolarHBondContact N-O 2.96Å; L443-I453 PolarHBondContact O-N 2.84Å; L443-L455 HydrophobicContact CB-CD1 3.76Å; L443-L455 HydrophobicContact CB-CG 4.17Å; L443-L475 HydrophobicContact CD1-CD2 3.83Å; L443-L475 HydrophobicContact CD2-CD2 4.26Å; L443-A479 HydrophobicContact CD1-CB 3.81Å; L443-A479 HydrophobicContact CD2-CB 4.46Å; L443-A479 HydrophobicContact CG-CB 3.98Å; L443-M480 WeakPolarHBondContact CA-O 3.23Å; L443-V481 HydrophobicContact CD1-CG2 3.85Å
444	R	84.3	Confident	77.3	Confident	95 Å²	95	62.2 Å²	62.2	36%	0.358	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	113.1	178.4	-170	178.6	-60.2	-111.3	1.2	110	A479 M480 E482	R444-A479 CarbonylContact O-C 3.55Å; R444-A479 VanDerWaalsContact O-CA 3.3Å; R444-A479 WeakPolarHBondContact O-CA 3.31Å; R444-A479 WeakPolarHBondContact O-CB 3.05Å; R444-M480 PolarHBondContact N-O 3.39Å; R444-M480 PolarHBondContact O-N 2.99Å; R444-E482 HydrophobicContact CB-CG 4.49Å; R444-E482 VanDerWaalsContact CD-OE1 3.28Å; R444-E482 WeakPolarHBondContact CD-OE1 2.98Å; R444-E482 IonicContact CZ-OE1 3.81Å; R444-E482 IonicContact CZ-OE2 2.77Å; R444-E482 IonicContact NE-OE1 2.97Å; R444-E482 PolarHBondContact NE-OE1 3.3Å; R444-E482 IonicContact NE-OE2 3.85Å; R444-E482 PolarHBondContact NE-OE2 2.76Å; R444-E482 IonicContact NH2-OE1 2.85Å; R444-E482 IonicContact NH2-OE2 3.07Å; R444-E482 PolarHBondContact NH2-OE2 3.09Å
445	P	83	Confident	78.1	Confident	18 Å²	18	59.4 Å²	59.4	12%	0.117	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	145.6	172.1	-18.5	31.9	0	0	0	110.5	L447 A450	P445-L447 PolarHBondContact O-N 3.1Å; P445-A450 HydrophobicContact CB-CB 3.89Å; P445-A450 HydrophobicContact CG-CB 3.85Å
446	S	75.6	Confident	78.9	Confident	61 Å²	61	58.6 Å²	58.6	43%	0.427	32%	0.322	S	S	.	.	S	Bend	trans	-72	1.2	178.1	-50.6	0	0	0	0	113.2	D478	S446-D478 WeakPolarHBondContact CB-O 3.43Å; S446-D478 PolarHBondContact N-O 3.19Å; S446-D478 PolarHBondContact OG-O 3.31Å
447	L	74.3	Confident	79.5	Confident	109 Å²	109	62 Å²	62	57%	0.571	34%	0.338	S	S	*	.	S	Bend	trans	-82.7	127.7	177.6	-71.6	164.3	0	0	0	109.8	P445 D449 A450	P445-L447 PolarHBondContact O-N 3.1Å; L447-D449 PolarHBondContact O-N 2.73Å; L447-A450 HydrophobicContact CB-CB 4.09Å; L447-A450 PolarHBondContact O-N 2.94Å
448	P	59.6	Low	79.6	Confident	138 Å²	138	62.2 Å²	62.2	90%	0.896	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-12.5	-168.6	-1.4	-2.1	0	0	0	116.9
449	D	60.4	Low	79.5	Confident	169 Å²	169	62.6 Å²	62.6	90%	0.904	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127	11.5	-171	-130.3	6.5	0	0	0	112.4	L447	L447-D449 PolarHBondContact O-N 2.73Å
450	A	65.8	Low	78.7	Confident	41 Å²	41	63.9 Å²	63.9	34%	0.339	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-94.1	128.3	-179.3	0	0	0	0	0	111	P445 L447	P445-A450 HydrophobicContact CB-CB 3.89Å; P445-A450 HydrophobicContact CG-CB 3.85Å; L447-A450 HydrophobicContact CB-CB 4.09Å; L447-A450 PolarHBondContact O-N 2.94Å
451	D	71.9	Confident	78	Confident	151 Å²	151	65.3 Å²	65.3	81%	0.807	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-60.9	139.7	176.4	-76.5	-31.7	0	0	0	111.6
452	A	78.1	Confident	77.1	Confident	44 Å²	44	68.7 Å²	68.7	36%	0.364	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-70.6	135.4	176.8	0	0	0	0	0	111	V442	V442-A452 HydrophobicContact CG1-CB 3.55Å
453	I	81.5	Confident	76	Confident	86 Å²	86	69.7 Å²	69.7	44%	0.441	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	115.2	-175.6	-57.3	171	0	0	0	109	V442 L443 L455	V442-I453 CarbonylContact C-O 3.43Å; V442-I453 WeakPolarHBondContact CA-O 3.15Å; L443-I453 HydrophobicContact CB-CB 4.4Å; L443-I453 PolarHBondContact N-O 2.96Å; L443-I453 PolarHBondContact O-N 2.84Å; I453-L455 HydrophobicContact CG2-CD2 3.89Å; I453-L455 PolarHBondContact O-N 2.8Å
454	V	82.1	Confident	75.2	Confident	73 Å²	73	72.6 Å²	72.6	44%	0.442	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	117.4	174.4	-175.6	0	0	0	0	109.1	R440 V442 Q457	R440-V454 HydrophobicContact CG-CG1 4.35Å; V442-V454 HydrophobicContact CG2-CG2 4.39Å; V454-Q457 HydrophobicContact CG1-CB 4.28Å
455	L	82.8	Confident	74.7	Confident	56 Å²	56	71.9 Å²	71.9	29%	0.293	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-30.4	-178	-58.1	172.2	0	0	0	112.6	V441 L443 I453 V471 L473	V441-L455 PolarHBondContact O-N 2.64Å; L443-L455 HydrophobicContact CB-CD1 3.76Å; L443-L455 HydrophobicContact CB-CG 4.17Å; I453-L455 HydrophobicContact CG2-CD2 3.89Å; I453-L455 PolarHBondContact O-N 2.8Å; L455-V471 HydrophobicContact CB-CG1 3.38Å; L455-V471 HydrophobicContact CD1-CG1 3.9Å; L455-V471 HydrophobicContact CG-CG1 4.22Å; L455-L473 HydrophobicContact CD1-CD2 3.27Å
456	F	82.6	Confident	74.4	Confident	28 Å²	28	73 Å²	73	12%	0.123	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	139.7	178.9	-176.3	-96.2	0	0	0	110	F427 Y429 R440 V441 K458 V471	F427-F456 HydrophobicContact CE2-CD1 4.49Å; F427-F456 HydrophobicContact CE2-CE1 4.1Å; F427-F456 HydrophobicContact CE2-CZ 4.47Å; F427-F456 AromaticContact CZ-CD1 3.76Å; F427-F456 HydrophobicContact CZ-CD1 3.76Å; F427-F456 HydrophobicContact CZ-CD2 4.46Å; F427-F456 AromaticContact CZ-CE1 3.72Å; F427-F456 HydrophobicContact CZ-CE1 3.72Å; F427-F456 HydrophobicContact CZ-CE2 4.45Å; F427-F456 HydrophobicContact CZ-CG 4.12Å; F427-F456 HydrophobicContact CZ-CZ 4.07Å; Y429-F456 HydrophobicContact CE1-CE1 4.46Å; Y429-F456 AromaticContact CE1-CZ 3.9Å; Y429-F456 HydrophobicContact CE1-CZ 3.9Å; R440-F456 CarbonylContact C-O 3.21Å; R440-F456 VanDerWaalsContact CA-O 3.24Å; R440-F456 WeakPolarHBondContact CA-O 3.48Å; V441-F456 HydrophobicContact CB-CB 3.9Å; V441-F456 HydrophobicContact CG2-CB 3.94Å; V441-F456 HydrophobicContact CG2-CD1 4.14Å; V441-F456 HydrophobicContact CG2-CG 4.4Å; V441-F456 PolarHBondContact N-O 3.06Å; V441-F456 PolarHBondContact O-N 3.17Å; F456-K458 HydrophobicContact CD1-CG 4.24Å; F456-K458 HydrophobicContact CE1-CB 4.11Å; F456-K458 HydrophobicContact CE1-CG 3.32Å; F456-K458 HydrophobicContact CE2-CG 4.09Å; F456-K458 HydrophobicContact CZ-CB 4.45Å; F456-K458 HydrophobicContact CZ-CD 4.07Å; F456-K458 HydrophobicContact CZ-CG 3.24Å; F456-V471 HydrophobicContact CB-CG2 3.58Å; F456-V471 HydrophobicContact CD2-CG2 3.96Å; F456-V471 HydrophobicContact CG-CG2 4.05Å
457	Q	84.9	Confident	74.4	Confident	79 Å²	79	70.7 Å²	70.7	37%	0.369	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	128.7	174.7	-178.2	177	-48.1	0	0	109.3	R438 L439 R440 V454 D459	R438-Q457 HydrophobicContact CG-CG 4.06Å; L439-Q457 WeakPolarHBondContact O-CA 3.38Å; R440-Q457 HydrophobicContact CG-CB 3.97Å; R440-Q457 HydrophobicContact CG-CG 3.78Å; V454-Q457 HydrophobicContact CG1-CB 4.28Å; Q457-D459 PolarHBondContact NE2-OD2 2.77Å
458	K	81.4	Confident	74.7	Confident	36 Å²	36	68.6 Å²	68.6	16%	0.157	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	137.9	172.3	-70	-75.1	-175.8	155.5	0	109.7	Y429 M431 R438 L439 F456 Y462 E513	Y429-K458 HydrophobicContact CE2-CG 4.4Å; M431-K458 HydrophobicContact SD-CB 4.39Å; R438-K458 VanDerWaalsContact CA-O 3.27Å; R438-K458 WeakPolarHBondContact CA-O 3.37Å; R438-K458 WeakPolarHBondContact CG-O 3.25Å; L439-K458 PolarHBondContact N-O 3.19Å; L439-K458 PolarHBondContact O-N 3.34Å; F456-K458 HydrophobicContact CD1-CG 4.24Å; F456-K458 HydrophobicContact CE1-CB 4.11Å; F456-K458 HydrophobicContact CE1-CG 3.32Å; F456-K458 HydrophobicContact CE2-CG 4.09Å; F456-K458 HydrophobicContact CZ-CB 4.45Å; F456-K458 HydrophobicContact CZ-CD 4.07Å; F456-K458 HydrophobicContact CZ-CG 3.24Å; K458-Y462 HydrophobicContact CB-CE2 4.04Å; K458-Y462 HydrophobicContact CD-CE1 4.31Å; K458-Y462 HydrophobicContact CD-CE2 4.37Å; K458-Y462 WeakPolarHBondContact CD-OH 3.36Å; K458-E513 VanDerWaalsContact NZ-CD 3.27Å; K458-E513 IonicContact NZ-OE1 2.7Å; K458-E513 PolarHBondContact NZ-OE1 2.89Å; K458-E513 IonicContact NZ-OE2 3.56Å; K458-E513 PolarHBondContact NZ-OE2 3.02Å
459	D	80.5	Confident	75.7	Confident	61 Å²	61	62 Å²	62	33%	0.326	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	129.6	-175.4	-74.3	-95.7	0	0	0	109.5	H437 R438 Q457	H437-D459 WeakPolarHBondContact O-CA 3.43Å; R438-D459 IonicContact CZ-OD1 2.8Å; R438-D459 IonicContact NE-OD1 3Å; R438-D459 PolarHBondContact NE-OD1 2.88Å; R438-D459 IonicContact NE-OD2 3.35Å; R438-D459 PolarHBondContact NE-OD2 3.1Å; R438-D459 IonicContact NH2-OD1 2.78Å; R438-D459 PolarHBondContact NH2-OD1 3Å; Q457-D459 PolarHBondContact NE2-OD2 2.77Å
460	G	72.4	Confident	76.9	Confident	28 Å²	28	56.1 Å²	56.1	29%	0.289	31%	0.31	S	S	.	.	S	Bend	trans	102.9	-169.2	174.7	0	0	0	0	0	115.7	H437	H437-G460 PolarHBondContact O-N 3.05Å; H437-G460 VanDerWaalsContact O-N 3.1Å
461	N	74.6	Confident	77.8	Confident	81 Å²	81	54.6 Å²	54.6	43%	0.433	30%	0.297	S	S	.	.			trans	-95.3	127	-177.7	-179.3	-11.7	0	0	0	110.2	M431 F432 G433 G463	M431-N461 PolarHBondContact O-OD1 3.02Å; F432-N461 WeakPolarHBondContact CD2-OD1 3.47Å; G433-N461 PolarHBondContact N-ND2 2.8Å; G433-N461 WeakPolarHBondContact O-CB 3.33Å; G433-N461 PolarHBondContact O-ND2 2.83Å; N461-G463 PolarHBondContact OD1-N 2.72Å
462	Y	68.6	Low	78.4	Confident	72 Å²	72	50 Å²	50	28%	0.282	27%	0.274	S	S	.	.			trans	-110.9	17.8	-176.3	-74.3	-90	0	0	0	113.6	M431 K458	M431-Y462 HydrophobicContact CB-CD2 4.37Å; M431-Y462 PolarHBondContact O-N 3.3Å; M431-Y462 HydrophobicContact SD-CD2 4.36Å; K458-Y462 HydrophobicContact CB-CE2 4.04Å; K458-Y462 HydrophobicContact CD-CE1 4.31Å; K458-Y462 HydrophobicContact CD-CE2 4.37Å; K458-Y462 WeakPolarHBondContact CD-OH 3.36Å
463	G	65.6	Low	78.5	Confident	27 Å²	27	48 Å²	48	28%	0.278	26%	0.257	S	S	.	.			trans	81.8	169.1	178.4	0	0	0	0	0	113.5	N461 T465	N461-G463 PolarHBondContact OD1-N 2.72Å; G463-T465 PolarHBondContact O-N 3.45Å
464	D	70.3	Confident	78.5	Confident	72 Å²	72	49.1 Å²	49.1	39%	0.385	26%	0.264	S	S	.	.	S	Bend	trans	-82.8	57.1	-179.8	-171.1	22.6	0	0	0	111.7	N383 H430 F432	N383-D464 PolarHBondContact ND2-OD2 3.16Å; H430-D464 IonicContact CD2-OD1 3.57Å; H430-D464 IonicContact CE1-OD1 3.85Å; H430-D464 IonicContact NE2-OD1 2.76Å; H430-D464 PolarHBondContact NE2-OD1 3.13Å; F432-D464 HydrophobicContact CD1-CB 4Å; F432-D464 HydrophobicContact CD2-CB 4.16Å; F432-D464 HydrophobicContact CE1-CB 4.1Å; F432-D464 HydrophobicContact CE2-CB 4.27Å; F432-D464 HydrophobicContact CG-CB 4.05Å; F432-D464 HydrophobicContact CZ-CB 4.25Å
465	T	71.9	Confident	78.3	Confident	80 Å²	80	46.1 Å²	46.1	49%	0.491	25%	0.246	S	C	.	.	S	Bend	trans	-143.8	146.9	178.3	53.4	0	0	0	0	110.7	G463 N467	G463-T465 PolarHBondContact O-N 3.45Å; T465-N467 PolarHBondContact O-N 3.32Å; T465-N467 PolarHBondContact O-ND2 3.38Å
466	W	77	Confident	77.9	Confident	40 Å²	40	49.8 Å²	49.8	15%	0.152	27%	0.27	C	S	.	.			trans	-66.9	127.9	171.4	-72.5	104.5	0	0	0	111	P382 S384 H386 Y395 W428 H430 A496 D498	P382-W466 HydrophobicContact CB-CZ2 3.71Å; P382-W466 HydrophobicContact CG-CH2 4.04Å; P382-W466 HydrophobicContact CG-CZ2 3.58Å; S384-W466 PolarHBondContact O-NE1 2.77Å; H386-W466 HydrophobicContact CB-CB 4.45Å; H386-W466 HydrophobicContact CB-CD2 3.77Å; H386-W466 HydrophobicContact CB-CE3 4.29Å; H386-W466 HydrophobicContact CB-CG 3.83Å; H386-W466 HydrophobicContact CB-CZ2 4.46Å; Y395-W466 HydrophobicContact CD2-CH2 4.42Å; Y395-W466 HydrophobicContact CG-CH2 4.2Å; Y395-W466 HydrophobicContact CG-CZ2 4.29Å; W428-W466 HydrophobicContact CB-CE3 3.97Å; W428-W466 HydrophobicContact CB-CZ3 4.44Å; W428-W466 HydrophobicContact CE3-CB 3.96Å; W428-W466 HydrophobicContact CZ3-CB 4.45Å; H430-W466 HydrophobicContact CB-CD2 4.21Å; H430-W466 HydrophobicContact CB-CE3 3.88Å; H430-W466 HydrophobicContact CB-CH2 4.4Å; H430-W466 HydrophobicContact CB-CZ3 3.98Å; W466-A496 HydrophobicContact CH2-CB 4.16Å; W466-D498 HydrophobicContact CE3-CB 4.37Å; W466-D498 HydrophobicContact CH2-CB 3.57Å; W466-D498 HydrophobicContact CZ2-CB 4.37Å; W466-D498 HydrophobicContact CZ3-CB 3.57Å
467	N	76.7	Confident	77.7	Confident	13 Å²	13	50.3 Å²	50.3	7%	0.07	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	139.7	179.3	-66.7	-77.8	0	0	0	110.3	W428 Y429 T465	W428-N467 WeakPolarHBondContact CA-O 3.47Å; Y429-N467 HydrophobicContact CD1-CB 4.16Å; Y429-N467 VanDerWaalsContact CD1-O 3.25Å; Y429-N467 WeakPolarHBondContact CD1-O 3.27Å; Y429-N467 HydrophobicContact CD2-CB 4.33Å; Y429-N467 HydrophobicContact CE1-CB 3.69Å; Y429-N467 HydrophobicContact CE2-CB 3.92Å; Y429-N467 HydrophobicContact CG-CB 4.45Å; Y429-N467 PolarHBondContact N-O 3.12Å; Y429-N467 PolarHBondContact O-N 2.74Å; T465-N467 PolarHBondContact O-N 3.32Å; T465-N467 PolarHBondContact O-ND2 3.38Å
468	Y	81.1	Confident	77.5	Confident	65 Å²	65	50.5 Å²	50.5	26%	0.255	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	121.7	179.6	-176.3	-106.9	0	0	0	111.2	S426 W428 Q470 P511	S426-Y468 WeakPolarHBondContact CB-OH 3.44Å; W428-Y468 HydrophobicContact CD2-CD2 4.01Å; W428-Y468 AromaticContact CE2-CD2 3.5Å; W428-Y468 VanDerWaalsContact CE2-CD2 3.5Å; W428-Y468 HydrophobicContact CH2-CD2 4.19Å; W428-Y468 HydrophobicContact CH2-CG 4.37Å; W428-Y468 AromaticContact CZ2-CD2 3.6Å; W428-Y468 HydrophobicContact CZ2-CD2 3.6Å; W428-Y468 HydrophobicContact CZ2-CE2 4.41Å; W428-Y468 HydrophobicContact CZ2-CG 4.21Å; W428-Y468 AromaticContact NE1-CD2 3.72Å; Y468-Q470 HydrophobicContact CE1-CB 3.92Å; Y468-Q470 HydrophobicContact CE1-CG 4.08Å; Y468-P511 HydrophobicContact CD1-CG 3.79Å; Y468-P511 HydrophobicContact CE1-CG 4.4Å
469	G	80.5	Confident	77.7	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.01	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	138.1	172.2	0	0	0	0	0	111.1	S426 F427	S426-G469 WeakPolarHBondContact CA-O 3.5Å; F427-G469 PolarHBondContact N-O 2.86Å; F427-G469 PolarHBondContact O-N 3.15Å; F427-G469 VanDerWaalsContact O-O 3.14Å
470	Q	84.4	Confident	77.9	Confident	44 Å²	44	48.2 Å²	48.2	21%	0.206	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	141.6	172.3	57	163.9	49.8	0	0	111.7	L425 Y468 G508	L425-Q470 CarbonylContact O-C 3.58Å; L425-Q470 VanDerWaalsContact O-CA 3.31Å; L425-Q470 WeakPolarHBondContact O-CA 3.46Å; Y468-Q470 HydrophobicContact CE1-CB 3.92Å; Y468-Q470 HydrophobicContact CE1-CG 4.08Å; Q470-G508 PolarHBondContact NE2-O 3.08Å
471	V	84.5	Confident	78.7	Confident	9 Å²	9	46.9 Å²	46.9	6%	0.055	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	128.3	-171.9	-178.9	0	0	0	0	110.4	L425 F427 L455 F456 L473 C507	L425-V471 PolarHBondContact N-O 2.84Å; L425-V471 PolarHBondContact O-N 3.43Å; F427-V471 HydrophobicContact CE1-CG2 4Å; L455-V471 HydrophobicContact CB-CG1 3.38Å; L455-V471 HydrophobicContact CD1-CG1 3.9Å; L455-V471 HydrophobicContact CG-CG1 4.22Å; F456-V471 HydrophobicContact CB-CG2 3.58Å; F456-V471 HydrophobicContact CD2-CG2 3.96Å; F456-V471 HydrophobicContact CG-CG2 4.05Å; V471-L473 HydrophobicContact CG1-CD2 4.31Å; V471-C507 PolarHBondContact O-SG 2.93Å; V471-C507 VanDerWaalsContact O-SG 3.39Å
472	T	84.1	Confident	79.3	Confident	56 Å²	56	43 Å²	43	34%	0.344	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	122.2	175.9	-52.1	0	0	0	0	110.4	P422 T423	P422-T472 HydrophobicContact CB-CG2 3.84Å; T423-T472 CarbonylContact O-C 3.56Å; T423-T472 WeakPolarHBondContact O-CA 3.33Å
473	L	81.4	Confident	80.3	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	120.3	175.5	-54.4	-175.9	0	0	0	110.9	T423 L425 L455 V471 V481 L502	T423-L473 PolarHBondContact N-O 3.28Å; T423-L473 VanDerWaalsContact N-O 3.09Å; T423-L473 PolarHBondContact O-N 2.81Å; L425-L473 HydrophobicContact CB-CD1 4.04Å; L425-L473 HydrophobicContact CB-CD2 4.43Å; L425-L473 HydrophobicContact CB-CG 4.05Å; L455-L473 HydrophobicContact CD1-CD2 3.27Å; V471-L473 HydrophobicContact CG1-CD2 4.31Å; L473-V481 HydrophobicContact CD1-CG2 4.09Å; L473-L502 HydrophobicContact CD1-CD1 3.71Å; L473-L502 HydrophobicContact CG-CD1 4.49Å
474	N	82.2	Confident	81.4	Confident	109 Å²	109	38.9 Å²	38.9	58%	0.583	21%	0.212	S	C	*	.			trans	-110.6	83.9	173.8	-73.2	-8.7	0	0	0	110.3	P422 T476	P422-N474 VanDerWaalsContact CB-OD1 3.3Å; P422-N474 WeakPolarHBondContact CB-OD1 3.25Å; N474-T476 PolarHBondContact O-N 3.32Å
475	L	75.9	Confident	82.2	Confident	11 Å²	11	35.5 Å²	35.5	6%	0.058	19%	0.193	C	C	.	.			trans	-80	104.3	-176.8	-64.6	163.4	0	0	0	110.9	L416 L443 A479	L416-L475 HydrophobicContact CB-CD1 3.92Å; L416-L475 HydrophobicContact CB-CD2 4.37Å; L416-L475 HydrophobicContact CD1-CD1 4.03Å; L416-L475 HydrophobicContact CD1-CD2 4.35Å; L443-L475 HydrophobicContact CD1-CD2 3.83Å; L443-L475 HydrophobicContact CD2-CD2 4.26Å; L475-A479 HydrophobicContact CD2-CB 3.89Å
476	T	75.1	Confident	82.8	Confident	132 Å²	132	31.9 Å²	31.9	81%	0.81	17%	0.171	S	C	*	.	S	Bend	trans	-94.7	-18.3	176.2	53.4	0	0	0	0	113.5	N474	N474-T476 PolarHBondContact O-N 3.32Å
477	S	78.3	Confident	82.9	Confident	39 Å²	39	30 Å²	30	27%	0.273	16%	0.164	S	C	.	.	S	Bend	trans	-148.1	168.5	177.7	53.6	0	0	0	0	109	A479	S477-A479 PolarHBondContact O-N 3.4Å
478	D	81.6	Confident	82.8	Confident	84 Å²	84	33.7 Å²	33.7	45%	0.449	18%	0.179	S	C	.	.			trans	-58.9	123.5	177	-65.5	-24	0	0	0	110.1	L416 P418 S446	L416-D478 WeakPolarHBondContact O-CA 3.38Å; P418-D478 WeakPolarHBondContact CD-OD1 3.12Å; S446-D478 WeakPolarHBondContact CB-O 3.43Å; S446-D478 PolarHBondContact N-O 3.19Å; S446-D478 PolarHBondContact OG-O 3.31Å
479	A	84.2	Confident	81.8	Confident	2 Å²	2	31.8 Å²	31.8	2%	0.017	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	157.3	-175.2	0	0	0	0	0	111.6	L416 L443 R444 L475 S477	L416-A479 WeakPolarHBondContact CB-O 3.4Å; L416-A479 PolarHBondContact N-O 2.93Å; L416-A479 PolarHBondContact O-N 3.1Å; L443-A479 HydrophobicContact CD1-CB 3.81Å; L443-A479 HydrophobicContact CD2-CB 4.46Å; L443-A479 HydrophobicContact CG-CB 3.98Å; R444-A479 CarbonylContact O-C 3.55Å; R444-A479 VanDerWaalsContact O-CA 3.3Å; R444-A479 WeakPolarHBondContact O-CA 3.31Å; R444-A479 WeakPolarHBondContact O-CB 3.05Å; L475-A479 HydrophobicContact CD2-CB 3.89Å; S477-A479 PolarHBondContact O-N 3.4Å
480	M	86.1	Confident	81	Confident	46 Å²	46	32.5 Å²	32.5	23%	0.227	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	144.9	175.3	-64.1	179.6	-62.7	0	0	109.7	P415 L443 R444	P415-M480 HydrophobicContact CB-CG 4.26Å; L443-M480 WeakPolarHBondContact CA-O 3.23Å; R444-M480 PolarHBondContact N-O 3.39Å; R444-M480 PolarHBondContact O-N 2.99Å
481	V	87.8	Confident	79.9	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	131	172.8	177.3	0	0	0	0	108.2	L347 W358 S413 L416 L425 V441 L443 L473 F483	L347-V481 HydrophobicContact CD2-CB 4.21Å; L347-V481 HydrophobicContact CD2-CG2 4.05Å; W358-V481 HydrophobicContact CH2-CG1 4.4Å; S413-V481 PolarHBondContact N-O 2.78Å; S413-V481 PolarHBondContact OG-N 2.85Å; L416-V481 HydrophobicContact CD1-CG2 3.89Å; L425-V481 HydrophobicContact CD2-CG1 4.04Å; V441-V481 HydrophobicContact CG1-CG1 3.82Å; L443-V481 HydrophobicContact CD1-CG2 3.85Å; L473-V481 HydrophobicContact CD1-CG2 4.09Å; V481-F483 HydrophobicContact CG1-CE2 4.37Å
482	E	88.6	Confident	79.2	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	127.6	-178.8	-51.8	-176.3	163.8	0	0	109.7	W410 L411 Q412 V441 V442 R444	W410-E482 HydrophobicContact CE3-CB 4.15Å; W410-E482 HydrophobicContact CZ3-CB 4.22Å; W410-E482 WeakPolarHBondContact CZ3-OE2 3.4Å; L411-E482 CarbonylContact O-C 3.55Å; L411-E482 VanDerWaalsContact O-CA 3.32Å; L411-E482 WeakPolarHBondContact O-CA 3.24Å; Q412-E482 HydrophobicContact CG-CG 4.05Å; Q412-E482 PolarHBondContact NE2-OE1 2.82Å; V441-E482 WeakPolarHBondContact CA-O 3.08Å; V442-E482 HydrophobicContact CB-CB 4.4Å; V442-E482 PolarHBondContact N-O 2.9Å; V442-E482 PolarHBondContact O-N 2.92Å; R444-E482 HydrophobicContact CB-CG 4.49Å; R444-E482 VanDerWaalsContact CD-OE1 3.28Å; R444-E482 WeakPolarHBondContact CD-OE1 2.98Å; R444-E482 IonicContact CZ-OE1 3.81Å; R444-E482 IonicContact CZ-OE2 2.77Å; R444-E482 IonicContact NE-OE1 2.97Å; R444-E482 PolarHBondContact NE-OE1 3.3Å; R444-E482 IonicContact NE-OE2 3.85Å; R444-E482 PolarHBondContact NE-OE2 2.76Å; R444-E482 IonicContact NH2-OE1 2.85Å; R444-E482 IonicContact NH2-OE2 3.07Å; R444-E482 PolarHBondContact NH2-OE2 3.09Å
483	F	89.3	Confident	78.6	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	117.4	165.5	-70.5	-94.3	0	0	0	108.7	W358 W410 L411 L425 F427 R440 V441 V481 L497 I500	W358-F483 AromaticContact CH2-CD2 3.96Å; W358-F483 HydrophobicContact CH2-CD2 3.96Å; W358-F483 AromaticContact CH2-CE2 3.53Å; W358-F483 HydrophobicContact CH2-CE2 3.53Å; W358-F483 HydrophobicContact CZ2-CE2 4.13Å; W358-F483 AromaticContact CZ3-CD2 3.87Å; W358-F483 HydrophobicContact CZ3-CD2 3.87Å; W358-F483 AromaticContact CZ3-CE2 3.96Å; W358-F483 HydrophobicContact CZ3-CE2 3.96Å; W410-F483 WeakPolarHBondContact CA-O 3.43Å; L411-F483 HydrophobicContact CB-CB 4.24Å; L411-F483 PolarHBondContact N-O 2.8Å; L411-F483 PolarHBondContact O-N 3.33Å; L425-F483 HydrophobicContact CD2-CZ 4.4Å; F427-F483 HydrophobicContact CD1-CE1 4.09Å; F427-F483 HydrophobicContact CD1-CZ 4.21Å; F427-F483 HydrophobicContact CD2-CE1 4.13Å; F427-F483 HydrophobicContact CE1-CE1 4.25Å; F427-F483 HydrophobicContact CE2-CE1 4.28Å; F427-F483 HydrophobicContact CG-CE1 4.03Å; F427-F483 HydrophobicContact CG-CZ 4.28Å; F427-F483 HydrophobicContact CZ-CE1 4.35Å; R440-F483 WeakPolarHBondContact O-CA 3.43Å; V441-F483 HydrophobicContact CG1-CE1 4.48Å; V441-F483 HydrophobicContact CG2-CD1 3.71Å; V441-F483 HydrophobicContact CG2-CE1 3.5Å; V441-F483 VanDerWaalsContact CG2-CE1 3.5Å; V441-F483 HydrophobicContact CG2-CZ 4.29Å; V481-F483 HydrophobicContact CG1-CE2 4.37Å; F483-L497 HydrophobicContact CB-CD1 4.11Å; F483-L497 HydrophobicContact CD1-CD1 3.83Å; F483-L497 HydrophobicContact CD1-CD2 4.28Å; F483-L497 HydrophobicContact CE1-CD1 4.43Å; F483-L497 HydrophobicContact CE1-CD2 4.39Å; F483-L497 HydrophobicContact CG-CD1 3.98Å; F483-I500 HydrophobicContact CE2-CD1 3.85Å; F483-I500 HydrophobicContact CZ-CD1 4.03Å; F483-I500 HydrophobicContact CZ-CG1 4.49Å; F483-I500 HydrophobicContact CZ-CG2 4.48Å
484	E	87.7	Confident	78.2	Confident	12 Å²	12	38 Å²	38	6%	0.056	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	115	175.8	178	-174	-143.3	0	0	108.6	W410 R440 L486	W410-E484 HydrophobicContact CD2-CB 4.47Å; W410-E484 HydrophobicContact CE3-CB 3.97Å; W410-E484 HydrophobicContact CE3-CG 4.4Å; W410-E484 HydrophobicContact CH2-CB 3.78Å; W410-E484 VanDerWaalsContact CH2-CD 3.42Å; W410-E484 HydrophobicContact CH2-CG 3.63Å; W410-E484 WeakPolarHBondContact CH2-OE1 3.35Å; W410-E484 HydrophobicContact CZ2-CB 4.29Å; W410-E484 HydrophobicContact CZ2-CG 3.72Å; W410-E484 WeakPolarHBondContact CZ2-OE1 3.05Å; W410-E484 HydrophobicContact CZ3-CB 3.62Å; W410-E484 HydrophobicContact CZ3-CG 4.01Å; R440-E484 HydrophobicContact CB-CB 4.1Å; R440-E484 WeakPolarHBondContact CD-OE2 3.13Å; R440-E484 PolarHBondContact N-O 3.29Å; R440-E484 IonicContact NE-OE2 3.63Å; R440-E484 IonicContact NH1-OE2 3.96Å; R440-E484 PolarHBondContact NH1-OE2 2.84Å; R440-E484 PolarHBondContact O-N 2.7Å; E484-L486 HydrophobicContact CG-CG 4.46Å
485	A	87.3	Confident	78.3	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	126.9	172.3	0	0	0	0	0	110.8	W368 T398 F409 L439 I495	W368-A485 HydrophobicContact CH2-CB 3.81Å; W368-A485 HydrophobicContact CZ2-CB 3.46Å; W368-A485 VanDerWaalsContact CZ2-CB 3.46Å; T398-A485 HydrophobicContact CG2-CB 4.07Å; F409-A485 HydrophobicContact CB-CB 4.32Å; F409-A485 PolarHBondContact N-O 2.96Å; F409-A485 PolarHBondContact O-N 2.85Å; L439-A485 HydrophobicContact CD1-CB 4.31Å; A485-I495 HydrophobicContact CB-CD1 4.11Å; A485-I495 HydrophobicContact CB-CG2 4.47Å
486	L	84.6	Confident	78.8	Confident	5 Å²	5	32.3 Å²	32.3	3%	0.026	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	127.6	177.8	-71.4	158.4	0	0	0	109	R408 H437 R438 E484	R408-L486 HydrophobicContact CB-CD2 4.29Å; R408-L486 HydrophobicContact CG-CD2 3.57Å; H437-L486 HydrophobicContact CB-CB 4.11Å; H437-L486 WeakPolarHBondContact CB-O 3.39Å; H437-L486 PolarHBondContact N-O 3.05Å; R438-L486 HydrophobicContact CB-CB 4.15Å; R438-L486 HydrophobicContact CB-CD1 4.07Å; R438-L486 HydrophobicContact CG-CD1 4.33Å; R438-L486 PolarHBondContact N-O 3.34Å; R438-L486 PolarHBondContact O-N 2.86Å; E484-L486 HydrophobicContact CG-CG 4.46Å
487	K	79.8	Confident	79.4	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	137	177.3	-59.8	-177.1	107.4	176.3	0	109.3	T398 P399 E406 K407 F409 N493 D494 I495	T398-K487 HydrophobicContact CG2-CD 4.49Å; T398-K487 PolarHBondContact O-NZ 2.9Å; T398-K487 WeakPolarHBondContact OG1-CE 3.46Å; T398-K487 PolarHBondContact OG1-NZ 2.9Å; P399-K487 PolarHBondContact O-NZ 3.36Å; E406-K487 CarbonylContact C-O 3.59Å; E406-K487 WeakPolarHBondContact CA-O 3.4Å; K407-K487 PolarHBondContact N-O 2.9Å; K407-K487 PolarHBondContact O-N 3.03Å; F409-K487 HydrophobicContact CD2-CD 4.02Å; F409-K487 HydrophobicContact CD2-CG 4.21Å; F409-K487 HydrophobicContact CE2-CB 4.37Å; F409-K487 HydrophobicContact CE2-CD 3.41Å; F409-K487 VanDerWaalsContact CE2-CD 3.41Å; F409-K487 HydrophobicContact CE2-CG 3.87Å; F409-K487 HydrophobicContact CZ-CD 4.1Å; K487-N493 HydrophobicContact CB-CB 4.23Å; K487-N493 WeakPolarHBondContact CE-O 3.48Å; K487-N493 WeakPolarHBondContact CE-OD1 3.18Å; K487-N493 PolarHBondContact NZ-OD1 3.06Å; K487-D494 IonicContact NZ-OD1 3.54Å; K487-D494 PolarHBondContact NZ-OD1 2.67Å; K487-I495 HydrophobicContact CG-CD1 4.48Å
488	K	73.4	Confident	79.7	Confident	90 Å²	90	24.1 Å²	24.1	39%	0.391	12%	0.123	S	C	.	.			trans	-80.7	157	169.3	-62.3	-178.9	179.5	165.6	0	109.7	D435 H437 G490 N493	D435-K488 HydrophobicContact CB-CB 4.41Å; D435-K488 WeakPolarHBondContact O-CB 3.23Å; D435-K488 PolarHBondContact O-N 3.28Å; D435-K488 VanDerWaalsContact O-N 3.09Å; H437-K488 HydrophobicContact CB-CG 3.84Å; H437-K488 WeakPolarHBondContact ND1-CE 3.25Å; K488-G490 PolarHBondContact O-N 2.94Å; K488-N493 PolarHBondContact O-ND2 2.89Å
489	G	61.7	Low	79.8	Confident	26 Å²	26	21.5 Å²	21.5	27%	0.268	11%	0.109	S	C	.	.	S	Bend	trans	-59.3	122	174.6	0	0	0	0	0	111.8	G403 W405	G403-G489 CarbonylContact O-C 3.53Å; G403-G489 WeakPolarHBondContact O-CA 3.03Å; W405-G489 WeakPolarHBondContact O-CA 3.43Å; W405-G489 PolarHBondContact O-N 3.32Å
490	G	62.8	Low	79.9	Confident	16 Å²	16	21.4 Å²	21.4	17%	0.165	11%	0.108	C	C	.	.	S	Bend	trans	159.8	166.6	-174.5	0	0	0	0	0	112.2	G403 D435 K488 N493	G403-G490 PolarHBondContact O-N 2.81Å; G403-G490 VanDerWaalsContact O-N 3.16Å; D435-G490 WeakPolarHBondContact OD2-CA 3.48Å; K488-G490 PolarHBondContact O-N 2.94Å; G490-N493 PolarHBondContact O-ND2 2.81Å; G490-N493 VanDerWaalsContact O-ND2 3.14Å
491	M	62	Low	79.8	Confident	103 Å²	103	22 Å²	22	51%	0.507	11%	0.114	S	C	.	.	S	Bend	trans	-89.5	-9.9	-179.6	-70.5	-168.2	-73	0	0	113	M400	M400-M491 HydrophobicContact CE-CB 3.89Å; M400-M491 HydrophobicContact CE-CG 3.4Å; M400-M491 VanDerWaalsContact CE-CG 3.4Å; M400-M491 HydrophobicContact CE-SD 3.4Å; M400-M491 WeakPolarHBondContact CE-SD 3.4Å
492	W	68.6	Low	79.6	Confident	118 Å²	118	22.5 Å²	22.5	45%	0.447	12%	0.117	S	C	.	.			trans	-122.5	61.1	-164.6	-64.4	34.9	0	0	0	110.2	T380 G433 V434 D435	T380-W492 HydrophobicContact CG2-CB 3.59Å; T380-W492 HydrophobicContact CG2-CD2 4.49Å; T380-W492 HydrophobicContact CG2-CG 4.11Å; G433-W492 CarbonylContact C-O 3.6Å; G433-W492 WeakPolarHBondContact CA-O 3.5Å; V434-W492 HydrophobicContact CG2-CE3 4.19Å; V434-W492 PolarHBondContact N-O 2.03Å; V434-W492 VanDerWaalsContact N-O 3.17Å; D435-W492 PolarHBondContact N-O 3.32Å
493	N	71.3	Confident	79.2	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.135	C	C	.	.			trans	-133.9	18.4	-168	56.8	14.5	0	0	0	115.6	S401 D435 K487 K488 G490	S401-N493 PolarHBondContact OG-ND2 2.98Å; S401-N493 PolarHBondContact OG-OD1 2.85Å; D435-N493 HydrophobicContact CB-CB 3.88Å; D435-N493 WeakPolarHBondContact O-CB 3.5Å; K487-N493 HydrophobicContact CB-CB 4.23Å; K487-N493 WeakPolarHBondContact CE-O 3.48Å; K487-N493 WeakPolarHBondContact CE-OD1 3.18Å; K487-N493 PolarHBondContact NZ-OD1 3.06Å; K488-N493 PolarHBondContact O-ND2 2.89Å; G490-N493 PolarHBondContact O-ND2 2.81Å; G490-N493 VanDerWaalsContact O-ND2 3.14Å
494	D	74.3	Confident	78.5	Confident	4 Å²	4	30 Å²	30	2%	0.021	17%	0.165	C	C	.	.			trans	-61.8	136	-172.7	-60.3	-24.9	0	0	0	113.6	T375 T380 G381 V397 K487	T375-D494 PolarHBondContact OG1-OD2 3.03Å; T375-D494 VanDerWaalsContact OG1-OD2 3.13Å; T380-D494 PolarHBondContact OG1-OD2 3.49Å; G381-D494 PolarHBondContact N-OD2 3.48Å; V397-D494 HydrophobicContact CG2-CB 4.22Å; K487-D494 IonicContact NZ-OD1 3.54Å; K487-D494 PolarHBondContact NZ-OD1 2.67Å
495	I	83.6	Confident	78	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	126.3	172.9	-60.3	174.1	0	0	0	106.2	W368 T398 H430 M431 V436 L439 A485 K487	W368-I495 HydrophobicContact CH2-CG2 4.26Å; T398-I495 PolarHBondContact N-O 2.84Å; T398-I495 PolarHBondContact OG1-N 2.51Å; T398-I495 PolarHBondContact OG1-O 3.29Å; T398-I495 VanDerWaalsContact OG1-O 3.1Å; H430-I495 WeakPolarHBondContact O-CA 3.35Å; M431-I495 HydrophobicContact CE-CD1 4.42Å; M431-I495 HydrophobicContact CG-CG1 4.36Å; M431-I495 HydrophobicContact CG-CG2 4.16Å; V436-I495 HydrophobicContact CG1-CD1 4.13Å; V436-I495 HydrophobicContact CG1-CG1 3.95Å; L439-I495 HydrophobicContact CD1-CG2 4.25Å; A485-I495 HydrophobicContact CB-CD1 4.11Å; A485-I495 HydrophobicContact CB-CG2 4.47Å; K487-I495 HydrophobicContact CG-CD1 4.48Å
496	A	86.4	Confident	77.3	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	150.1	179.5	0	0	0	0	0	112.2	P382 Y395 L396 V397 Y429 H430 W466	P382-A496 HydrophobicContact CG-CB 3.91Å; Y395-A496 HydrophobicContact CD2-CB 3.74Å; Y395-A496 HydrophobicContact CE2-CB 3.99Å; L396-A496 CarbonylContact O-C 3.46Å; L396-A496 WeakPolarHBondContact O-CA 3.4Å; L396-A496 WeakPolarHBondContact O-CB 3.42Å; V397-A496 HydrophobicContact CB-CB 4.31Å; V397-A496 HydrophobicContact CG2-CB 4.15Å; Y429-A496 WeakPolarHBondContact CA-O 3.48Å; H430-A496 HydrophobicContact CB-CB 4.26Å; H430-A496 PolarHBondContact N-O 3.39Å; H430-A496 PolarHBondContact O-N 3.01Å; W466-A496 HydrophobicContact CH2-CB 4.16Å
497	L	87.9	Confident	76.9	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	142.5	179.6	-67.8	174.3	0	0	0	109.9	W368 L396 F427 W428 L439 F483	W368-L497 HydrophobicContact CH2-CD1 3.47Å; W368-L497 VanDerWaalsContact CH2-CD1 3.47Å; W368-L497 HydrophobicContact CH2-CG 3.82Å; W368-L497 HydrophobicContact CZ2-CD1 4.03Å; W368-L497 HydrophobicContact CZ3-CB 4.41Å; W368-L497 HydrophobicContact CZ3-CD1 3.79Å; W368-L497 HydrophobicContact CZ3-CG 3.86Å; L396-L497 PolarHBondContact N-O 3.09Å; L396-L497 VanDerWaalsContact N-O 3.08Å; L396-L497 PolarHBondContact O-N 2.92Å; F427-L497 HydrophobicContact CD2-CD2 4.27Å; W428-L497 WeakPolarHBondContact O-CA 2.97Å; L439-L497 HydrophobicContact CD1-CD2 4.43Å; L439-L497 HydrophobicContact CD2-CD2 3.93Å; F483-L497 HydrophobicContact CB-CD1 4.11Å; F483-L497 HydrophobicContact CD1-CD1 3.83Å; F483-L497 HydrophobicContact CD1-CD2 4.28Å; F483-L497 HydrophobicContact CE1-CD1 4.43Å; F483-L497 HydrophobicContact CE1-CD2 4.39Å; F483-L497 HydrophobicContact CG-CD1 3.98Å
498	D	85.7	Confident	76.5	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	161.7	176.8	-165.9	19.4	0	0	0	112.5	H386 T387 W428 W466 I500	H386-D498 WeakPolarHBondContact CA-OD2 3.26Å; H386-D498 HydrophobicContact CB-CB 4.5Å; H386-D498 VanDerWaalsContact CB-OD2 3.26Å; H386-D498 WeakPolarHBondContact CB-OD2 3.32Å; H386-D498 PolarHBondContact N-OD2 2.81Å; T387-D498 PolarHBondContact N-OD2 3.49Å; T387-D498 VanDerWaalsContact N-OD2 3.16Å; T387-D498 PolarHBondContact OG1-OD2 3.36Å; W428-D498 HydrophobicContact CB-CB 4.44Å; W428-D498 PolarHBondContact N-O 2.78Å; W428-D498 PolarHBondContact O-N 3.28Å; W466-D498 HydrophobicContact CE3-CB 4.37Å; W466-D498 HydrophobicContact CH2-CB 3.57Å; W466-D498 HydrophobicContact CZ2-CB 4.37Å; W466-D498 HydrophobicContact CZ3-CB 3.57Å; D498-I500 PolarHBondContact O-N 2.83Å
499	D	82.3	Confident	76.1	Confident	29 Å²	29	45.1 Å²	45.1	16%	0.155	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	51.5	50.5	170.1	-87.2	-26.5	0	0	0	114.4	H386 T387 W428 T501	H386-D499 IonicContact CE1-OD2 2.66Å; H386-D499 IonicContact ND1-OD2 2.67Å; H386-D499 PolarHBondContact ND1-OD2 3.28Å; T387-D499 PolarHBondContact OG1-OD1 3.18Å; T387-D499 PolarHBondContact OG1-OD2 2.82Å; W428-D499 VanDerWaalsContact CD1-CB 3.46Å; W428-D499 HydrophobicContact CG-CB 4.35Å; D499-T501 PolarHBondContact O-N 2.69Å
500	I	86.3	Confident	75.9	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	120.4	177.6	-53.8	175.5	0	0	0	108.8	S348 C349 F351 W358 L425 F427 F483 D498	S348-I500 CarbonylContact C-O 3.43Å; S348-I500 VanDerWaalsContact CA-O 3.23Å; S348-I500 WeakPolarHBondContact CA-O 3.31Å; C349-I500 PolarHBondContact N-O 2.76Å; C349-I500 PolarHBondContact O-N 3.05Å; F351-I500 HydrophobicContact CE2-CD1 3.93Å; F351-I500 HydrophobicContact CE2-CG1 4.05Å; F351-I500 HydrophobicContact CZ-CD1 3.64Å; F351-I500 HydrophobicContact CZ-CG1 4.25Å; W358-I500 HydrophobicContact CZ2-CD1 4Å; W358-I500 HydrophobicContact CZ2-CG2 3.93Å; L425-I500 HydrophobicContact CD1-CG2 3.84Å; F427-I500 HydrophobicContact CB-CG1 4.08Å; F483-I500 HydrophobicContact CE2-CD1 3.85Å; F483-I500 HydrophobicContact CZ-CD1 4.03Å; F483-I500 HydrophobicContact CZ-CG1 4.49Å; F483-I500 HydrophobicContact CZ-CG2 4.48Å; D498-I500 PolarHBondContact O-N 2.83Å
501	T	85.1	Confident	75.6	Confident	57 Å²	57	49.1 Å²	49.1	35%	0.35	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	138.9	-175.9	45.4	0	0	0	0	110.7	S426 D499	S426-T501 PolarHBondContact N-O 3.19Å; S426-T501 PolarHBondContact O-N 3.32Å; S426-T501 PolarHBondContact O-OG1 3.38Å; S426-T501 PolarHBondContact OG-O 3.41Å; S426-T501 PolarHBondContact OG-OG1 2.99Å; D499-T501 PolarHBondContact O-N 2.69Å
502	L	82.6	Confident	74.9	Confident	11 Å²	11	49.3 Å²	49.3	6%	0.058	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	118.4	176.1	-174.7	72.4	0	0	0	109.3	N343 L347 C424 L425 L473	N343-L502 HydrophobicContact CB-CD2 4.24Å; L347-L502 HydrophobicContact CB-CB 4.31Å; C424-L502 WeakPolarHBondContact O-CA 3.24Å; L425-L502 HydrophobicContact CB-CD1 4.06Å; L425-L502 HydrophobicContact CD1-CD1 4.25Å; L473-L502 HydrophobicContact CD1-CD1 3.71Å; L473-L502 HydrophobicContact CG-CD1 4.49Å
503	T	80.9	Confident	74.2	Confident	62 Å²	62	48.2 Å²	48.2	38%	0.38	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	144	179.5	56.1	0	0	0	0	111.3	T423 C424 E505	T423-T503 WeakPolarHBondContact CA-O 3.1Å; T423-T503 WeakPolarHBondContact CB-O 2.74Å; C424-T503 PolarHBondContact N-O 3.45Å; C424-T503 PolarHBondContact O-N 3.28Å; C424-T503 PolarHBondContact O-OG1 3.16Å; T503-E505 PolarHBondContact O-N 2.73Å
504	P	74.6	Confident	73.1	Confident	98 Å²	98	53.5 Å²	53.5	64%	0.636	34%	0.337	S	S	*	.	S	Bend	trans	-77	16.6	-175.4	30.5	-34.3	0	0	0	114.8
505	E	76.4	Confident	71.9	Confident	142 Å²	142	56 Å²	56	66%	0.664	35%	0.353	S	S	*	.	S	Bend	trans	-116	153.7	178.9	-64.2	-167.9	167.1	0	0	111.1	T423 C424 T503	T423-E505 CarbonylContact C-O 3.52Å; C424-E505 WeakPolarHBondContact CB-O 3.32Å; C424-E505 PolarHBondContact N-O 3.35Å; T503-E505 PolarHBondContact O-N 2.73Å
506	P	72.9	Confident	69.9	Low	83 Å²	83	63.2 Å²	63.2	54%	0.539	39%	0.392	S	S	.	.			trans	-65.7	142.4	172.3	25.1	-31.6	0	0	0	111.5	P422 G508	P422-P506 HydrophobicContact CB-CB 4.35Å; P422-P506 HydrophobicContact CG-CB 3.95Å; P422-P506 HydrophobicContact CG-CG 4.33Å; P506-G508 PolarHBondContact O-N 3.33Å
507	C	75.9	Confident	67.7	Low	27 Å²	27	68.2 Å²	68.2	18%	0.182	42%	0.422	C	S	.	.			trans	-60.7	138.5	-179.2	-58.8	0	0	0	0	112.3	C424 V471	C424-C507 WeakPolarHBondContact CA-SG 3.5Å; C424-C507 HydrophobicContact CB-CB 3.97Å; C424-C507 WeakPolarHBondContact CB-SG 3.03Å; C424-C507 WeakPolarHBondContact SG-CA 3.33Å; C424-C507 WeakPolarHBondContact SG-CB 3.44Å; C424-C507 CovalentContact SG-SG 2.03Å; C424-C507 PolarHBondContact SG-SG 3.19Å; V471-C507 PolarHBondContact O-SG 2.93Å; V471-C507 VanDerWaalsContact O-SG 3.39Å
508	G	71.6	Confident	65.2	Low	45 Å²	45	73 Å²	73	46%	0.464	45%	0.453	S	S	.	.			trans	-70.4	-176.8	174.5	0	0	0	0	0	113.6	Q470 P506 A510	Q470-G508 PolarHBondContact NE2-O 3.08Å; P506-G508 PolarHBondContact O-N 3.33Å; G508-A510 PolarHBondContact O-N 3.48Å
509	P	65.4	Low	62.8	Low	127 Å²	127	78.2 Å²	78.2	83%	0.825	49%	0.487	S	S	*	.	S	Bend	trans	-59.8	133.7	173	25.5	-32.3	0	0	0	110.6
510	A	57	Low	60.6	Low	80 Å²	80	82.2 Å²	82.2	66%	0.661	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-57.1	128.7	-178.6	0	0	0	0	0	110.5	G508	G508-A510 PolarHBondContact O-N 3.48Å
511	P	57.7	Low	58.2	Low	46 Å²	46	89.2 Å²	89.2	30%	0.299	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-62.5	150.6	176.8	23.3	-30.5	0	0	0	111.2	Y468 T515	Y468-P511 HydrophobicContact CD1-CG 3.79Å; Y468-P511 HydrophobicContact CE1-CG 4.4Å; P511-T515 HydrophobicContact CB-CG2 4.48Å
512	P	46.1	Very low	55.8	Low	107 Å²	107	92 Å²	92	70%	0.695	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-67.8	133.1	179.1	26	-31.8	0	0	0	111.7	P514 T515	P512-P514 CarbonylContact O-C 3.56Å; P512-P514 VanDerWaalsContact O-C 3.28Å; P512-T515 WeakPolarHBondContact O-CA 3.04Å; P512-T515 PolarHBondContact O-N 3.24Å; P512-T515 VanDerWaalsContact O-N 3.15Å; P512-T515 PolarHBondContact O-OG1 3.05Å
513	E	55.2	Low	53.3	Low	95 Å²	95	99.5 Å²	99.5	44%	0.444	61%	0.613	S	S	.	*	S	Bend	trans	-90.5	129.3	171.3	-71.3	176.2	-177.3	0	0	109.5	K458	K458-E513 VanDerWaalsContact NZ-CD 3.27Å; K458-E513 IonicContact NZ-OE1 2.7Å; K458-E513 PolarHBondContact NZ-OE1 2.89Å; K458-E513 IonicContact NZ-OE2 3.56Å; K458-E513 PolarHBondContact NZ-OE2 3.02Å
514	P	47.2	Very low	51.2	Low	110 Å²	110	99.7 Å²	99.7	71%	0.714	62%	0.621	S	S	*	*	S	Bend	cis	-79	132.3	-2	31	-32.1	0	0	0	112	P512 N516	P512-P514 CarbonylContact O-C 3.56Å; P512-P514 VanDerWaalsContact O-C 3.28Å; P514-N516 PolarHBondContact O-N 2.04Å
515	T	49.6	Very low	49.2	Very low	58 Å²	58	101.2 Å²	101.2	36%	0.356	63%	0.63	S	S	.	*			trans	-76	107.9	177.7	-48.4	0	0	0	0	108.4	P511 P512 V517	P511-T515 HydrophobicContact CB-CG2 4.48Å; P512-T515 WeakPolarHBondContact O-CA 3.04Å; P512-T515 PolarHBondContact O-N 3.24Å; P512-T515 VanDerWaalsContact O-N 3.15Å; P512-T515 PolarHBondContact O-OG1 3.05Å; T515-V517 PolarHBondContact O-N 2.63Å
516	N	41.1	Very low	47.5	Very low	151 Å²	151	98.1 Å²	98.1	81%	0.807	62%	0.618	S	S	*	*			trans	-59.8	109.6	169.6	-89.4	-28.2	0	0	0	108.4	P514 P518	P514-N516 PolarHBondContact O-N 2.04Å; N516-P518 WeakPolarHBondContact O-CD 3.3Å
517	V	40.6	Very low	45.8	Very low	104 Å²	104	97 Å²	97	63%	0.63	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-56.8	119.1	173.1	-177.5	0	0	0	0	108	T515	T515-V517 PolarHBondContact O-N 2.63Å
518	P	34.8	Very low	44.2	Very low	102 Å²	102	101.7 Å²	101.7	66%	0.662	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-61	133.9	166	-15.3	28.7	0	0	0	108	N516	N516-P518 WeakPolarHBondContact O-CD 3.3Å
519	P	36.8	Very low	43.4	Very low	109 Å²	109	105.5 Å²	105.5	71%	0.708	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-55.2	136.9	175	22.1	-31	0	0	0	109.3	T521	P519-T521 PolarHBondContact O-N 2.81Å; P519-T521 VanDerWaalsContact O-N 3.1Å
520	P	35.4	Very low	43.4	Very low	113 Å²	113	100.7 Å²	100.7	73%	0.734	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-53.6	120.6	-177.8	18.6	-29.8	0	0	0	109.9	T522	P520-T522 PolarHBondContact O-N 2.92Å; P520-T522 VanDerWaalsContact O-N 3.15Å
521	T	35.9	Very low	43.3	Very low	146 Å²	146	98.5 Å²	98.5	90%	0.896	60%	0.604	S	S	*	*	S	Bend	trans	-78.8	17.4	178.7	23.4	0	0	0	0	112.9	P519	P519-T521 PolarHBondContact O-N 2.81Å; P519-T521 VanDerWaalsContact O-N 3.1Å
522	T	34	Very low	43.5	Very low	115 Å²	115	97.6 Å²	97.6	71%	0.706	60%	0.604	S	S	*	*	S	Bend	trans	-132.5	114.6	178.8	-13.2	0	0	0	0	108.2	P520 A524	P520-T522 PolarHBondContact O-N 2.92Å; P520-T522 VanDerWaalsContact O-N 3.15Å; T522-A524 PolarHBondContact O-N 3Å
523	I	31.4	Very low	44.4	Very low	170 Å²	170	96.2 Å²	96.2	87%	0.872	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-58.5	121.7	169.6	-66.7	173.3	0	0	0	106.8
524	A	35.5	Very low	45.1	Very low	65 Å²	65	94.4 Å²	94.4	54%	0.537	59%	0.586	S	S	.	*	P	Polyproline II helix	trans	-54.9	138.9	-177.4	0	0	0	0	0	112.2	T522 I526	T522-A524 PolarHBondContact O-N 3Å; A524-I526 HydrophobicContact CB-CG1 4.39Å
525	P	32.9	Very low	46.4	Very low	130 Å²	130	92.1 Å²	92.1	84%	0.844	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-69.6	118.7	138.5	8	9.5	0	0	0	107.7
526	I	40.4	Very low	47.9	Very low	78 Å²	78	89.8 Å²	89.8	40%	0.4	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-78.1	151.3	178.3	-58.3	163.2	0	0	0	107.8	A524 F534	A524-I526 HydrophobicContact CB-CG1 4.39Å; I526-F534 HydrophobicContact CB-CB 4.07Å; I526-F534 HydrophobicContact CD1-CB 3.55Å; I526-F534 HydrophobicContact CD1-CD1 3.43Å; I526-F534 VanDerWaalsContact CD1-CD1 3.43Å; I526-F534 HydrophobicContact CD1-CD2 4.46Å; I526-F534 HydrophobicContact CD1-CE1 4.26Å; I526-F534 HydrophobicContact CD1-CG 3.57Å; I526-F534 HydrophobicContact CG1-CB 4.39Å; I526-F534 HydrophobicContact CG2-CB 3.63Å; I526-F534 HydrophobicContact CG2-CD2 4.09Å; I526-F534 HydrophobicContact CG2-CG 3.98Å
527	P	37.7	Very low	49.7	Very low	58 Å²	58	90.7 Å²	90.7	38%	0.377	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-49.7	132.7	-168.3	-29.9	35.4	0	0	0	113.8	D529	P527-D529 PolarHBondContact O-N 3.24Å; P527-D529 VanDerWaalsContact O-N 3.13Å
528	P	42.6	Very low	51.3	Low	126 Å²	126	93 Å²	93	82%	0.818	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-2.1	179	-13.5	25.9	0	0	0	115.5
529	D	54.5	Low	53.2	Low	126 Å²	126	91.7 Å²	91.7	67%	0.674	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-11.1	-164.8	-95.8	-15.1	0	0	0	116.2	P527 G531 P546	P527-D529 PolarHBondContact O-N 3.24Å; P527-D529 VanDerWaalsContact O-N 3.13Å; D529-G531 VanDerWaalsContact C-N 3.27Å; D529-G531 PolarHBondContact O-N 3.39Å; D529-P546 WeakPolarHBondContact O-CB 3.46Å; D529-P546 WeakPolarHBondContact O-CG 3.34Å
530	C	64.9	Low	55.1	Low	25 Å²	25	91.6 Å²	91.6	17%	0.169	54%	0.535	C	S	.	.	S	Bend	trans	-89.2	33.2	-179.3	-68.8	0	0	0	0	114.1	G532 S544 C558 W560	C530-G532 PolarHBondContact O-N 3.19Å; C530-S544 VanDerWaalsContact O-O 3.05Å; C530-C558 HydrophobicContact CB-CB 3.72Å; C530-C558 WeakPolarHBondContact CB-SG 3.33Å; C530-C558 WeakPolarHBondContact SG-CA 3.21Å; C530-C558 WeakPolarHBondContact SG-CB 3.02Å; C530-C558 CovalentContact SG-SG 2.04Å; C530-C558 PolarHBondContact SG-SG 3.34Å; C530-W560 HydrophobicContact CB-CZ2 3.94Å; C530-W560 WeakPolarHBondContact O-CZ2 3.4Å; C530-W560 PolarHBondContact O-NE1 2.85Å; C530-W560 VanDerWaalsContact O-NE1 3.08Å
531	G	55.7	Low	57.2	Low	34 Å²	34	87.2 Å²	87.2	35%	0.351	51%	0.508	S	S	.	.	S	Bend	trans	58.5	17.8	170.7	0	0	0	0	0	116.2	D529 S544	D529-G531 VanDerWaalsContact C-N 3.27Å; D529-G531 PolarHBondContact O-N 3.39Å; G531-S544 WeakPolarHBondContact CA-O 3.45Å
532	G	62.3	Low	59.4	Low	28 Å²	28	83.6 Å²	83.6	29%	0.289	49%	0.486	S	S	.	.	S	Bend	trans	171.1	167	-178.9	0	0	0	0	0	113.1	C530	C530-G532 PolarHBondContact O-N 3.19Å
533	P	63.8	Low	61.9	Low	78 Å²	78	78.2 Å²	78.2	51%	0.506	45%	0.452	S	S	.	.			trans	-67.9	144.7	176	28.8	-33	0	0	0	111	L536	P533-L536 HydrophobicContact CG-CD2 3.6Å; P533-L536 HydrophobicContact CG-CG 4.19Å
534	F	69.4	Low	64.4	Low	57 Å²	57	71.2 Å²	71.2	25%	0.25	42%	0.419	C	S	.	.	S	Bend	trans	-62.4	-43.1	179.7	169.9	-90.7	0	0	0	113.2	I526 L559 T561	I526-F534 HydrophobicContact CB-CB 4.07Å; I526-F534 HydrophobicContact CD1-CB 3.55Å; I526-F534 HydrophobicContact CD1-CD1 3.43Å; I526-F534 VanDerWaalsContact CD1-CD1 3.43Å; I526-F534 HydrophobicContact CD1-CD2 4.46Å; I526-F534 HydrophobicContact CD1-CE1 4.26Å; I526-F534 HydrophobicContact CD1-CG 3.57Å; I526-F534 HydrophobicContact CG1-CB 4.39Å; I526-F534 HydrophobicContact CG2-CB 3.63Å; I526-F534 HydrophobicContact CG2-CD2 4.09Å; I526-F534 HydrophobicContact CG2-CG 3.98Å; F534-L559 HydrophobicContact CD2-CB 4.36Å; F534-L559 HydrophobicContact CD2-CG 4.46Å; F534-L559 WeakPolarHBondContact CD2-O 3.38Å; F534-L559 HydrophobicContact CE2-CB 3.95Å; F534-L559 HydrophobicContact CE2-CD2 3.64Å; F534-L559 HydrophobicContact CE2-CG 3.67Å; F534-L559 HydrophobicContact CZ-CD2 4.13Å; F534-L559 HydrophobicContact CZ-CG 4.41Å; F534-T561 PolarHBondContact O-N 3.34Å
535	D	76.3	Confident	66.7	Low	61 Å²	61	68.1 Å²	68.1	33%	0.326	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	115.4	176.1	-76.5	-56.2	0	0	0	109.9	T561 H563	D535-T561 WeakPolarHBondContact CA-O 3.44Å; D535-H563 IonicContact OD1-CD2 3.25Å; D535-H563 IonicContact OD1-CE1 3.73Å; D535-H563 IonicContact OD1-NE2 3.63Å; D535-H563 PolarHBondContact OD1-NE2 2.97Å
536	L	80.6	Confident	68.9	Low	9 Å²	9	62.5 Å²	62.5	5%	0.047	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	113.5	179.2	-68.5	149.5	0	0	0	109.4	P533 F543 W560 T561 L562 H563 F638	P533-L536 HydrophobicContact CG-CD2 3.6Å; P533-L536 HydrophobicContact CG-CG 4.19Å; L536-F543 HydrophobicContact CD1-CB 4.03Å; L536-F543 HydrophobicContact CD1-CD1 3.78Å; L536-F543 HydrophobicContact CD1-CE1 4.47Å; L536-F543 HydrophobicContact CD1-CG 3.99Å; L536-W560 HydrophobicContact CD1-CB 4.44Å; L536-T561 PolarHBondContact N-O 2.92Å; L536-L562 HydrophobicContact CB-CD2 3.88Å; L536-L562 HydrophobicContact CD1-CD2 3.44Å; L536-L562 VanDerWaalsContact CD1-CD2 3.44Å; L536-L562 HydrophobicContact CG-CD2 4.29Å; L536-H563 PolarHBondContact O-N 2.99Å; L536-F638 HydrophobicContact CB-CE1 3.44Å; L536-F638 VanDerWaalsContact CB-CE1 3.44Å; L536-F638 HydrophobicContact CB-CZ 3.5Å; L536-F638 HydrophobicContact CD1-CE1 3.99Å; L536-F638 HydrophobicContact CD2-CE1 4.16Å; L536-F638 HydrophobicContact CG-CE1 4.07Å
537	W	78.4	Confident	70.4	Confident	170 Å²	170	64.1 Å²	64.1	64%	0.644	37%	0.366	S	S	*	.			trans	-106.8	-20	-178.2	-63.1	81	0	0	0	113.1	H563	W537-H563 HydrophobicContact CD2-CB 3.69Å; W537-H563 AromaticContact CD2-CG 3.95Å; W537-H563 AromaticContact CE2-CD2 3.61Å; W537-H563 AromaticContact CE2-CG 3.81Å; W537-H563 HydrophobicContact CE3-CB 3.46Å; W537-H563 VanDerWaalsContact CE3-CB 3.46Å; W537-H563 AromaticContact CE3-CG 3.99Å; W537-H563 HydrophobicContact CG-CB 4.31Å; W537-H563 HydrophobicContact CH2-CB 4.11Å; W537-H563 AromaticContact CH2-CG 3.78Å; W537-H563 AromaticContact CH2-ND1 3.71Å; W537-H563 HydrophobicContact CZ2-CB 4.31Å; W537-H563 AromaticContact CZ2-CD2 3.74Å; W537-H563 AromaticContact CZ2-CE1 3.94Å; W537-H563 AromaticContact CZ2-CG 3.74Å; W537-H563 AromaticContact CZ2-ND1 3.89Å; W537-H563 AromaticContact CZ2-NE2 3.86Å; W537-H563 HydrophobicContact CZ3-CB 3.69Å; W537-H563 AromaticContact CZ3-CG 3.91Å; W537-H563 AromaticContact NE1-CD2 3.86Å
538	E	73.9	Confident	72.1	Confident	153 Å²	153	64 Å²	64	72%	0.715	36%	0.358	S	S	*	.	S	Bend	trans	-84.2	122	-176.7	-65.1	-173.3	177.3	0	0	110.7	S541 F638	E538-S541 WeakPolarHBondContact O-CB 3.38Å; E538-S541 PolarHBondContact O-N 3.3Å; E538-S541 PolarHBondContact O-OG 2.85Å; E538-F638 WeakPolarHBondContact O-CE2 3.48Å; E538-F638 WeakPolarHBondContact O-CZ 3.33Å
539	S	74.2	Confident	73.6	Confident	75 Å²	75	61.9 Å²	61.9	52%	0.524	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	139.6	172.6	60.2	0	0	0	0	111.1
540	N	78.2	Confident	74.3	Confident	106 Å²	106	62.9 Å²	62.9	57%	0.567	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	30.6	-177.8	-158	19	0	0	0	113.5	N637 F638 T639	N540-N637 PolarHBondContact OD1-ND2 2.94Å; N540-N637 PolarHBondContact OD1-OD1 2.65Å; N540-F638 WeakPolarHBondContact CA-O 2.99Å; N540-F638 PolarHBondContact N-O 3.47Å; N540-T639 HydrophobicContact CB-CG2 4.16Å
541	S	78.3	Confident	74.7	Confident	22 Å²	22	63.7 Å²	63.7	15%	0.154	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	144.3	171.8	57.7	0	0	0	0	110.9	E538 N637 F638	E538-S541 WeakPolarHBondContact O-CB 3.38Å; E538-S541 PolarHBondContact O-N 3.3Å; E538-S541 PolarHBondContact O-OG 2.85Å; S541-N637 PolarHBondContact O-OD1 3.14Å; S541-F638 VanDerWaalsContact O-CD1 3.3Å; S541-F638 WeakPolarHBondContact O-CD1 3.23Å; S541-F638 PolarHBondContact O-N 2.93Å; S541-F638 WeakPolarHBondContact OG-CE1 3.45Å; S541-F638 WeakPolarHBondContact OG-CZ 3.05Å
542	T	83.3	Confident	75.5	Confident	70 Å²	70	62.2 Å²	62.2	43%	0.429	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	140.6	-178.2	59.7	0	0	0	0	110.8	L575 A636 N637	T542-L575 HydrophobicContact CG2-CD1 4.39Å; T542-A636 CarbonylContact C-O 3.58Å; T542-A636 WeakPolarHBondContact CA-O 3.26Å; T542-N637 HydrophobicContact CG2-CB 3.94Å
543	F	85.3	Confident	75.9	Confident	2 Å²	2	62.2 Å²	62.2	1%	0.009	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	156	172.3	65.9	-81.2	0	0	0	109.9	L536 W560 L562 L572 V621 F634 A636 F638	L536-F543 HydrophobicContact CD1-CB 4.03Å; L536-F543 HydrophobicContact CD1-CD1 3.78Å; L536-F543 HydrophobicContact CD1-CE1 4.47Å; L536-F543 HydrophobicContact CD1-CG 3.99Å; F543-W560 HydrophobicContact CD2-CB 4.41Å; F543-W560 AromaticContact CD2-CD1 3.82Å; F543-W560 AromaticContact CD2-CD2 3.68Å; F543-W560 HydrophobicContact CD2-CD2 3.68Å; F543-W560 AromaticContact CD2-CE2 3.74Å; F543-W560 HydrophobicContact CD2-CE3 4.28Å; F543-W560 AromaticContact CD2-CG 3.73Å; F543-W560 HydrophobicContact CD2-CG 3.73Å; F543-W560 HydrophobicContact CD2-CZ2 4.36Å; F543-W560 AromaticContact CD2-NE1 3.82Å; F543-W560 HydrophobicContact CE2-CB 4.3Å; F543-W560 AromaticContact CE2-CD2 3.81Å; F543-W560 HydrophobicContact CE2-CD2 3.81Å; F543-W560 AromaticContact CE2-CE3 4Å; F543-W560 HydrophobicContact CE2-CE3 4Å; F543-W560 AromaticContact CE2-CG 3.96Å; F543-W560 HydrophobicContact CE2-CG 3.96Å; F543-W560 HydrophobicContact CG-CG 4.41Å; F543-L562 HydrophobicContact CD1-CD2 4.45Å; F543-L562 HydrophobicContact CE1-CD1 4.45Å; F543-L562 HydrophobicContact CE1-CD2 4.03Å; F543-L572 HydrophobicContact CE1-CD1 3.82Å; F543-L572 HydrophobicContact CZ-CD1 3.88Å; F543-V621 HydrophobicContact CE2-CB 4.44Å; F543-V621 HydrophobicContact CE2-CG1 4.22Å; F543-V621 HydrophobicContact CZ-CB 4.36Å; F543-V621 HydrophobicContact CZ-CG1 4.37Å; F543-V621 HydrophobicContact CZ-CG2 4.13Å; F543-F634 HydrophobicContact CD2-CE2 4.24Å; F543-F634 AromaticContact CE2-CE2 3.83Å; F543-F634 HydrophobicContact CE2-CE2 3.83Å; F543-F634 HydrophobicContact CE2-CZ 4.42Å; F543-A636 HydrophobicContact CD1-CB 4.37Å; F543-A636 HydrophobicContact CE1-CB 3.82Å; F543-A636 HydrophobicContact CE2-CB 4.18Å; F543-A636 HydrophobicContact CZ-CB 3.72Å; F543-A636 PolarHBondContact N-O 3.46Å; F543-A636 PolarHBondContact O-N 2.8Å; F543-F638 HydrophobicContact CD1-CD1 4.38Å; F543-F638 HydrophobicContact CE1-CD1 4.34Å
544	S	84.8	Confident	76.3	Confident	23 Å²	23	62 Å²	62	16%	0.161	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	162.7	-178.6	55.8	0	0	0	0	112	C530 G531 F634	C530-S544 VanDerWaalsContact O-O 3.05Å; G531-S544 WeakPolarHBondContact CA-O 3.45Å; S544-F634 CarbonylContact C-O 3.18Å; S544-F634 WeakPolarHBondContact CA-O 3.45Å; S544-F634 VanDerWaalsContact CB-O 3.32Å; S544-F634 WeakPolarHBondContact CB-O 3.19Å
545	S	83.4	Confident	76.4	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	35%	0.352	C	S	.	.			trans	-59.3	161	168	58.3	0	0	0	0	111.8	Y548 G633 F634	S545-Y548 WeakPolarHBondContact O-CB 3.09Å; S545-Y548 PolarHBondContact O-N 2.95Å; S545-G633 VanDerWaalsContact OG-CA 3.24Å; S545-G633 WeakPolarHBondContact OG-CA 3.36Å; S545-F634 PolarHBondContact N-O 3.44Å; S545-F634 PolarHBondContact OG-N 3Å; S545-F634 PolarHBondContact OG-O 3.46Å
546	P	78.7	Confident	76.1	Confident	11 Å²	11	64.5 Å²	64.5	7%	0.071	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49	142	172.6	-25.4	33.1	0	0	0	111.7	D529 Y548 Y552	D529-P546 WeakPolarHBondContact O-CB 3.46Å; D529-P546 WeakPolarHBondContact O-CG 3.34Å; P546-Y548 PolarHBondContact O-N 2.87Å; P546-Y552 WeakPolarHBondContact O-CA 3.44Å
547	N	72	Confident	76.1	Confident	112 Å²	112	68.6 Å²	68.6	60%	0.599	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	6.8	174.7	-61.6	-36.1	0	0	0	117.8	H550 S551	N547-H550 HydrophobicContact CB-CB 4.43Å; N547-H550 WeakPolarHBondContact O-CA 3.27Å; N547-H550 VanDerWaalsContact O-CB 3.29Å; N547-H550 WeakPolarHBondContact O-CB 3.47Å; N547-H550 PolarHBondContact O-N 3.41Å; N547-S551 VanDerWaalsContact CB-O 3.31Å; N547-S551 WeakPolarHBondContact CB-O 2.88Å
548	Y	73.4	Confident	76.3	Confident	57 Å²	57	60.6 Å²	60.6	22%	0.224	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	129.4	179.4	-176.4	-86	0	0	0	111.9	S545 P546 D576 R632 K635	S545-Y548 WeakPolarHBondContact O-CB 3.09Å; S545-Y548 PolarHBondContact O-N 2.95Å; P546-Y548 PolarHBondContact O-N 2.87Å; Y548-D576 HydrophobicContact CE2-CB 4.35Å; Y548-D576 WeakPolarHBondContact OH-CB 3.34Å; Y548-D576 PolarHBondContact OH-OD2 3.12Å; Y548-R632 VanDerWaalsContact CD2-O 3.27Å; Y548-R632 WeakPolarHBondContact CD2-O 3.23Å; Y548-K635 HydrophobicContact CD1-CB 4.4Å; Y548-K635 HydrophobicContact CD1-CD 4.49Å; Y548-K635 HydrophobicContact CE1-CB 3.95Å; Y548-K635 HydrophobicContact CE1-CD 3.96Å; Y548-K635 HydrophobicContact CE2-CB 4.19Å
549	P	74.6	Confident	76.8	Confident	81 Å²	81	55.3 Å²	55.3	53%	0.526	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	cis	-93	8.7	14.1	37.5	-37.1	0	0	0	115.4
550	H	69.9	Low	77.4	Confident	146 Å²	146	51.8 Å²	51.8	68%	0.676	29%	0.288	S	S	*	.	S	Bend	trans	-79.3	171.5	170.9	-61.8	-76.4	0	0	0	110.7	N547 Y552	N547-H550 HydrophobicContact CB-CB 4.43Å; N547-H550 WeakPolarHBondContact O-CA 3.27Å; N547-H550 VanDerWaalsContact O-CB 3.29Å; N547-H550 WeakPolarHBondContact O-CB 3.47Å; N547-H550 PolarHBondContact O-N 3.41Å; H550-Y552 PolarHBondContact O-N 3.16Å
551	S	73.2	Confident	77.7	Confident	42 Å²	42	47 Å²	47	29%	0.294	26%	0.263	S	S	.	.			trans	-51.8	133.9	178.4	170.5	0	0	0	0	112.9	N547 G553 D630 G631	N547-S551 VanDerWaalsContact CB-O 3.31Å; N547-S551 WeakPolarHBondContact CB-O 2.88Å; S551-G553 PolarHBondContact O-N 2.97Å; S551-G553 PolarHBondContact OG-N 3.06Å; S551-D630 WeakPolarHBondContact CB-OD2 3.41Å; S551-D630 WeakPolarHBondContact OG-CB 3Å; S551-D630 PolarHBondContact OG-OD2 3.07Å; S551-G631 WeakPolarHBondContact CA-O 3.35Å
552	Y	72.1	Confident	78.1	Confident	4 Å²	4	45.9 Å²	45.9	2%	0.016	26%	0.255	C	S	.	.			trans	-76.8	-2.8	179.4	54.8	-101.3	0	0	0	114.4	P546 H550 V579 E580 D584 F623 T625 D630 G631	P546-Y552 WeakPolarHBondContact O-CA 3.44Å; H550-Y552 PolarHBondContact O-N 3.16Å; Y552-V579 HydrophobicContact CE1-CG2 4.48Å; Y552-E580 PolarHBondContact OH-N 3.19Å; Y552-D584 WeakPolarHBondContact CE2-OD2 3.26Å; Y552-D584 PolarHBondContact OH-OD2 3.32Å; Y552-F623 HydrophobicContact CD1-CZ 4.15Å; Y552-F623 AromaticContact CD2-CE1 3.87Å; Y552-F623 HydrophobicContact CD2-CE1 3.87Å; Y552-F623 AromaticContact CD2-CZ 3.59Å; Y552-F623 HydrophobicContact CD2-CZ 3.59Å; Y552-F623 HydrophobicContact CE1-CZ 4.24Å; Y552-F623 HydrophobicContact CE2-CE1 4.48Å; Y552-F623 AromaticContact CE2-CZ 3.77Å; Y552-F623 HydrophobicContact CE2-CZ 3.77Å; Y552-F623 AromaticContact CG-CE1 3.96Å; Y552-F623 HydrophobicContact CG-CE1 3.96Å; Y552-F623 AromaticContact CG-CZ 3.8Å; Y552-F623 HydrophobicContact CG-CZ 3.8Å; Y552-T625 HydrophobicContact CD2-CG2 3.57Å; Y552-T625 HydrophobicContact CE2-CG2 3.35Å; Y552-D630 HydrophobicContact CE2-CB 4.37Å; Y552-G631 WeakPolarHBondContact CD1-O 3.24Å; Y552-G631 VanDerWaalsContact CE1-C 3.5Å; Y552-G631 VanDerWaalsContact CE1-O 3.24Å; Y552-G631 WeakPolarHBondContact CE1-O 3.49Å; Y552-G631 VanDerWaalsContact CZ-N 3.27Å; Y552-G631 PolarHBondContact N-O 3.21Å; Y552-G631 PolarHBondContact OH-N 2.64Å
553	G	69.8	Low	78.2	Confident	27 Å²	27	43.1 Å²	43.1	28%	0.278	24%	0.237	S	C	.	.			trans	73.4	173.5	179.3	0	0	0	0	0	114.4	S551	S551-G553 PolarHBondContact O-N 2.97Å; S551-G553 PolarHBondContact OG-N 3.06Å
554	N	73.4	Confident	78.1	Confident	73 Å²	73	43.4 Å²	43.4	39%	0.39	24%	0.24	S	C	.	.	S	Bend	trans	-96.7	155.6	-178.2	-58.1	-33.9	0	0	0	111.1	A556 D626 S627 G629	N554-A556 PolarHBondContact O-N 2.97Å; N554-D626 CarbonylContact C-O 3.56Å; N554-D626 WeakPolarHBondContact CA-O 3.45Å; N554-D626 WeakPolarHBondContact CB-O 3.44Å; N554-S627 PolarHBondContact ND2-O 2.98Å; N554-G629 PolarHBondContact OD1-N 3.08Å
555	M	69.9	Low	77.9	Confident	151 Å²	151	46 Å²	46	74%	0.744	26%	0.258	S	S	*	.	S	Bend	trans	61.7	17.9	176.1	-55	170.2	73.6	0	0	115.4	T625 D626	M555-T625 PolarHBondContact N-OG1 2.79Å; M555-T625 VanDerWaalsContact N-OG1 3.08Å; M555-D626 PolarHBondContact N-O 2.81Å
556	A	70.9	Confident	77.4	Confident	20 Å²	20	50.7 Å²	50.7	17%	0.165	30%	0.297	C	S	.	.			trans	-65.1	137.2	169.9	0	0	0	0	0	111.8	N554 F624 T625	N554-A556 PolarHBondContact O-N 2.97Å; A556-F624 CarbonylContact O-C 3.56Å; A556-F624 WeakPolarHBondContact O-CA 2.99Å; A556-T625 WeakPolarHBondContact CA-OG1 3.33Å; A556-T625 HydrophobicContact CB-CG2 4.3Å; A556-T625 WeakPolarHBondContact CB-OG1 3.43Å; A556-T625 PolarHBondContact N-OG1 3.15Å; A556-T625 PolarHBondContact O-N 3.47Å; A556-T625 PolarHBondContact O-OG1 2.78Å
557	N	79.8	Confident	76.9	Confident	95 Å²	95	53 Å²	53	51%	0.508	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	87.2	173	172.5	35.6	0	0	0	109.3	R622 F623	N557-R622 PolarHBondContact ND2-NH2 3.17Å; N557-R622 VanDerWaalsContact ND2-NH2 3.18Å; N557-R622 PolarHBondContact OD1-NE 2.93Å; N557-R622 VanDerWaalsContact OD1-NE 3.13Å; N557-R622 PolarHBondContact OD1-NH2 3.01Å; N557-F623 CarbonylContact C-O 3.49Å; N557-F623 WeakPolarHBondContact CA-O 3.48Å
558	C	82.9	Confident	77.3	Confident	3 Å²	3	50.2 Å²	50.2	2%	0.02	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	146.4	-177	-71.9	0	0	0	0	112.2	C530 W560 R622 F623	C530-C558 HydrophobicContact CB-CB 3.72Å; C530-C558 WeakPolarHBondContact CB-SG 3.33Å; C530-C558 WeakPolarHBondContact SG-CA 3.21Å; C530-C558 WeakPolarHBondContact SG-CB 3.02Å; C530-C558 CovalentContact SG-SG 2.04Å; C530-C558 PolarHBondContact SG-SG 3.34Å; C558-W560 HydrophobicContact CB-CE3 4.42Å; C558-W560 HydrophobicContact CB-CH2 3.31Å; C558-W560 HydrophobicContact CB-CZ2 3.74Å; C558-W560 HydrophobicContact CB-CZ3 3.69Å; C558-R622 CarbonylContact O-C 3.49Å; C558-R622 WeakPolarHBondContact O-CA 3.36Å; C558-R622 WeakPolarHBondContact O-CG 3.27Å; C558-F623 HydrophobicContact CB-CB 4.27Å; C558-F623 PolarHBondContact N-O 2.9Å; C558-F623 PolarHBondContact O-N 3.19Å
559	L	85	Confident	77.6	Confident	42 Å²	42	49.3 Å²	49.3	22%	0.22	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	127.2	-180	-175.3	63.1	0	0	0	109.6	F534 M620 R622	F534-L559 HydrophobicContact CD2-CB 4.36Å; F534-L559 HydrophobicContact CD2-CG 4.46Å; F534-L559 WeakPolarHBondContact CD2-O 3.38Å; F534-L559 HydrophobicContact CE2-CB 3.95Å; F534-L559 HydrophobicContact CE2-CD2 3.64Å; F534-L559 HydrophobicContact CE2-CG 3.67Å; F534-L559 HydrophobicContact CZ-CD2 4.13Å; F534-L559 HydrophobicContact CZ-CG 4.41Å; L559-M620 HydrophobicContact CD1-CE 3.91Å; L559-M620 HydrophobicContact CD1-CG 3.58Å; L559-M620 HydrophobicContact CD1-SD 3.77Å; L559-M620 HydrophobicContact CD2-CE 4.12Å; L559-M620 HydrophobicContact CG-CE 4.42Å; L559-R622 HydrophobicContact CD1-CB 3.88Å; L559-R622 HydrophobicContact CD1-CG 4.05Å
560	W	86.8	Confident	78.1	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	135	173	-56	-90.3	0	0	0	109.5	C530 L536 F543 C558 M620 V621 F623 F634	C530-W560 HydrophobicContact CB-CZ2 3.94Å; C530-W560 WeakPolarHBondContact O-CZ2 3.4Å; C530-W560 PolarHBondContact O-NE1 2.85Å; C530-W560 VanDerWaalsContact O-NE1 3.08Å; L536-W560 HydrophobicContact CD1-CB 4.44Å; F543-W560 HydrophobicContact CD2-CB 4.41Å; F543-W560 AromaticContact CD2-CD1 3.82Å; F543-W560 AromaticContact CD2-CD2 3.68Å; F543-W560 HydrophobicContact CD2-CD2 3.68Å; F543-W560 AromaticContact CD2-CE2 3.74Å; F543-W560 HydrophobicContact CD2-CE3 4.28Å; F543-W560 AromaticContact CD2-CG 3.73Å; F543-W560 HydrophobicContact CD2-CG 3.73Å; F543-W560 HydrophobicContact CD2-CZ2 4.36Å; F543-W560 AromaticContact CD2-NE1 3.82Å; F543-W560 HydrophobicContact CE2-CB 4.3Å; F543-W560 AromaticContact CE2-CD2 3.81Å; F543-W560 HydrophobicContact CE2-CD2 3.81Å; F543-W560 AromaticContact CE2-CE3 4Å; F543-W560 HydrophobicContact CE2-CE3 4Å; F543-W560 AromaticContact CE2-CG 3.96Å; F543-W560 HydrophobicContact CE2-CG 3.96Å; F543-W560 HydrophobicContact CG-CG 4.41Å; C558-W560 HydrophobicContact CB-CE3 4.42Å; C558-W560 HydrophobicContact CB-CH2 3.31Å; C558-W560 HydrophobicContact CB-CZ2 3.74Å; C558-W560 HydrophobicContact CB-CZ3 3.69Å; W560-M620 WeakPolarHBondContact O-CA 3.21Å; W560-V621 HydrophobicContact CB-CB 4.47Å; W560-V621 HydrophobicContact CE3-CB 4.24Å; W560-V621 HydrophobicContact CE3-CG1 4.05Å; W560-V621 HydrophobicContact CZ3-CG1 4.45Å; W560-V621 PolarHBondContact N-O 3.22Å; W560-V621 PolarHBondContact O-N 2.98Å; W560-F623 HydrophobicContact CH2-CB 3.89Å; W560-F623 HydrophobicContact CH2-CD1 4.46Å; W560-F623 HydrophobicContact CZ3-CB 3.58Å; W560-F634 HydrophobicContact CE3-CZ 4.44Å; W560-F634 HydrophobicContact CH2-CE1 4.17Å; W560-F634 AromaticContact CH2-CZ 3.57Å; W560-F634 HydrophobicContact CH2-CZ 3.57Å; W560-F634 HydrophobicContact CZ2-CZ 4.41Å; W560-F634 HydrophobicContact CZ3-CE1 4.37Å; W560-F634 AromaticContact CZ3-CZ 3.61Å; W560-F634 HydrophobicContact CZ3-CZ 3.61Å
561	T	85.2	Confident	78.8	Confident	5 Å²	5	40.6 Å²	40.6	3%	0.031	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	117	175.1	-51.4	0	0	0	0	108.8	F534 D535 L536 H563 T592	F534-T561 PolarHBondContact O-N 3.34Å; D535-T561 WeakPolarHBondContact CA-O 3.44Å; L536-T561 PolarHBondContact N-O 2.92Å; T561-H563 WeakPolarHBondContact CG2-NE2 3.47Å; T561-T592 HydrophobicContact CG2-CG2 3.62Å
562	L	86.6	Confident	79.4	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	125.8	179.1	-48.1	-178.3	0	0	0	108.3	L536 F543 I570 L572 Q618 M619 V621 F638	L536-L562 HydrophobicContact CB-CD2 3.88Å; L536-L562 HydrophobicContact CD1-CD2 3.44Å; L536-L562 VanDerWaalsContact CD1-CD2 3.44Å; L536-L562 HydrophobicContact CG-CD2 4.29Å; F543-L562 HydrophobicContact CD1-CD2 4.45Å; F543-L562 HydrophobicContact CE1-CD1 4.45Å; F543-L562 HydrophobicContact CE1-CD2 4.03Å; L562-I570 HydrophobicContact CB-CD1 3.92Å; L562-I570 HydrophobicContact CB-CG2 4.31Å; L562-I570 HydrophobicContact CD1-CG2 4.05Å; L562-I570 VanDerWaalsContact O-CD1 3.26Å; L562-I570 WeakPolarHBondContact O-CD1 3.29Å; L562-L572 HydrophobicContact CD1-CD1 4.12Å; L562-Q618 CarbonylContact O-C 3.5Å; L562-Q618 VanDerWaalsContact O-CA 3.27Å; L562-Q618 WeakPolarHBondContact O-CA 3.37Å; L562-M619 HydrophobicContact CB-CB 4.21Å; L562-M619 WeakPolarHBondContact CB-O 3.33Å; L562-M619 HydrophobicContact CD1-CB 4.31Å; L562-M619 HydrophobicContact CD1-CG 4.24Å; L562-M619 HydrophobicContact CD1-SD 3.99Å; L562-M619 PolarHBondContact N-O 2.78Å; L562-M619 PolarHBondContact O-N 3.47Å; L562-V621 HydrophobicContact CD1-CG2 4.34Å; L562-F638 HydrophobicContact CB-CD2 4.41Å; L562-F638 HydrophobicContact CD1-CB 3.81Å; L562-F638 HydrophobicContact CD1-CD1 4.21Å; L562-F638 HydrophobicContact CD1-CD2 4.43Å; L562-F638 HydrophobicContact CD1-CG 3.9Å; L562-F638 HydrophobicContact CD2-CD1 3.63Å; L562-F638 HydrophobicContact CD2-CE1 3.71Å; L562-F638 HydrophobicContact CD2-CG 4.07Å; L562-F638 HydrophobicContact CD2-CZ 4.26Å; L562-F638 HydrophobicContact CG-CD1 4.43Å; L562-F638 HydrophobicContact CG-CG 4.4Å
563	H	84.4	Confident	80.1	Confident	12 Å²	12	42 Å²	42	6%	0.056	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	134.4	178.2	-61.9	-90.7	0	0	0	110.5	D535 L536 W537 T561 Q618	D535-H563 IonicContact OD1-CD2 3.25Å; D535-H563 IonicContact OD1-CE1 3.73Å; D535-H563 IonicContact OD1-NE2 3.63Å; D535-H563 PolarHBondContact OD1-NE2 2.97Å; L536-H563 PolarHBondContact O-N 2.99Å; W537-H563 HydrophobicContact CD2-CB 3.69Å; W537-H563 AromaticContact CD2-CG 3.95Å; W537-H563 AromaticContact CE2-CD2 3.61Å; W537-H563 AromaticContact CE2-CG 3.81Å; W537-H563 HydrophobicContact CE3-CB 3.46Å; W537-H563 VanDerWaalsContact CE3-CB 3.46Å; W537-H563 AromaticContact CE3-CG 3.99Å; W537-H563 HydrophobicContact CG-CB 4.31Å; W537-H563 HydrophobicContact CH2-CB 4.11Å; W537-H563 AromaticContact CH2-CG 3.78Å; W537-H563 AromaticContact CH2-ND1 3.71Å; W537-H563 HydrophobicContact CZ2-CB 4.31Å; W537-H563 AromaticContact CZ2-CD2 3.74Å; W537-H563 AromaticContact CZ2-CE1 3.94Å; W537-H563 AromaticContact CZ2-CG 3.74Å; W537-H563 AromaticContact CZ2-ND1 3.89Å; W537-H563 AromaticContact CZ2-NE2 3.86Å; W537-H563 HydrophobicContact CZ3-CB 3.69Å; W537-H563 AromaticContact CZ3-CG 3.91Å; W537-H563 AromaticContact NE1-CD2 3.86Å; T561-H563 WeakPolarHBondContact CG2-NE2 3.47Å; H563-Q618 PolarHBondContact CE1-NE2 3.47Å; H563-Q618 PolarHBondContact ND1-NE2 3.03Å; H563-Q618 VanDerWaalsContact ND1-NE2 3.12Å
564	A	82.7	Confident	80.8	Confident	8 Å²	8	41.7 Å²	41.7	7%	0.066	25%	0.251	C	S	.	.			trans	-116	159.7	168.4	0	0	0	0	0	110.6	Q568 I570 N617 C640	A564-Q568 HydrophobicContact CB-CB 4.01Å; A564-I570 HydrophobicContact CB-CD1 4.03Å; A564-I570 HydrophobicContact CB-CG1 3.58Å; A564-N617 HydrophobicContact CB-CB 4.47Å; A564-N617 PolarHBondContact N-O 3.2Å; A564-C640 HydrophobicContact CB-CB 3.9Å
565	S	81.2	Confident	81.4	Confident	76 Å²	76	42.7 Å²	42.7	53%	0.531	26%	0.256	S	S	.	.			trans	-61.9	148.8	175.9	-55.8	0	0	0	0	110.1	G567 Q568	S565-G567 PolarHBondContact O-N 2.87Å; S565-G567 VanDerWaalsContact O-N 3.11Å; S565-Q568 WeakPolarHBondContact O-CB 3.4Å; S565-Q568 PolarHBondContact O-N 2.78Å; S565-Q568 PolarHBondContact OG-OE1 3.41Å
566	A	74	Confident	82	Confident	99 Å²	99	38.4 Å²	38.4	82%	0.818	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.6	121.1	-179.8	0	0	0	0	0	111.1
567	G	67.6	Low	82.6	Confident	61 Å²	61	38 Å²	38	63%	0.629	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	92.2	2.4	-175.8	0	0	0	0	0	115.9	S565	S565-G567 PolarHBondContact O-N 2.87Å; S565-G567 VanDerWaalsContact O-N 3.11Å
568	Q	79.3	Confident	82.8	Confident	52 Å²	52	35.1 Å²	35.1	24%	0.243	22%	0.215	C	C	.	.			trans	-103.1	148	170.6	-66.2	-179.2	-18.7	0	0	111	A564 S565 N617 G641 V642	A564-Q568 HydrophobicContact CB-CB 4.01Å; S565-Q568 WeakPolarHBondContact O-CB 3.4Å; S565-Q568 PolarHBondContact O-N 2.78Å; S565-Q568 PolarHBondContact OG-OE1 3.41Å; Q568-N617 WeakPolarHBondContact O-CA 3.45Å; Q568-G641 CarbonylContact C-O 3.5Å; Q568-G641 WeakPolarHBondContact CA-O 3.43Å; Q568-V642 HydrophobicContact CG-CG2 3.77Å
569	N	80.7	Confident	82.9	Confident	39 Å²	39	35.1 Å²	35.1	21%	0.209	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	158.8	174.4	-69.4	16.6	0	0	0	109.8	S614 C640 G641	N569-S614 VanDerWaalsContact CB-O 3.28Å; N569-S614 WeakPolarHBondContact CB-O 3.24Å; N569-S614 VanDerWaalsContact CG-O 3.25Å; N569-S614 PolarHBondContact ND2-O 2.93Å; N569-S614 VanDerWaalsContact ND2-O 3.1Å; N569-C640 WeakPolarHBondContact O-CA 2.99Å; N569-G641 PolarHBondContact N-O 2.94Å; N569-G641 PolarHBondContact O-N 2.94Å; N569-G641 VanDerWaalsContact O-N 3.11Å
570	I	84	Confident	82.8	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	129.8	-179.3	-59.7	168.4	0	0	0	108.8	L562 A564 S614 M619 F638	L562-I570 HydrophobicContact CB-CD1 3.92Å; L562-I570 HydrophobicContact CB-CG2 4.31Å; L562-I570 HydrophobicContact CD1-CG2 4.05Å; L562-I570 VanDerWaalsContact O-CD1 3.26Å; L562-I570 WeakPolarHBondContact O-CD1 3.29Å; A564-I570 HydrophobicContact CB-CD1 4.03Å; A564-I570 HydrophobicContact CB-CG1 3.58Å; I570-S614 WeakPolarHBondContact O-CB 3.49Å; I570-S614 PolarHBondContact O-N 3.19Å; I570-M619 HydrophobicContact CB-CB 4.42Å; I570-M619 HydrophobicContact CD1-CB 3.93Å; I570-M619 HydrophobicContact CG2-CB 4.33Å; I570-M619 HydrophobicContact CG2-SD 4.11Å; I570-F638 HydrophobicContact CG2-CB 4.17Å; I570-F638 HydrophobicContact CG2-CD2 4.09Å
571	Q	84.9	Confident	82.3	Confident	43 Å²	43	37.2 Å²	37.2	20%	0.201	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	125.9	168.4	171.6	-178.5	-2.9	0	0	108.4	D611 L612 F613 F638 T639 L644	Q571-D611 HydrophobicContact CG-CB 4.19Å; Q571-D611 PolarHBondContact NE2-OD2 2.89Å; Q571-L612 CarbonylContact C-O 3.58Å; Q571-L612 WeakPolarHBondContact CA-O 3.24Å; Q571-F613 HydrophobicContact CB-CD1 3.81Å; Q571-F613 HydrophobicContact CB-CE1 3.78Å; Q571-F613 VanDerWaalsContact CD-CE1 3.49Å; Q571-F613 HydrophobicContact CG-CD1 3.94Å; Q571-F613 HydrophobicContact CG-CE1 3.48Å; Q571-F613 VanDerWaalsContact CG-CE1 3.48Å; Q571-F613 HydrophobicContact CG-CZ 4.16Å; Q571-F638 CarbonylContact O-C 3.52Å; Q571-F638 WeakPolarHBondContact O-CA 2.98Å; Q571-F638 WeakPolarHBondContact O-CB 3.09Å; Q571-T639 PolarHBondContact N-O 2.93Å; Q571-T639 PolarHBondContact O-N 3.44Å; Q571-L644 HydrophobicContact CB-CD1 4.47Å
572	L	86	Confident	81.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	124.3	176.8	179.4	67.2	0	0	0	110	F543 L562 F574 V588 L612 M619 V621 A636 F638	F543-L572 HydrophobicContact CE1-CD1 3.82Å; F543-L572 HydrophobicContact CZ-CD1 3.88Å; L562-L572 HydrophobicContact CD1-CD1 4.12Å; L572-F574 HydrophobicContact CD2-CE2 3.78Å; L572-F574 HydrophobicContact CD2-CZ 4.06Å; L572-F574 HydrophobicContact CG-CE2 4.05Å; L572-V588 HydrophobicContact CD2-CG1 3.99Å; L572-V588 HydrophobicContact CD2-CG2 4.11Å; L572-L612 HydrophobicContact CB-CB 4.36Å; L572-L612 HydrophobicContact CD2-CD1 4.46Å; L572-L612 PolarHBondContact N-O 3.3Å; L572-L612 PolarHBondContact O-N 3.38Å; L572-M619 HydrophobicContact CB-CE 4.41Å; L572-M619 HydrophobicContact CB-SD 3.73Å; L572-M619 HydrophobicContact CD2-SD 3.99Å; L572-M619 HydrophobicContact CG-SD 4.45Å; L572-V621 HydrophobicContact CD2-CG2 3.7Å; L572-A636 HydrophobicContact CD1-CB 3.97Å; L572-F638 HydrophobicContact CD1-CB 4.12Å
573	H	86.6	Confident	80.8	Confident	75 Å²	75	43 Å²	43	35%	0.347	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	126.4	-179.9	179.1	70.4	0	0	0	110.3	D611 A636 N637	H573-D611 IonicContact CE1-OD1 2.65Å; H573-D611 IonicContact CG-OD1 3.54Å; H573-D611 IonicContact ND1-OD1 3.08Å; H573-D611 PolarHBondContact ND1-OD1 2.85Å; H573-D611 IonicContact ND1-OD2 2.77Å; H573-A636 CarbonylContact O-C 3.59Å; H573-A636 WeakPolarHBondContact O-CA 3.32Å; H573-N637 PolarHBondContact N-O 3.45Å; H573-N637 PolarHBondContact O-N 3.42Å; H573-N637 VanDerWaalsContact O-O 3.13Å
574	F	85.6	Confident	80.7	Confident	21 Å²	21	42.5 Å²	42.5	9%	0.092	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	117.9	174.8	-72.4	-94.2	0	0	0	109.5	L572 F577 V586 V588 L602 P608 L612 F634 A636	L572-F574 HydrophobicContact CD2-CE2 3.78Å; L572-F574 HydrophobicContact CD2-CZ 4.06Å; L572-F574 HydrophobicContact CG-CE2 4.05Å; F574-F577 AromaticContact CD1-CD2 3.62Å; F574-F577 HydrophobicContact CD1-CD2 3.62Å; F574-F577 HydrophobicContact CD1-CE2 4.16Å; F574-F577 AromaticContact CE1-CD2 3.93Å; F574-F577 HydrophobicContact CE1-CD2 3.93Å; F574-F577 AromaticContact CE1-CE2 3.99Å; F574-F577 HydrophobicContact CE1-CE2 3.99Å; F574-F577 HydrophobicContact CG-CD2 4.27Å; F574-V586 HydrophobicContact CE1-CG1 4.4Å; F574-V586 HydrophobicContact CZ-CG1 4.14Å; F574-V588 HydrophobicContact CZ-CG2 4.45Å; F574-L602 HydrophobicContact CD2-CD1 4.18Å; F574-L602 HydrophobicContact CE1-CD1 4.42Å; F574-L602 HydrophobicContact CE2-CD1 3.51Å; F574-L602 HydrophobicContact CZ-CD1 3.65Å; F574-P608 HydrophobicContact CB-CG 4.11Å; F574-P608 HydrophobicContact CD2-CG 3.34Å; F574-P608 HydrophobicContact CE2-CG 3.99Å; F574-P608 HydrophobicContact CG-CG 3.96Å; F574-L612 HydrophobicContact CE2-CD1 4.31Å; F574-F634 HydrophobicContact CD1-CB 4.36Å; F574-F634 AromaticContact CD1-CD2 3.93Å; F574-F634 HydrophobicContact CD1-CD2 3.93Å; F574-F634 HydrophobicContact CD1-CG 4.39Å; F574-F634 AromaticContact CE1-CD2 3.63Å; F574-F634 HydrophobicContact CE1-CD2 3.63Å; F574-F634 AromaticContact CE1-CE2 4Å; F574-F634 HydrophobicContact CE1-CE2 4Å; F574-F634 HydrophobicContact CE1-CG 4.18Å; F574-A636 HydrophobicContact CD1-CB 3.91Å; F574-A636 HydrophobicContact CE1-CB 4.07Å; F574-A636 HydrophobicContact CG-CB 4.38Å
575	L	84.4	Confident	80.8	Confident	95 Å²	95	42.9 Å²	42.9	50%	0.497	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	-39.7	179.2	-67.1	166	0	0	0	111.6	T542 K635 N637	T542-L575 HydrophobicContact CG2-CD1 4.39Å; L575-K635 WeakPolarHBondContact CB-O 3.49Å; L575-K635 HydrophobicContact CD1-CD 4.42Å; L575-K635 HydrophobicContact CD1-CG 4.24Å; L575-K635 PolarHBondContact N-O 2.81Å; L575-N637 HydrophobicContact CD1-CB 4.19Å; L575-N637 HydrophobicContact CG-CB 4.47Å
576	D	82.6	Confident	81.1	Confident	61 Å²	61	39.3 Å²	39.3	33%	0.326	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	145.5	175.1	-158.1	-6.3	0	0	0	108.8	Y548 F634 K635	Y548-D576 HydrophobicContact CE2-CB 4.35Å; Y548-D576 WeakPolarHBondContact OH-CB 3.34Å; Y548-D576 PolarHBondContact OH-OD2 3.12Å; D576-F634 VanDerWaalsContact O-CA 3.28Å; D576-F634 WeakPolarHBondContact O-CA 3.09Å; D576-F634 WeakPolarHBondContact O-CB 3.38Å; D576-K635 PolarHBondContact N-O 3.1Å; D576-K635 PolarHBondContact O-N 3.14Å
577	F	85.4	Confident	81.7	Confident	11 Å²	11	35.4 Å²	35.4	5%	0.048	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	111.5	-174.3	-165.1	-88.5	0	0	0	111.1	F574 V579 V586 L602 G604 S605 F634	F574-F577 AromaticContact CD1-CD2 3.62Å; F574-F577 HydrophobicContact CD1-CD2 3.62Å; F574-F577 HydrophobicContact CD1-CE2 4.16Å; F574-F577 AromaticContact CE1-CD2 3.93Å; F574-F577 HydrophobicContact CE1-CD2 3.93Å; F574-F577 AromaticContact CE1-CE2 3.99Å; F574-F577 HydrophobicContact CE1-CE2 3.99Å; F574-F577 HydrophobicContact CG-CD2 4.27Å; F577-V579 HydrophobicContact CE1-CB 4.15Å; F577-V579 HydrophobicContact CE1-CG2 4.17Å; F577-V579 HydrophobicContact CE2-CG2 4.27Å; F577-V579 HydrophobicContact CZ-CB 4.23Å; F577-V579 HydrophobicContact CZ-CG2 3.94Å; F577-V586 HydrophobicContact CE2-CB 4.21Å; F577-V586 HydrophobicContact CE2-CG2 3.86Å; F577-V586 HydrophobicContact CZ-CB 4.37Å; F577-V586 HydrophobicContact CZ-CG2 4.08Å; F577-L602 HydrophobicContact CE1-CB 4.25Å; F577-L602 HydrophobicContact CE2-CB 4.02Å; F577-L602 HydrophobicContact CE2-CD1 4.3Å; F577-L602 HydrophobicContact CZ-CB 3.53Å; F577-G604 WeakPolarHBondContact CD1-O 3.36Å; F577-G604 WeakPolarHBondContact CE1-O 3.38Å; F577-S605 CarbonylContact O-C 3.6Å; F577-F634 HydrophobicContact CD2-CB 3.64Å; F577-F634 HydrophobicContact CD2-CG 4.29Å; F577-F634 HydrophobicContact CE2-CB 4.19Å; F577-F634 HydrophobicContact CE2-CG 4.44Å; F577-F634 HydrophobicContact CG-CB 4.36Å
578	D	83.1	Confident	82.7	Confident	34 Å²	34	32.5 Å²	32.5	18%	0.182	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	84.5	-178.3	-170	27.4	0	0	0	110.3	G631 R632 G633	D578-G631 CarbonylContact O-C 3.56Å; D578-R632 HydrophobicContact CB-CB 4.2Å; D578-R632 PolarHBondContact O-N 3.19Å; D578-R632 WeakPolarHBondContact OD2-CB 3.38Å; D578-R632 WeakPolarHBondContact OD2-CG 3.46Å; D578-R632 IonicContact OD2-CZ 3.76Å; D578-R632 PolarHBondContact OD2-N 2.85Å; D578-R632 IonicContact OD2-NE 3.21Å; D578-R632 PolarHBondContact OD2-NE 3.02Å; D578-R632 IonicContact OD2-NH2 3.97Å; D578-R632 PolarHBondContact OD2-NH2 2.83Å; D578-G633 CarbonylContact C-O 3.52Å; D578-G633 WeakPolarHBondContact CA-O 3.47Å; D578-G633 PolarHBondContact N-O 3.5Å; D578-G633 WeakPolarHBondContact O-CA 3.31Å; D578-G633 PolarHBondContact O-N 2.95Å
579	V	84.8	Confident	83	Confident	3 Å²	3	30.3 Å²	30.3	2%	0.018	15%	0.15	C	C	.	.			trans	-118.1	150.5	-177.9	175.7	0	0	0	0	108.6	Y552 F577 A581 D584 V586 G604 F623 F634	Y552-V579 HydrophobicContact CE1-CG2 4.48Å; F577-V579 HydrophobicContact CE1-CB 4.15Å; F577-V579 HydrophobicContact CE1-CG2 4.17Å; F577-V579 HydrophobicContact CE2-CG2 4.27Å; F577-V579 HydrophobicContact CZ-CB 4.23Å; F577-V579 HydrophobicContact CZ-CG2 3.94Å; V579-A581 PolarHBondContact O-N 3.37Å; V579-D584 HydrophobicContact CG1-CB 3.33Å; V579-V586 HydrophobicContact CG2-CG2 4.48Å; V579-G604 PolarHBondContact N-O 3.01Å; V579-G604 VanDerWaalsContact N-O 3.15Å; V579-G604 CarbonylContact O-C 3.5Å; V579-G604 WeakPolarHBondContact O-CA 3.45Å; V579-G604 PolarHBondContact O-N 2.73Å; V579-G604 VanDerWaalsContact O-O 3.13Å; V579-F623 HydrophobicContact CG1-CE2 3.83Å; V579-F623 HydrophobicContact CG1-CZ 4.5Å; V579-F623 HydrophobicContact CG2-CE2 4.09Å; V579-F623 HydrophobicContact CG2-CZ 4.5Å; V579-F634 HydrophobicContact CG2-CD1 4.31Å
580	E	82.1	Confident	83.2	Confident	55 Å²	55	29 Å²	29	26%	0.257	14%	0.143	S	C	.	.			trans	-55	136.9	177.2	-158	-161.7	-178.9	0	0	111.2	Y552 T582 Y583 D584 T603 G604	Y552-E580 PolarHBondContact OH-N 3.19Å; E580-T582 PolarHBondContact O-N 2.5Å; E580-Y583 WeakPolarHBondContact OE2-CB 3.16Å; E580-D584 HydrophobicContact CB-CB 3.94Å; E580-T603 PolarHBondContact O-OG1 2.93Å; E580-G604 PolarHBondContact O-N 3.26Å
581	A	76.6	Confident	83.1	Confident	32 Å²	32	29.6 Å²	29.6	26%	0.264	15%	0.148	S	C	.	.	S	Bend	trans	-71.1	131	177.1	0	0	0	0	0	110.3	V579 Y583 T603 H851	V579-A581 PolarHBondContact O-N 3.37Å; A581-Y583 VanDerWaalsContact C-N 3.29Å; A581-Y583 WeakPolarHBondContact O-CD2 3.18Å; A581-Y583 PolarHBondContact O-N 2.99Å; A581-T603 WeakPolarHBondContact CA-OG1 3.44Å; A581-H851 WeakPolarHBondContact CB-NE2 3.21Å
582	T	68.3	Low	82.5	Confident	6 Å²	6	31.2 Å²	31.2	4%	0.037	16%	0.162	C	C	.	.	S	Bend	trans	72.5	-16.1	170.5	60.8	0	0	0	0	119.7	E580 M585 T603 W822 K848	E580-T582 PolarHBondContact O-N 2.5Å; T582-M585 VanDerWaalsContact O-CE 3.23Å; T582-M585 WeakPolarHBondContact O-CE 3.35Å; T582-T603 PolarHBondContact N-OG1 3.04Å; T582-W822 HydrophobicContact CG2-CH2 3.84Å; T582-W822 HydrophobicContact CG2-CZ2 3.6Å; T582-K848 HydrophobicContact CG2-CG 4.11Å
583	Y	73.1	Confident	81.6	Confident	121 Å²	121	32.4 Å²	32.4	48%	0.475	17%	0.174	S	C	.	.	S	Bend	trans	-110.7	-45.7	179.7	-58.9	-72.7	0	0	0	111.3	E580 A581 D626	E580-Y583 WeakPolarHBondContact OE2-CB 3.16Å; A581-Y583 VanDerWaalsContact C-N 3.29Å; A581-Y583 WeakPolarHBondContact O-CD2 3.18Å; A581-Y583 PolarHBondContact O-N 2.99Å; Y583-D626 WeakPolarHBondContact CB-OD2 3.5Å
584	D	82	Confident	80.5	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.175	C	C	.	.	S	Bend	trans	-91	134.6	173.8	-64.3	-14.2	0	0	0	112.1	Y552 V579 E580 T603 T625 D626 G629	Y552-D584 WeakPolarHBondContact CE2-OD2 3.26Å; Y552-D584 PolarHBondContact OH-OD2 3.32Å; V579-D584 HydrophobicContact CG1-CB 3.33Å; E580-D584 HydrophobicContact CB-CB 3.94Å; D584-T603 WeakPolarHBondContact O-CB 3.44Å; D584-T603 PolarHBondContact O-OG1 2.9Å; D584-T625 HydrophobicContact CB-CG2 4.2Å; D584-T625 WeakPolarHBondContact OD1-CA 3.37Å; D584-T625 VanDerWaalsContact OD1-CB 3.29Å; D584-T625 WeakPolarHBondContact OD1-CB 3.23Å; D584-D626 PolarHBondContact OD1-N 3.17Å; D584-G629 VanDerWaalsContact OD2-O 3.1Å
585	M	84	Confident	79.7	Confident	17 Å²	17	36.5 Å²	36.5	8%	0.084	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	144.5	-173.4	-36.8	177.4	-172.4	0	0	113.5	T582 V601 L602 F623 F624 Y846 G847	T582-M585 VanDerWaalsContact O-CE 3.23Å; T582-M585 WeakPolarHBondContact O-CE 3.35Å; M585-V601 HydrophobicContact CB-CG1 4.32Å; M585-V601 HydrophobicContact SD-CG1 4.25Å; M585-L602 WeakPolarHBondContact CA-O 3.38Å; M585-F623 WeakPolarHBondContact O-CD2 3.03Å; M585-F624 HydrophobicContact CB-CD2 4.5Å; M585-F624 HydrophobicContact CB-CE1 3.9Å; M585-F624 HydrophobicContact CB-CE2 3.71Å; M585-F624 HydrophobicContact CB-CZ 3.38Å; M585-F624 HydrophobicContact CE-CE2 4.35Å; M585-F624 HydrophobicContact CG-CE2 3.58Å; M585-F624 HydrophobicContact CG-CZ 3.61Å; M585-F624 PolarHBondContact N-O 3.15Å; M585-F624 PolarHBondContact O-N 3.28Å; M585-F624 HydrophobicContact SD-CE2 3.72Å; M585-F624 HydrophobicContact SD-CZ 3.48Å; M585-F624 WeakPolarHBondContact SD-CZ 3.29Å; M585-Y846 HydrophobicContact SD-CD1 3.84Å; M585-Y846 HydrophobicContact SD-CE1 3.76Å; M585-G847 WeakPolarHBondContact SD-CA 3.4Å
586	V	87.8	Confident	79.4	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	119.5	169.9	-179.1	0	0	0	0	108.8	F574 F577 V579 V588 V601 L602 V621 R622 F623 F634	F574-V586 HydrophobicContact CE1-CG1 4.4Å; F574-V586 HydrophobicContact CZ-CG1 4.14Å; F577-V586 HydrophobicContact CE2-CB 4.21Å; F577-V586 HydrophobicContact CE2-CG2 3.86Å; F577-V586 HydrophobicContact CZ-CB 4.37Å; F577-V586 HydrophobicContact CZ-CG2 4.08Å; V579-V586 HydrophobicContact CG2-CG2 4.48Å; V586-V588 HydrophobicContact CG1-CG2 4.42Å; V586-V601 WeakPolarHBondContact O-CA 3.44Å; V586-L602 HydrophobicContact CB-CB 4.28Å; V586-L602 PolarHBondContact N-O 3.47Å; V586-L602 PolarHBondContact O-N 2.81Å; V586-V621 HydrophobicContact CG1-CG1 3.78Å; V586-R622 CarbonylContact C-O 3.59Å; V586-R622 WeakPolarHBondContact CA-O 3.43Å; V586-F623 HydrophobicContact CG2-CB 4.32Å; V586-F623 HydrophobicContact CG2-CD2 3.46Å; V586-F623 VanDerWaalsContact CG2-CD2 3.46Å; V586-F623 HydrophobicContact CG2-CE2 4.1Å; V586-F623 HydrophobicContact CG2-CG 4.21Å; V586-F634 HydrophobicContact CG2-CD1 3.8Å; V586-F634 HydrophobicContact CG2-CE1 3.58Å; V586-F634 HydrophobicContact CG2-CZ 4.29Å
587	E	86.8	Confident	79.2	Confident	18 Å²	18	32.6 Å²	32.6	8%	0.084	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	126.8	-179.8	-173.6	179.1	162	0	0	109.9	R589 L598 V621 R622 Y846	E587-R589 HydrophobicContact CG-CG 4.43Å; E587-R589 IonicContact OE1-CZ 2.68Å; E587-R589 IonicContact OE1-NE 3.19Å; E587-R589 PolarHBondContact OE1-NE 2.64Å; E587-R589 IonicContact OE1-NH2 2.85Å; E587-R589 PolarHBondContact OE1-NH2 3.43Å; E587-L598 HydrophobicContact CG-CD1 3.59Å; E587-V621 CarbonylContact O-C 3.11Å; E587-V621 WeakPolarHBondContact O-CA 3.49Å; E587-R622 HydrophobicContact CB-CB 4.39Å; E587-R622 PolarHBondContact N-O 3.5Å; E587-R622 PolarHBondContact O-N 2.84Å; E587-Y846 PolarHBondContact OE2-OH 2.8Å
588	V	88.2	Confident	79	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	124.7	179.8	-174.5	0	0	0	0	109.6	L572 F574 V586 L599 A600 L612 M619 M620 V621	L572-V588 HydrophobicContact CD2-CG1 3.99Å; L572-V588 HydrophobicContact CD2-CG2 4.11Å; F574-V588 HydrophobicContact CZ-CG2 4.45Å; V586-V588 HydrophobicContact CG1-CG2 4.42Å; V588-L599 HydrophobicContact CG1-CB 4.46Å; V588-L599 HydrophobicContact CG1-CD1 4.25Å; V588-L599 PolarHBondContact O-N 3.34Å; V588-A600 PolarHBondContact N-O 3.1Å; V588-A600 PolarHBondContact O-N 3.44Å; V588-L612 HydrophobicContact CB-CD1 3.99Å; V588-L612 HydrophobicContact CG1-CD1 3.95Å; V588-L612 HydrophobicContact CG2-CD1 3.85Å; V588-M619 HydrophobicContact CG1-CE 4Å; V588-M619 HydrophobicContact CG1-CG 4.09Å; V588-M619 HydrophobicContact CG1-SD 3.99Å; V588-M620 CarbonylContact C-O 3.58Å; V588-M620 WeakPolarHBondContact CA-O 3.34Å; V588-V621 HydrophobicContact CG1-CG2 4.35Å; V588-V621 HydrophobicContact CG2-CG1 4.39Å; V588-V621 HydrophobicContact CG2-CG2 4.38Å
589	R	87.1	Confident	78.9	Confident	6 Å²	6	34.1 Å²	34.1	2%	0.023	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	146.6	179	-57.3	-171.4	170	-97.6	-7.6	112.7	E587 S594 S596 T597 L598 M619 M620 Y886	E587-R589 HydrophobicContact CG-CG 4.43Å; E587-R589 IonicContact OE1-CZ 2.68Å; E587-R589 IonicContact OE1-NE 3.19Å; E587-R589 PolarHBondContact OE1-NE 2.64Å; E587-R589 IonicContact OE1-NH2 2.85Å; E587-R589 PolarHBondContact OE1-NH2 3.43Å; R589-S594 PolarHBondContact NH1-O 3.27Å; R589-S596 WeakPolarHBondContact CB-OG 3.39Å; R589-S596 VanDerWaalsContact CD-OG 3.31Å; R589-S596 WeakPolarHBondContact CD-OG 3.32Å; R589-S596 PolarHBondContact NH1-O 3.32Å; R589-T597 CarbonylContact C-O 3.16Å; R589-T597 WeakPolarHBondContact CA-O 3.49Å; R589-T597 WeakPolarHBondContact CB-O 3.45Å; R589-L598 HydrophobicContact CG-CD1 4.2Å; R589-M619 CarbonylContact O-C 3.48Å; R589-M619 WeakPolarHBondContact O-CA 3.38Å; R589-M619 WeakPolarHBondContact O-CG 3.15Å; R589-M620 HydrophobicContact CB-CB 4.46Å; R589-M620 PolarHBondContact N-O 2.9Å; R589-M620 PolarHBondContact O-N 3.36Å; R589-Y886 PolarHBondContact NH1-O 3.41Å; R589-Y886 PolarHBondContact NH2-O 2.81Å
590	D	83.9	Confident	78.6	Confident	11 Å²	11	34.8 Å²	34.8	6%	0.059	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	95.4	176.3	-174.9	-3.4	0	0	0	109.9	S596 T597 L599 S614 T615 S616	D590-S596 WeakPolarHBondContact O-CB 3.34Å; D590-T597 WeakPolarHBondContact CB-OG1 3.33Å; D590-T597 PolarHBondContact N-O 2.98Å; D590-T597 PolarHBondContact O-N 3.08Å; D590-L599 HydrophobicContact CB-CD1 3.78Å; D590-L599 HydrophobicContact CB-CD2 3.96Å; D590-L599 HydrophobicContact CB-CG 3.82Å; D590-S614 PolarHBondContact OD1-OG 3.14Å; D590-T615 VanDerWaalsContact CG-N 3.35Å; D590-T615 PolarHBondContact OD1-N 3.01Å; D590-T615 WeakPolarHBondContact OD2-CA 3.26Å; D590-T615 VanDerWaalsContact OD2-CB 3.3Å; D590-T615 WeakPolarHBondContact OD2-CB 3.36Å; D590-T615 PolarHBondContact OD2-N 3.46Å; D590-T615 PolarHBondContact OD2-OG1 3.02Å; D590-S616 VanDerWaalsContact OD1-CB 3.24Å; D590-S616 WeakPolarHBondContact OD1-CB 3.17Å; D590-S616 PolarHBondContact OD1-N 2.96Å; D590-S616 PolarHBondContact OD1-OG 2.84Å
591	G	81.4	Confident	78.6	Confident	12 Å²	12	32.5 Å²	32.5	12%	0.124	19%	0.19	C	C	.	.	S	Bend	trans	129.4	178.1	-176.6	0	0	0	0	0	113.9	Q618 M620	G591-Q618 WeakPolarHBondContact CA-O 3.36Å; G591-Q618 PolarHBondContact N-O 2.98Å; G591-M620 WeakPolarHBondContact O-CB 3.48Å
592	T	72.3	Confident	79	Confident	78 Å²	78	31.5 Å²	31.5	48%	0.479	18%	0.18	S	C	.	.	S	Bend	trans	-96.5	119.3	174.5	38.4	0	0	0	0	111.4	T561 Q618	T561-T592 HydrophobicContact CG2-CG2 3.62Å; T592-Q618 HydrophobicContact CG2-CB 4.06Å; T592-Q618 HydrophobicContact CG2-CG 4.3Å; T592-Q618 PolarHBondContact OG1-OE1 3.41Å
593	G	67.8	Low	79.7	Confident	25 Å²	25	31.4 Å²	31.4	26%	0.258	18%	0.18	S	C	.	.	S	Bend	trans	109.2	170	172.1	0	0	0	0	0	114.8	N595 S596 M620	G593-N595 VanDerWaalsContact C-N 3.28Å; G593-N595 PolarHBondContact O-N 2.87Å; G593-S596 WeakPolarHBondContact O-CB 3.4Å; G593-S596 PolarHBondContact O-N 3.23Å; G593-S596 PolarHBondContact O-OG 2.73Å; G593-M620 VanDerWaalsContact N-CE 3.33Å
594	S	63.9	Low	80.1	Confident	54 Å²	54	25.8 Å²	25.8	38%	0.378	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-15	-172.9	53.4	0	0	0	0	114.9	R589 N887	R589-S594 PolarHBondContact NH1-O 3.27Å; S594-N887 PolarHBondContact O-ND2 3.35Å
595	N	68.1	Low	79.6	Confident	128 Å²	128	30.2 Å²	30.2	68%	0.684	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.3	0.8	176.6	-68.6	-17.3	0	0	0	113.5	G593 N887	G593-N595 VanDerWaalsContact C-N 3.28Å; G593-N595 PolarHBondContact O-N 2.87Å; N595-N887 PolarHBondContact OD1-ND2 3.41Å
596	S	77.4	Confident	78.7	Confident	15 Å²	15	32.9 Å²	32.9	11%	0.105	22%	0.215	C	C	.	.	S	Bend	trans	-73	158.9	177.5	60.8	0	0	0	0	111.6	R589 D590 G593 L598	R589-S596 WeakPolarHBondContact CB-OG 3.39Å; R589-S596 VanDerWaalsContact CD-OG 3.31Å; R589-S596 WeakPolarHBondContact CD-OG 3.32Å; R589-S596 PolarHBondContact NH1-O 3.32Å; D590-S596 WeakPolarHBondContact O-CB 3.34Å; G593-S596 WeakPolarHBondContact O-CB 3.4Å; G593-S596 PolarHBondContact O-N 3.23Å; G593-S596 PolarHBondContact O-OG 2.73Å; S596-L598 PolarHBondContact O-N 3.09Å
597	T	79.8	Confident	77.4	Confident	58 Å²	58	34.4 Å²	34.4	36%	0.356	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	130.8	-171	66.9	0	0	0	0	111.6	R589 D590 L599	R589-T597 CarbonylContact C-O 3.16Å; R589-T597 WeakPolarHBondContact CA-O 3.49Å; R589-T597 WeakPolarHBondContact CB-O 3.45Å; D590-T597 WeakPolarHBondContact CB-OG1 3.33Å; D590-T597 PolarHBondContact N-O 2.98Å; D590-T597 PolarHBondContact O-N 3.08Å; T597-L599 PolarHBondContact O-N 3.34Å
598	L	80.6	Confident	76.5	Confident	15 Å²	15	35.3 Å²	35.3	8%	0.079	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	116.5	179.7	-176.1	68	0	0	0	109.7	E587 R589 S596 V601 Y846 R884	E587-L598 HydrophobicContact CG-CD1 3.59Å; R589-L598 HydrophobicContact CG-CD1 4.2Å; S596-L598 PolarHBondContact O-N 3.09Å; L598-V601 HydrophobicContact CD1-CG2 3.96Å; L598-V601 HydrophobicContact CD2-CG2 3.88Å; L598-V601 HydrophobicContact CG-CG2 4.29Å; L598-Y846 HydrophobicContact CD2-CE2 4.33Å; L598-R884 VanDerWaalsContact CB-O 3.3Å; L598-R884 WeakPolarHBondContact CB-O 3.18Å; L598-R884 PolarHBondContact N-O 3.42Å
599	L	81	Confident	75.1	Confident	63 Å²	63	39.6 Å²	39.6	33%	0.33	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-47	177.2	-65.4	174.3	0	0	0	111.3	V588 D590 T597 M619	V588-L599 HydrophobicContact CG1-CB 4.46Å; V588-L599 HydrophobicContact CG1-CD1 4.25Å; V588-L599 PolarHBondContact O-N 3.34Å; D590-L599 HydrophobicContact CB-CD1 3.78Å; D590-L599 HydrophobicContact CB-CD2 3.96Å; D590-L599 HydrophobicContact CB-CG 3.82Å; T597-L599 PolarHBondContact O-N 3.34Å; L599-M619 HydrophobicContact CD1-CE 3.32Å
600	A	78.6	Confident	74.2	Confident	16 Å²	16	46.7 Å²	46.7	13%	0.132	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	153	-177.4	0	0	0	0	0	112.5	V588 L602 L612	V588-A600 PolarHBondContact N-O 3.1Å; V588-A600 PolarHBondContact O-N 3.44Å; A600-L602 HydrophobicContact CB-CD2 4.18Å; A600-L602 HydrophobicContact CB-CG 4.3Å; A600-L612 HydrophobicContact CB-CD1 3.83Å; A600-L612 HydrophobicContact CB-CD2 4Å
601	V	82.4	Confident	73.9	Confident	8 Å²	8	48.8 Å²	48.8	5%	0.048	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	118.2	166.7	-176.9	0	0	0	0	106	M585 V586 L598 Y846 L850	M585-V601 HydrophobicContact CB-CG1 4.32Å; M585-V601 HydrophobicContact SD-CG1 4.25Å; V586-V601 WeakPolarHBondContact O-CA 3.44Å; L598-V601 HydrophobicContact CD1-CG2 3.96Å; L598-V601 HydrophobicContact CD2-CG2 3.88Å; L598-V601 HydrophobicContact CG-CG2 4.29Å; V601-Y846 HydrophobicContact CB-CE2 4.47Å; V601-Y846 HydrophobicContact CG1-CE1 4.27Å; V601-Y846 HydrophobicContact CG1-CE2 4.29Å; V601-Y846 HydrophobicContact CG2-CD2 4.16Å; V601-Y846 HydrophobicContact CG2-CE2 3.44Å; V601-Y846 VanDerWaalsContact CG2-CE2 3.44Å; V601-L850 WeakPolarHBondContact O-CD1 3.48Å
602	L	84.4	Confident	73.9	Confident	11 Å²	11	49.5 Å²	49.5	6%	0.058	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	140.4	-171.8	-53.3	170.3	0	0	0	109.7	F574 F577 M585 V586 A600 P608	F574-L602 HydrophobicContact CD2-CD1 4.18Å; F574-L602 HydrophobicContact CE1-CD1 4.42Å; F574-L602 HydrophobicContact CE2-CD1 3.51Å; F574-L602 HydrophobicContact CZ-CD1 3.65Å; F577-L602 HydrophobicContact CE1-CB 4.25Å; F577-L602 HydrophobicContact CE2-CB 4.02Å; F577-L602 HydrophobicContact CE2-CD1 4.3Å; F577-L602 HydrophobicContact CZ-CB 3.53Å; M585-L602 WeakPolarHBondContact CA-O 3.38Å; V586-L602 HydrophobicContact CB-CB 4.28Å; V586-L602 PolarHBondContact N-O 3.47Å; V586-L602 PolarHBondContact O-N 2.81Å; A600-L602 HydrophobicContact CB-CD2 4.18Å; A600-L602 HydrophobicContact CB-CG 4.3Å; L602-P608 HydrophobicContact CD1-CB 4.31Å; L602-P608 HydrophobicContact CD1-CG 3.86Å; L602-P608 HydrophobicContact CD2-CB 3.83Å; L602-P608 HydrophobicContact CD2-CG 4.23Å
603	T	83.5	Confident	74.3	Confident	3 Å²	3	49.7 Å²	49.7	2%	0.018	31%	0.313	C	S	.	.			trans	-159.4	160.4	179.4	174.8	0	0	0	0	109.4	E580 A581 T582 D584 G847 L850	E580-T603 PolarHBondContact O-OG1 2.93Å; A581-T603 WeakPolarHBondContact CA-OG1 3.44Å; T582-T603 PolarHBondContact N-OG1 3.04Å; D584-T603 WeakPolarHBondContact O-CB 3.44Å; D584-T603 PolarHBondContact O-OG1 2.9Å; T603-G847 WeakPolarHBondContact CG2-O 3.07Å; T603-L850 HydrophobicContact CG2-CD1 3.58Å
604	G	80.2	Confident	75	Confident	4 Å²	4	48.5 Å²	48.5	4%	0.041	30%	0.301	C	S	.	.	S	Bend	trans	82.6	-169.8	-178.6	0	0	0	0	0	114	F577 V579 E580	F577-G604 WeakPolarHBondContact CD1-O 3.36Å; F577-G604 WeakPolarHBondContact CE1-O 3.38Å; V579-G604 PolarHBondContact N-O 3.01Å; V579-G604 VanDerWaalsContact N-O 3.15Å; V579-G604 CarbonylContact O-C 3.5Å; V579-G604 WeakPolarHBondContact O-CA 3.45Å; V579-G604 PolarHBondContact O-N 2.73Å; V579-G604 VanDerWaalsContact O-O 3.13Å; E580-G604 PolarHBondContact O-N 3.26Å
605	S	73.1	Confident	75.6	Confident	92 Å²	92	51.3 Å²	51.3	64%	0.643	32%	0.316	S	S	*	.	S	Bend	trans	-94.6	-3	-178.8	67	0	0	0	0	114	F577	F577-S605 CarbonylContact O-C 3.6Å
606	A	64	Low	76	Confident	74 Å²	74	46.9 Å²	46.9	61%	0.612	29%	0.294	S	S	*	.	S	Bend	trans	-97.8	96	173.7	0	0	0	0	0	107.3
607	G	61.6	Low	76.2	Confident	32 Å²	32	49.1 Å²	49.1	33%	0.33	31%	0.305	S	S	.	.			trans	-56.5	175.3	173	0	0	0	0	0	113.1	A609	G607-A609 PolarHBondContact O-N 3.19Å
608	P	68.3	Low	76.5	Confident	36 Å²	36	48.7 Å²	48.7	23%	0.234	30%	0.299	C	S	.	.			trans	-60	134.9	-179.1	20.6	-27	0	0	0	111.6	F574 L602 H610	F574-P608 HydrophobicContact CB-CG 4.11Å; F574-P608 HydrophobicContact CD2-CG 3.34Å; F574-P608 HydrophobicContact CE2-CG 3.99Å; F574-P608 HydrophobicContact CG-CG 3.96Å; L602-P608 HydrophobicContact CD1-CB 4.31Å; L602-P608 HydrophobicContact CD1-CG 3.86Å; L602-P608 HydrophobicContact CD2-CB 3.83Å; L602-P608 HydrophobicContact CD2-CG 4.23Å; P608-H610 PolarHBondContact O-N 3.02Å
609	A	58.3	Low	76.9	Confident	91 Å²	91	48 Å²	48	75%	0.752	30%	0.295	S	S	*	.	S	Bend	trans	-68	-18.3	-179.1	0	0	0	0	0	113.8	G607	G607-A609 PolarHBondContact O-N 3.19Å
610	H	67.9	Low	77.2	Confident	155 Å²	155	46 Å²	46	72%	0.718	29%	0.285	S	S	*	.	S	Bend	trans	-143.9	155.5	-178.1	-58.1	-58	0	0	0	110.5	P608	P608-H610 PolarHBondContact O-N 3.02Å
611	D	78.3	Confident	77.6	Confident	55 Å²	55	45.2 Å²	45.2	29%	0.294	28%	0.279	S	S	.	.			trans	-65	145.2	175.1	-65.9	-3.4	0	0	0	111.2	Q571 H573 F613	Q571-D611 HydrophobicContact CG-CB 4.19Å; Q571-D611 PolarHBondContact NE2-OD2 2.89Å; H573-D611 IonicContact CE1-OD1 2.65Å; H573-D611 IonicContact CG-OD1 3.54Å; H573-D611 IonicContact ND1-OD1 3.08Å; H573-D611 PolarHBondContact ND1-OD1 2.85Å; H573-D611 IonicContact ND1-OD2 2.77Å; D611-F613 HydrophobicContact CB-CE2 4.03Å; D611-F613 HydrophobicContact CB-CZ 3.94Å; D611-F613 WeakPolarHBondContact O-CD2 3.11Å; D611-F613 WeakPolarHBondContact O-CE2 3.34Å
612	L	80	Confident	77.8	Confident	27 Å²	27	48.8 Å²	48.8	14%	0.141	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	128.6	-180	-59.5	175.7	0	0	0	109.4	Q571 L572 F574 V588 A600 M619	Q571-L612 CarbonylContact C-O 3.58Å; Q571-L612 WeakPolarHBondContact CA-O 3.24Å; L572-L612 HydrophobicContact CB-CB 4.36Å; L572-L612 HydrophobicContact CD2-CD1 4.46Å; L572-L612 PolarHBondContact N-O 3.3Å; L572-L612 PolarHBondContact O-N 3.38Å; F574-L612 HydrophobicContact CE2-CD1 4.31Å; V588-L612 HydrophobicContact CB-CD1 3.99Å; V588-L612 HydrophobicContact CG1-CD1 3.95Å; V588-L612 HydrophobicContact CG2-CD1 3.85Å; A600-L612 HydrophobicContact CB-CD1 3.83Å; A600-L612 HydrophobicContact CB-CD2 4Å; L612-M619 HydrophobicContact CB-CE 4.38Å
613	F	81.5	Confident	77.9	Confident	81 Å²	81	48.3 Å²	48.3	36%	0.355	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	129.5	-179.1	-59.8	-82	0	0	0	110.7	Q571 D611	Q571-F613 HydrophobicContact CB-CD1 3.81Å; Q571-F613 HydrophobicContact CB-CE1 3.78Å; Q571-F613 VanDerWaalsContact CD-CE1 3.49Å; Q571-F613 HydrophobicContact CG-CD1 3.94Å; Q571-F613 HydrophobicContact CG-CE1 3.48Å; Q571-F613 VanDerWaalsContact CG-CE1 3.48Å; Q571-F613 HydrophobicContact CG-CZ 4.16Å; D611-F613 HydrophobicContact CB-CE2 4.03Å; D611-F613 HydrophobicContact CB-CZ 3.94Å; D611-F613 WeakPolarHBondContact O-CD2 3.11Å; D611-F613 WeakPolarHBondContact O-CE2 3.34Å
614	S	81.3	Confident	77.9	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.007	29%	0.293	C	S	.	.			trans	-82	138.6	173	-171	0	0	0	0	110.2	N569 I570 D590 S616 Q618	N569-S614 VanDerWaalsContact CB-O 3.28Å; N569-S614 WeakPolarHBondContact CB-O 3.24Å; N569-S614 VanDerWaalsContact CG-O 3.25Å; N569-S614 PolarHBondContact ND2-O 2.93Å; N569-S614 VanDerWaalsContact ND2-O 3.1Å; I570-S614 WeakPolarHBondContact O-CB 3.49Å; I570-S614 PolarHBondContact O-N 3.19Å; D590-S614 PolarHBondContact OD1-OG 3.14Å; S614-S616 PolarHBondContact OG-N 3.31Å; S614-S616 PolarHBondContact OG-O 3.31Å; S614-Q618 PolarHBondContact OG-O 3.36Å
615	T	76.4	Confident	77.9	Confident	113 Å²	113	50 Å²	50	69%	0.693	30%	0.296	S	S	*	.	S	Bend	trans	-88.8	-18.3	169.3	67.1	0	0	0	0	112.3	D590	D590-T615 VanDerWaalsContact CG-N 3.35Å; D590-T615 PolarHBondContact OD1-N 3.01Å; D590-T615 WeakPolarHBondContact OD2-CA 3.26Å; D590-T615 VanDerWaalsContact OD2-CB 3.3Å; D590-T615 WeakPolarHBondContact OD2-CB 3.36Å; D590-T615 PolarHBondContact OD2-N 3.46Å; D590-T615 PolarHBondContact OD2-OG1 3.02Å
616	S	77.4	Confident	78	Confident	34 Å²	34	47.8 Å²	47.8	24%	0.238	28%	0.277	C	S	.	.	S	Bend	trans	-103.2	172.1	173.7	76.3	0	0	0	0	112.4	D590 S614 Q618	D590-S616 VanDerWaalsContact OD1-CB 3.24Å; D590-S616 WeakPolarHBondContact OD1-CB 3.17Å; D590-S616 PolarHBondContact OD1-N 2.96Å; D590-S616 PolarHBondContact OD1-OG 2.84Å; S614-S616 PolarHBondContact OG-N 3.31Å; S614-S616 PolarHBondContact OG-O 3.31Å; S616-Q618 PolarHBondContact O-N 2.97Å; S616-Q618 PolarHBondContact OG-N 3.41Å; S616-Q618 PolarHBondContact OG-O 3.26Å
617	N	82.4	Confident	78.4	Confident	62 Å²	62	48.3 Å²	48.3	33%	0.332	28%	0.276	S	S	.	.	S	Bend	trans	-81.1	8.1	176.1	69.4	-64.4	0	0	0	113.4	A564 Q568	A564-N617 HydrophobicContact CB-CB 4.47Å; A564-N617 PolarHBondContact N-O 3.2Å; Q568-N617 WeakPolarHBondContact O-CA 3.45Å
618	Q	85.4	Confident	78.8	Confident	49 Å²	49	50 Å²	50	23%	0.229	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	139.6	179.4	-66.7	-178.8	-27	0	0	110.8	L562 H563 G591 T592 S614 S616	L562-Q618 CarbonylContact O-C 3.5Å; L562-Q618 VanDerWaalsContact O-CA 3.27Å; L562-Q618 WeakPolarHBondContact O-CA 3.37Å; H563-Q618 PolarHBondContact CE1-NE2 3.47Å; H563-Q618 PolarHBondContact ND1-NE2 3.03Å; H563-Q618 VanDerWaalsContact ND1-NE2 3.12Å; G591-Q618 WeakPolarHBondContact CA-O 3.36Å; G591-Q618 PolarHBondContact N-O 2.98Å; T592-Q618 HydrophobicContact CG2-CB 4.06Å; T592-Q618 HydrophobicContact CG2-CG 4.3Å; T592-Q618 PolarHBondContact OG1-OE1 3.41Å; S614-Q618 PolarHBondContact OG-O 3.36Å; S616-Q618 PolarHBondContact O-N 2.97Å; S616-Q618 PolarHBondContact OG-N 3.41Å; S616-Q618 PolarHBondContact OG-O 3.26Å
619	M	88.1	Confident	78.6	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	135.9	177.6	174.6	-177.5	-96.6	0	0	109.5	L562 I570 L572 V588 R589 L599 L612	L562-M619 HydrophobicContact CB-CB 4.21Å; L562-M619 WeakPolarHBondContact CB-O 3.33Å; L562-M619 HydrophobicContact CD1-CB 4.31Å; L562-M619 HydrophobicContact CD1-CG 4.24Å; L562-M619 HydrophobicContact CD1-SD 3.99Å; L562-M619 PolarHBondContact N-O 2.78Å; L562-M619 PolarHBondContact O-N 3.47Å; I570-M619 HydrophobicContact CB-CB 4.42Å; I570-M619 HydrophobicContact CD1-CB 3.93Å; I570-M619 HydrophobicContact CG2-CB 4.33Å; I570-M619 HydrophobicContact CG2-SD 4.11Å; L572-M619 HydrophobicContact CB-CE 4.41Å; L572-M619 HydrophobicContact CB-SD 3.73Å; L572-M619 HydrophobicContact CD2-SD 3.99Å; L572-M619 HydrophobicContact CG-SD 4.45Å; V588-M619 HydrophobicContact CG1-CE 4Å; V588-M619 HydrophobicContact CG1-CG 4.09Å; V588-M619 HydrophobicContact CG1-SD 3.99Å; R589-M619 CarbonylContact O-C 3.48Å; R589-M619 WeakPolarHBondContact O-CA 3.38Å; R589-M619 WeakPolarHBondContact O-CG 3.15Å; L599-M619 HydrophobicContact CD1-CE 3.32Å; L612-M619 HydrophobicContact CB-CE 4.38Å
620	M	87.3	Confident	79.1	Confident	22 Å²	22	49.3 Å²	49.3	11%	0.108	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	129.4	179.9	175.1	176.9	-85.4	0	0	109.7	L559 W560 V588 R589 G591 G593	L559-M620 HydrophobicContact CD1-CE 3.91Å; L559-M620 HydrophobicContact CD1-CG 3.58Å; L559-M620 HydrophobicContact CD1-SD 3.77Å; L559-M620 HydrophobicContact CD2-CE 4.12Å; L559-M620 HydrophobicContact CG-CE 4.42Å; W560-M620 WeakPolarHBondContact O-CA 3.21Å; V588-M620 CarbonylContact C-O 3.58Å; V588-M620 WeakPolarHBondContact CA-O 3.34Å; R589-M620 HydrophobicContact CB-CB 4.46Å; R589-M620 PolarHBondContact N-O 2.9Å; R589-M620 PolarHBondContact O-N 3.36Å; G591-M620 WeakPolarHBondContact O-CB 3.48Å; G593-M620 VanDerWaalsContact N-CE 3.33Å
621	V	88.5	Confident	79.4	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	125.5	173.4	-176.6	0	0	0	0	108	F543 W560 L562 L572 V586 E587 V588	F543-V621 HydrophobicContact CE2-CB 4.44Å; F543-V621 HydrophobicContact CE2-CG1 4.22Å; F543-V621 HydrophobicContact CZ-CB 4.36Å; F543-V621 HydrophobicContact CZ-CG1 4.37Å; F543-V621 HydrophobicContact CZ-CG2 4.13Å; W560-V621 HydrophobicContact CB-CB 4.47Å; W560-V621 HydrophobicContact CE3-CB 4.24Å; W560-V621 HydrophobicContact CE3-CG1 4.05Å; W560-V621 HydrophobicContact CZ3-CG1 4.45Å; W560-V621 PolarHBondContact N-O 3.22Å; W560-V621 PolarHBondContact O-N 2.98Å; L562-V621 HydrophobicContact CD1-CG2 4.34Å; L572-V621 HydrophobicContact CD2-CG2 3.7Å; V586-V621 HydrophobicContact CG1-CG1 3.78Å; E587-V621 CarbonylContact O-C 3.11Å; E587-V621 WeakPolarHBondContact O-CA 3.49Å; V588-V621 HydrophobicContact CG1-CG2 4.35Å; V588-V621 HydrophobicContact CG2-CG1 4.39Å; V588-V621 HydrophobicContact CG2-CG2 4.38Å
622	R	85.9	Confident	79.5	Confident	83 Å²	83	46.6 Å²	46.6	31%	0.313	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	129.9	179.9	-169.8	176.7	-171.7	130.5	-0.5	110	N557 C558 L559 V586 E587	N557-R622 PolarHBondContact ND2-NH2 3.17Å; N557-R622 VanDerWaalsContact ND2-NH2 3.18Å; N557-R622 PolarHBondContact OD1-NE 2.93Å; N557-R622 VanDerWaalsContact OD1-NE 3.13Å; N557-R622 PolarHBondContact OD1-NH2 3.01Å; C558-R622 CarbonylContact O-C 3.49Å; C558-R622 WeakPolarHBondContact O-CA 3.36Å; C558-R622 WeakPolarHBondContact O-CG 3.27Å; L559-R622 HydrophobicContact CD1-CB 3.88Å; L559-R622 HydrophobicContact CD1-CG 4.05Å; V586-R622 CarbonylContact C-O 3.59Å; V586-R622 WeakPolarHBondContact CA-O 3.43Å; E587-R622 HydrophobicContact CB-CB 4.39Å; E587-R622 PolarHBondContact N-O 3.5Å; E587-R622 PolarHBondContact O-N 2.84Å
623	F	86.9	Confident	79.7	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	125.9	177.4	174.6	-128.8	0	0	0	109.2	Y552 N557 C558 W560 V579 M585 V586 T625 F634	Y552-F623 HydrophobicContact CD1-CZ 4.15Å; Y552-F623 AromaticContact CD2-CE1 3.87Å; Y552-F623 HydrophobicContact CD2-CE1 3.87Å; Y552-F623 AromaticContact CD2-CZ 3.59Å; Y552-F623 HydrophobicContact CD2-CZ 3.59Å; Y552-F623 HydrophobicContact CE1-CZ 4.24Å; Y552-F623 HydrophobicContact CE2-CE1 4.48Å; Y552-F623 AromaticContact CE2-CZ 3.77Å; Y552-F623 HydrophobicContact CE2-CZ 3.77Å; Y552-F623 AromaticContact CG-CE1 3.96Å; Y552-F623 HydrophobicContact CG-CE1 3.96Å; Y552-F623 AromaticContact CG-CZ 3.8Å; Y552-F623 HydrophobicContact CG-CZ 3.8Å; N557-F623 CarbonylContact C-O 3.49Å; N557-F623 WeakPolarHBondContact CA-O 3.48Å; C558-F623 HydrophobicContact CB-CB 4.27Å; C558-F623 PolarHBondContact N-O 2.9Å; C558-F623 PolarHBondContact O-N 3.19Å; W560-F623 HydrophobicContact CH2-CB 3.89Å; W560-F623 HydrophobicContact CH2-CD1 4.46Å; W560-F623 HydrophobicContact CZ3-CB 3.58Å; V579-F623 HydrophobicContact CG1-CE2 3.83Å; V579-F623 HydrophobicContact CG1-CZ 4.5Å; V579-F623 HydrophobicContact CG2-CE2 4.09Å; V579-F623 HydrophobicContact CG2-CZ 4.5Å; M585-F623 WeakPolarHBondContact O-CD2 3.03Å; V586-F623 HydrophobicContact CG2-CB 4.32Å; V586-F623 HydrophobicContact CG2-CD2 3.46Å; V586-F623 VanDerWaalsContact CG2-CD2 3.46Å; V586-F623 HydrophobicContact CG2-CE2 4.1Å; V586-F623 HydrophobicContact CG2-CG 4.21Å; F623-T625 HydrophobicContact CD1-CG2 4.37Å; F623-T625 HydrophobicContact CD2-CG2 4.44Å; F623-T625 HydrophobicContact CE1-CG2 3.58Å; F623-T625 HydrophobicContact CE2-CG2 3.67Å; F623-T625 HydrophobicContact CZ-CG2 3.19Å; F623-F634 HydrophobicContact CB-CE1 4.02Å; F623-F634 HydrophobicContact CB-CZ 4.41Å; F623-F634 HydrophobicContact CD1-CE1 4.14Å; F623-F634 HydrophobicContact CD2-CE1 4.08Å; F623-F634 AromaticContact CG-CE1 3.83Å; F623-F634 HydrophobicContact CG-CE1 3.83Å
624	F	82.8	Confident	80	Confident	27 Å²	27	41.4 Å²	41.4	12%	0.118	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	141.1	175.7	59.4	-92.9	0	0	0	110.5	A556 M585 Y846	A556-F624 CarbonylContact O-C 3.56Å; A556-F624 WeakPolarHBondContact O-CA 2.99Å; M585-F624 HydrophobicContact CB-CD2 4.5Å; M585-F624 HydrophobicContact CB-CE1 3.9Å; M585-F624 HydrophobicContact CB-CE2 3.71Å; M585-F624 HydrophobicContact CB-CZ 3.38Å; M585-F624 HydrophobicContact CE-CE2 4.35Å; M585-F624 HydrophobicContact CG-CE2 3.58Å; M585-F624 HydrophobicContact CG-CZ 3.61Å; M585-F624 PolarHBondContact N-O 3.15Å; M585-F624 PolarHBondContact O-N 3.28Å; M585-F624 HydrophobicContact SD-CE2 3.72Å; M585-F624 HydrophobicContact SD-CZ 3.48Å; M585-F624 WeakPolarHBondContact SD-CZ 3.29Å; F624-Y846 HydrophobicContact CZ-CE1 4.03Å
625	T	80	Confident	80.3	Confident	16 Å²	16	45 Å²	45	10%	0.098	25%	0.246	C	C	.	.			trans	-126.2	156.2	-179.1	59.9	0	0	0	0	110.9	Y552 M555 A556 D584 F623	Y552-T625 HydrophobicContact CD2-CG2 3.57Å; Y552-T625 HydrophobicContact CE2-CG2 3.35Å; M555-T625 PolarHBondContact N-OG1 2.79Å; M555-T625 VanDerWaalsContact N-OG1 3.08Å; A556-T625 WeakPolarHBondContact CA-OG1 3.33Å; A556-T625 HydrophobicContact CB-CG2 4.3Å; A556-T625 WeakPolarHBondContact CB-OG1 3.43Å; A556-T625 PolarHBondContact N-OG1 3.15Å; A556-T625 PolarHBondContact O-N 3.47Å; A556-T625 PolarHBondContact O-OG1 2.78Å; D584-T625 HydrophobicContact CB-CG2 4.2Å; D584-T625 WeakPolarHBondContact OD1-CA 3.37Å; D584-T625 VanDerWaalsContact OD1-CB 3.29Å; D584-T625 WeakPolarHBondContact OD1-CB 3.23Å; F623-T625 HydrophobicContact CD1-CG2 4.37Å; F623-T625 HydrophobicContact CD2-CG2 4.44Å; F623-T625 HydrophobicContact CE1-CG2 3.58Å; F623-T625 HydrophobicContact CE2-CG2 3.67Å; F623-T625 HydrophobicContact CZ-CG2 3.19Å
626	D	76.8	Confident	80.8	Confident	45 Å²	45	39.6 Å²	39.6	24%	0.241	21%	0.213	C	C	.	.			trans	-92.4	-167	179.6	87.8	-6.7	0	0	0	112.5	N554 M555 Y583 D584 S628	N554-D626 CarbonylContact C-O 3.56Å; N554-D626 WeakPolarHBondContact CA-O 3.45Å; N554-D626 WeakPolarHBondContact CB-O 3.44Å; M555-D626 PolarHBondContact N-O 2.81Å; Y583-D626 WeakPolarHBondContact CB-OD2 3.5Å; D584-D626 PolarHBondContact OD1-N 3.17Å; D626-S628 VanDerWaalsContact C-N 3.3Å; D626-S628 PolarHBondContact O-N 3.04Å; D626-S628 VanDerWaalsContact OD1-C 3.3Å; D626-S628 PolarHBondContact OD1-N 2.93Å
627	S	70.8	Confident	81.4	Confident	85 Å²	85	39.3 Å²	39.3	59%	0.594	21%	0.208	S	C	*	.	S	Bend	trans	-78.2	-7	-178.2	54.6	0	0	0	0	114.7	N554	N554-S627 PolarHBondContact ND2-O 2.98Å
628	S	70.3	Confident	81.6	Confident	67 Å²	67	36.3 Å²	36.3	47%	0.469	19%	0.193	S	C	.	.	S	Bend	trans	-161.1	129.4	-170.7	58.4	0	0	0	0	113.7	D626	D626-S628 VanDerWaalsContact C-N 3.3Å; D626-S628 PolarHBondContact O-N 3.04Å; D626-S628 VanDerWaalsContact OD1-C 3.3Å; D626-S628 PolarHBondContact OD1-N 2.93Å
629	G	64	Low	81.5	Confident	25 Å²	25	35.9 Å²	35.9	26%	0.258	19%	0.193	S	C	.	.			trans	108.2	108.7	172.3	0	0	0	0	0	109.5	N554 D584	N554-G629 PolarHBondContact OD1-N 3.08Å; D584-G629 VanDerWaalsContact OD2-O 3.1Å
630	D	68.9	Low	81.2	Confident	88 Å²	88	36.9 Å²	36.9	47%	0.471	20%	0.2	S	C	.	.			trans	-126.8	141.2	-173.6	60.2	-84.4	0	0	0	111.6	S551 Y552	S551-D630 WeakPolarHBondContact CB-OD2 3.41Å; S551-D630 WeakPolarHBondContact OG-CB 3Å; S551-D630 PolarHBondContact OG-OD2 3.07Å; Y552-D630 HydrophobicContact CE2-CB 4.37Å
631	G	73.9	Confident	80.5	Confident	14 Å²	14	36.4 Å²	36.4	14%	0.144	20%	0.201	C	C	.	.			trans	-109.6	-176.7	173	0	0	0	0	0	111.7	S551 Y552 D578 G633	S551-G631 WeakPolarHBondContact CA-O 3.35Å; Y552-G631 WeakPolarHBondContact CD1-O 3.24Å; Y552-G631 VanDerWaalsContact CE1-C 3.5Å; Y552-G631 VanDerWaalsContact CE1-O 3.24Å; Y552-G631 WeakPolarHBondContact CE1-O 3.49Å; Y552-G631 VanDerWaalsContact CZ-N 3.27Å; Y552-G631 PolarHBondContact N-O 3.21Å; Y552-G631 PolarHBondContact OH-N 2.64Å; D578-G631 CarbonylContact O-C 3.56Å; G631-G633 PolarHBondContact O-N 3.44Å
632	R	81	Confident	79.2	Confident	139 Å²	139	41.6 Å²	41.6	53%	0.525	23%	0.232	S	C	.	.			trans	-73	-11.1	177.2	-63.1	178.2	-64.9	172.1	13	113.6	Y548 D578	Y548-R632 VanDerWaalsContact CD2-O 3.27Å; Y548-R632 WeakPolarHBondContact CD2-O 3.23Å; D578-R632 HydrophobicContact CB-CB 4.2Å; D578-R632 PolarHBondContact O-N 3.19Å; D578-R632 WeakPolarHBondContact OD2-CB 3.38Å; D578-R632 WeakPolarHBondContact OD2-CG 3.46Å; D578-R632 IonicContact OD2-CZ 3.76Å; D578-R632 PolarHBondContact OD2-N 2.85Å; D578-R632 IonicContact OD2-NE 3.21Å; D578-R632 PolarHBondContact OD2-NE 3.02Å; D578-R632 IonicContact OD2-NH2 3.97Å; D578-R632 PolarHBondContact OD2-NH2 2.83Å
633	G	84.4	Confident	77.8	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	89.3	-154.5	176.7	0	0	0	0	0	113.1	S545 D578 G631	S545-G633 VanDerWaalsContact OG-CA 3.24Å; S545-G633 WeakPolarHBondContact OG-CA 3.36Å; D578-G633 CarbonylContact C-O 3.52Å; D578-G633 WeakPolarHBondContact CA-O 3.47Å; D578-G633 PolarHBondContact N-O 3.5Å; D578-G633 WeakPolarHBondContact O-CA 3.31Å; D578-G633 PolarHBondContact O-N 2.95Å; G631-G633 PolarHBondContact O-N 3.44Å
634	F	87.3	Confident	76.4	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	155.3	-177.5	71.4	-92.7	0	0	0	112.5	F543 S544 S545 W560 F574 D576 F577 V579 V586 F623 A636	F543-F634 HydrophobicContact CD2-CE2 4.24Å; F543-F634 AromaticContact CE2-CE2 3.83Å; F543-F634 HydrophobicContact CE2-CE2 3.83Å; F543-F634 HydrophobicContact CE2-CZ 4.42Å; S544-F634 CarbonylContact C-O 3.18Å; S544-F634 WeakPolarHBondContact CA-O 3.45Å; S544-F634 VanDerWaalsContact CB-O 3.32Å; S544-F634 WeakPolarHBondContact CB-O 3.19Å; S545-F634 PolarHBondContact N-O 3.44Å; S545-F634 PolarHBondContact OG-N 3Å; S545-F634 PolarHBondContact OG-O 3.46Å; W560-F634 HydrophobicContact CE3-CZ 4.44Å; W560-F634 HydrophobicContact CH2-CE1 4.17Å; W560-F634 AromaticContact CH2-CZ 3.57Å; W560-F634 HydrophobicContact CH2-CZ 3.57Å; W560-F634 HydrophobicContact CZ2-CZ 4.41Å; W560-F634 HydrophobicContact CZ3-CE1 4.37Å; W560-F634 AromaticContact CZ3-CZ 3.61Å; W560-F634 HydrophobicContact CZ3-CZ 3.61Å; F574-F634 HydrophobicContact CD1-CB 4.36Å; F574-F634 AromaticContact CD1-CD2 3.93Å; F574-F634 HydrophobicContact CD1-CD2 3.93Å; F574-F634 HydrophobicContact CD1-CG 4.39Å; F574-F634 AromaticContact CE1-CD2 3.63Å; F574-F634 HydrophobicContact CE1-CD2 3.63Å; F574-F634 AromaticContact CE1-CE2 4Å; F574-F634 HydrophobicContact CE1-CE2 4Å; F574-F634 HydrophobicContact CE1-CG 4.18Å; D576-F634 VanDerWaalsContact O-CA 3.28Å; D576-F634 WeakPolarHBondContact O-CA 3.09Å; D576-F634 WeakPolarHBondContact O-CB 3.38Å; F577-F634 HydrophobicContact CD2-CB 3.64Å; F577-F634 HydrophobicContact CD2-CG 4.29Å; F577-F634 HydrophobicContact CE2-CB 4.19Å; F577-F634 HydrophobicContact CE2-CG 4.44Å; F577-F634 HydrophobicContact CG-CB 4.36Å; V579-F634 HydrophobicContact CG2-CD1 4.31Å; V586-F634 HydrophobicContact CG2-CD1 3.8Å; V586-F634 HydrophobicContact CG2-CE1 3.58Å; V586-F634 HydrophobicContact CG2-CZ 4.29Å; F623-F634 HydrophobicContact CB-CE1 4.02Å; F623-F634 HydrophobicContact CB-CZ 4.41Å; F623-F634 HydrophobicContact CD1-CE1 4.14Å; F623-F634 HydrophobicContact CD2-CE1 4.08Å; F623-F634 AromaticContact CG-CE1 3.83Å; F623-F634 HydrophobicContact CG-CE1 3.83Å; F634-A636 HydrophobicContact CD2-CB 4.34Å; F634-A636 HydrophobicContact CE2-CB 4.46Å
635	K	87.2	Confident	74.9	Confident	75 Å²	75	42.9 Å²	42.9	33%	0.326	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	124.8	170.4	-173.2	173	-177.3	172.3	0	109.4	Y548 L575 D576	Y548-K635 HydrophobicContact CD1-CB 4.4Å; Y548-K635 HydrophobicContact CD1-CD 4.49Å; Y548-K635 HydrophobicContact CE1-CB 3.95Å; Y548-K635 HydrophobicContact CE1-CD 3.96Å; Y548-K635 HydrophobicContact CE2-CB 4.19Å; L575-K635 WeakPolarHBondContact CB-O 3.49Å; L575-K635 HydrophobicContact CD1-CD 4.42Å; L575-K635 HydrophobicContact CD1-CG 4.24Å; L575-K635 PolarHBondContact N-O 2.81Å; D576-K635 PolarHBondContact N-O 3.1Å; D576-K635 PolarHBondContact O-N 3.14Å
636	A	87.8	Confident	73.7	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	150.4	-178.4	0	0	0	0	0	111.5	T542 F543 L572 H573 F574 F634	T542-A636 CarbonylContact C-O 3.58Å; T542-A636 WeakPolarHBondContact CA-O 3.26Å; F543-A636 HydrophobicContact CD1-CB 4.37Å; F543-A636 HydrophobicContact CE1-CB 3.82Å; F543-A636 HydrophobicContact CE2-CB 4.18Å; F543-A636 HydrophobicContact CZ-CB 3.72Å; F543-A636 PolarHBondContact N-O 3.46Å; F543-A636 PolarHBondContact O-N 2.8Å; L572-A636 HydrophobicContact CD1-CB 3.97Å; H573-A636 CarbonylContact O-C 3.59Å; H573-A636 WeakPolarHBondContact O-CA 3.32Å; F574-A636 HydrophobicContact CD1-CB 3.91Å; F574-A636 HydrophobicContact CE1-CB 4.07Å; F574-A636 HydrophobicContact CG-CB 4.38Å; F634-A636 HydrophobicContact CD2-CB 4.34Å; F634-A636 HydrophobicContact CE2-CB 4.46Å
637	N	89.1	Confident	72.6	Confident	28 Å²	28	44.4 Å²	44.4	15%	0.15	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	138.7	171.5	-173.6	2.1	0	0	0	108.3	N540 S541 T542 H573 L575	N540-N637 PolarHBondContact OD1-ND2 2.94Å; N540-N637 PolarHBondContact OD1-OD1 2.65Å; S541-N637 PolarHBondContact O-OD1 3.14Å; T542-N637 HydrophobicContact CG2-CB 3.94Å; H573-N637 PolarHBondContact N-O 3.45Å; H573-N637 PolarHBondContact O-N 3.42Å; H573-N637 VanDerWaalsContact O-O 3.13Å; L575-N637 HydrophobicContact CD1-CB 4.19Å; L575-N637 HydrophobicContact CG-CB 4.47Å
638	F	87.2	Confident	71.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	144.3	169.7	78.1	-83.9	0	0	0	112.3	L536 E538 N540 S541 F543 L562 I570 Q571 L572 C640	L536-F638 HydrophobicContact CB-CE1 3.44Å; L536-F638 VanDerWaalsContact CB-CE1 3.44Å; L536-F638 HydrophobicContact CB-CZ 3.5Å; L536-F638 HydrophobicContact CD1-CE1 3.99Å; L536-F638 HydrophobicContact CD2-CE1 4.16Å; L536-F638 HydrophobicContact CG-CE1 4.07Å; E538-F638 WeakPolarHBondContact O-CE2 3.48Å; E538-F638 WeakPolarHBondContact O-CZ 3.33Å; N540-F638 WeakPolarHBondContact CA-O 2.99Å; N540-F638 PolarHBondContact N-O 3.47Å; S541-F638 VanDerWaalsContact O-CD1 3.3Å; S541-F638 WeakPolarHBondContact O-CD1 3.23Å; S541-F638 PolarHBondContact O-N 2.93Å; S541-F638 WeakPolarHBondContact OG-CE1 3.45Å; S541-F638 WeakPolarHBondContact OG-CZ 3.05Å; F543-F638 HydrophobicContact CD1-CD1 4.38Å; F543-F638 HydrophobicContact CE1-CD1 4.34Å; L562-F638 HydrophobicContact CB-CD2 4.41Å; L562-F638 HydrophobicContact CD1-CB 3.81Å; L562-F638 HydrophobicContact CD1-CD1 4.21Å; L562-F638 HydrophobicContact CD1-CD2 4.43Å; L562-F638 HydrophobicContact CD1-CG 3.9Å; L562-F638 HydrophobicContact CD2-CD1 3.63Å; L562-F638 HydrophobicContact CD2-CE1 3.71Å; L562-F638 HydrophobicContact CD2-CG 4.07Å; L562-F638 HydrophobicContact CD2-CZ 4.26Å; L562-F638 HydrophobicContact CG-CD1 4.43Å; L562-F638 HydrophobicContact CG-CG 4.4Å; I570-F638 HydrophobicContact CG2-CB 4.17Å; I570-F638 HydrophobicContact CG2-CD2 4.09Å; Q571-F638 CarbonylContact O-C 3.52Å; Q571-F638 WeakPolarHBondContact O-CA 2.98Å; Q571-F638 WeakPolarHBondContact O-CB 3.09Å; L572-F638 HydrophobicContact CD1-CB 4.12Å; F638-C640 VanDerWaalsContact CE2-SG 3.54Å
639	T	84.1	Confident	71.4	Confident	40 Å²	40	46.6 Å²	46.6	25%	0.245	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	139	177.1	52.1	0	0	0	0	110.4	N540 Q571 L644	N540-T639 HydrophobicContact CB-CG2 4.16Å; Q571-T639 PolarHBondContact N-O 2.93Å; Q571-T639 PolarHBondContact O-N 3.44Å; T639-L644 WeakPolarHBondContact O-CD1 2.88Å
640	C	81.4	Confident	71.7	Confident	21 Å²	21	46.5 Å²	46.5	14%	0.142	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	142.8	179	-52.6	0	0	0	0	110.3	A564 N569 F638	A564-C640 HydrophobicContact CB-CB 3.9Å; N569-C640 WeakPolarHBondContact O-CA 2.99Å; F638-C640 VanDerWaalsContact CE2-SG 3.54Å
641	G	72.2	Confident	71.9	Confident	12 Å²	12	45.3 Å²	45.3	12%	0.124	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.5	159.7	179.7	0	0	0	0	0	112.1	Q568 N569 A643	Q568-G641 CarbonylContact C-O 3.5Å; Q568-G641 WeakPolarHBondContact CA-O 3.43Å; N569-G641 PolarHBondContact N-O 2.94Å; N569-G641 PolarHBondContact O-N 2.94Å; N569-G641 VanDerWaalsContact O-N 3.11Å; G641-A643 PolarHBondContact O-N 2.85Å
642	V	61	Low	71.2	Confident	109 Å²	109	52 Å²	52	66%	0.661	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	126.3	177.7	-177.2	0	0	0	0	107.3	Q568 L644	Q568-V642 HydrophobicContact CG-CG2 3.77Å; V642-L644 PolarHBondContact O-N 2.98Å
643	A	57.1	Low	70.3	Confident	44 Å²	44	49.5 Å²	49.5	36%	0.364	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	26.2	177	0	0	0	0	0	114.3	G641 G645 S646	G641-A643 PolarHBondContact O-N 2.85Å; A643-G645 PolarHBondContact O-N 3.17Å; A643-S646 VanDerWaalsContact C-OG 3.25Å; A643-S646 WeakPolarHBondContact CA-OG 3.15Å; A643-S646 WeakPolarHBondContact CB-OG 3.47Å; A643-S646 CarbonylContact O-C 3.5Å; A643-S646 PolarHBondContact O-N 3.02Å; A643-S646 PolarHBondContact O-OG 3.01Å
644	L	57.1	Low	69.8	Low	49 Å²	49	54 Å²	54	26%	0.257	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	126.2	171.8	-74	-179.4	0	0	0	110.5	Q571 T639 V642 S646	Q571-L644 HydrophobicContact CB-CD1 4.47Å; T639-L644 WeakPolarHBondContact O-CD1 2.88Å; V642-L644 PolarHBondContact O-N 2.98Å; L644-S646 PolarHBondContact O-N 3.04Å
645	G	51.1	Low	68.9	Low	44 Å²	44	56.3 Å²	56.3	45%	0.454	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.8	-11.6	-172.3	0	0	0	0	0	114.9	A643 P647	A643-G645 PolarHBondContact O-N 3.17Å; G645-P647 WeakPolarHBondContact O-CD 3.01Å
646	S	54.3	Low	68.1	Low	57 Å²	57	56 Å²	56	40%	0.399	37%	0.369	S	S	.	.	S	Bend	trans	-94.3	110.5	160.9	59.3	0	0	0	0	108.3	A643 L644 A648	A643-S646 VanDerWaalsContact C-OG 3.25Å; A643-S646 WeakPolarHBondContact CA-OG 3.15Å; A643-S646 WeakPolarHBondContact CB-OG 3.47Å; A643-S646 CarbonylContact O-C 3.5Å; A643-S646 PolarHBondContact O-N 3.02Å; A643-S646 PolarHBondContact O-OG 3.01Å; L644-S646 PolarHBondContact O-N 3.04Å; S646-A648 PolarHBondContact O-N 2.88Å
647	P	54.3	Low	67.1	Low	36 Å²	36	56 Å²	56	23%	0.234	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-47.5	143.5	174.5	23.9	-41.2	0	0	0	112.9	G645 Q656 G660	G645-P647 WeakPolarHBondContact O-CD 3.01Å; P647-Q656 HydrophobicContact CB-CG 4.06Å; P647-Q656 HydrophobicContact CG-CG 3.57Å; P647-Q656 PolarHBondContact O-NE2 3.21Å; P647-G660 WeakPolarHBondContact CB-O 3.1Å
648	A	57.1	Low	65.8	Low	82 Å²	82	61.4 Å²	61.4	68%	0.678	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-54.1	128.2	174.1	0	0	0	0	0	109	S646 C650 Q656	S646-A648 PolarHBondContact O-N 2.88Å; A648-C650 PolarHBondContact O-N 2.88Å; A648-C650 VanDerWaalsContact O-N 3.14Å; A648-Q656 VanDerWaalsContact C-NE2 3.3Å; A648-Q656 PolarHBondContact O-NE2 2.03Å
649	P	58.9	Low	64.2	Low	115 Å²	115	65.4 Å²	65.4	75%	0.747	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-55.7	125.4	-174.9	20.6	-31	0	0	0	109.2
650	C	70.6	Confident	63	Low	23 Å²	23	64.6 Å²	64.6	16%	0.155	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-61.5	155.8	-177.4	-53.3	0	0	0	0	110.6	A648 Q654 Q656 C662	A648-C650 PolarHBondContact O-N 2.88Å; A648-C650 VanDerWaalsContact O-N 3.14Å; C650-Q654 HydrophobicContact CB-CB 3.5Å; C650-Q656 WeakPolarHBondContact SG-CB 3.16Å; C650-C662 VanDerWaalsContact CA-SG 3.52Å; C650-C662 HydrophobicContact CB-CB 3.73Å; C650-C662 WeakPolarHBondContact CB-SG 3.22Å; C650-C662 WeakPolarHBondContact SG-CA 3.2Å; C650-C662 WeakPolarHBondContact SG-CB 3.45Å; C650-C662 CovalentContact SG-SG 2.03Å; C650-C662 PolarHBondContact SG-SG 3.41Å
651	A	73.8	Confident	62.3	Low	63 Å²	63	65.3 Å²	65.3	52%	0.521	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-56.1	150.2	-179.8	0	0	0	0	0	111	A653 Q654	A651-A653 PolarHBondContact O-N 3.38Å; A651-Q654 PolarHBondContact O-N 3.15Å
652	V	57.4	Low	62.3	Low	156 Å²	156	67.5 Å²	67.5	95%	0.945	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	108.4	178.4	-143	0	0	0	0	108.1
653	A	63.8	Low	63	Low	86 Å²	86	62.8 Å²	62.8	71%	0.711	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	107.7	10.5	-169.6	0	0	0	0	0	117.5	A651 G665	A651-A653 PolarHBondContact O-N 3.38Å; A653-G665 WeakPolarHBondContact O-CA 3.41Å; A653-G665 PolarHBondContact O-N 3.36Å
654	Q	73.4	Confident	63.7	Low	95 Å²	95	63.6 Å²	63.6	44%	0.444	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	140.9	171.2	-73.5	179.6	-14.3	0	0	111.2	C650 A651 I663	C650-Q654 HydrophobicContact CB-CB 3.5Å; A651-Q654 PolarHBondContact O-N 3.15Å; Q654-I663 CarbonylContact C-O 3.56Å; Q654-I663 WeakPolarHBondContact CA-O 3.1Å; Q654-I663 WeakPolarHBondContact CB-O 3.32Å
655	F	68.6	Low	64	Low	48 Å²	48	62.8 Å²	62.8	21%	0.211	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	142.6	173.8	175.4	-99.9	0	0	0	110.3	C662 I663 Q668 D680	F655-C662 WeakPolarHBondContact O-CA 3.14Å; F655-I663 HydrophobicContact CB-CD1 4.28Å; F655-I663 HydrophobicContact CB-CG1 3.81Å; F655-I663 HydrophobicContact CD1-CD1 3.72Å; F655-I663 HydrophobicContact CD1-CG1 3.84Å; F655-I663 HydrophobicContact CG-CD1 4.45Å; F655-I663 HydrophobicContact CG-CG1 4.33Å; F655-I663 PolarHBondContact N-O 2.83Å; F655-I663 PolarHBondContact O-N 2.88Å; F655-Q668 HydrophobicContact CB-CB 4.1Å; F655-Q668 HydrophobicContact CB-CG 4.42Å; F655-Q668 HydrophobicContact CD1-CB 4.46Å; F655-Q668 HydrophobicContact CD1-CG 4.16Å; F655-Q668 HydrophobicContact CD2-CB 4.45Å; F655-Q668 HydrophobicContact CD2-CG 3.86Å; F655-Q668 VanDerWaalsContact CD2-NE2 3.31Å; F655-Q668 VanDerWaalsContact CD2-OE1 3.29Å; F655-Q668 HydrophobicContact CE1-CG 4.39Å; F655-Q668 VanDerWaalsContact CE2-CD 3.47Å; F655-Q668 HydrophobicContact CE2-CG 4.13Å; F655-Q668 HydrophobicContact CG-CB 4.08Å; F655-Q668 HydrophobicContact CG-CG 3.87Å; F655-Q668 HydrophobicContact CZ-CG 4.36Å; F655-D680 HydrophobicContact CD1-CB 4.38Å; F655-D680 HydrophobicContact CE1-CB 4.23Å
656	Q	69.6	Low	64.7	Low	67 Å²	67	66.8 Å²	66.8	31%	0.313	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	115.7	-176.9	-171.5	168.9	52.6	0	0	110	P647 A648 C650	P647-Q656 HydrophobicContact CB-CG 4.06Å; P647-Q656 HydrophobicContact CG-CG 3.57Å; P647-Q656 PolarHBondContact O-NE2 3.21Å; A648-Q656 VanDerWaalsContact C-NE2 3.3Å; A648-Q656 PolarHBondContact O-NE2 2.03Å; C650-Q656 WeakPolarHBondContact SG-CB 3.16Å
657	C	66.8	Low	65.1	Low	2 Å²	2	64.6 Å²	64.6	1%	0.014	41%	0.41	C	S	.	.			trans	-64.2	154.9	175.1	-51.8	0	0	0	0	111	T659 G660 A661 C675 D677	C657-T659 PolarHBondContact O-N 3.13Å; C657-G660 WeakPolarHBondContact O-CA 3.26Å; C657-G660 PolarHBondContact O-N 3.06Å; C657-A661 HydrophobicContact CB-CB 4.3Å; C657-A661 WeakPolarHBondContact CB-O 3.43Å; C657-A661 PolarHBondContact N-O 2.8Å; C657-A661 PolarHBondContact SG-O 2.04Å; C657-C675 VanDerWaalsContact CA-SG 3.58Å; C657-C675 HydrophobicContact CB-CB 3.7Å; C657-C675 WeakPolarHBondContact CB-SG 3.32Å; C657-C675 WeakPolarHBondContact SG-CA 3.42Å; C657-C675 WeakPolarHBondContact SG-CB 3.35Å; C657-C675 CovalentContact SG-SG 2.01Å; C657-C675 PolarHBondContact SG-SG 2.7Å; C657-D677 WeakPolarHBondContact CB-OD1 3.48Å
658	Q	61.2	Low	65.4	Low	140 Å²	140	66.6 Å²	66.6	65%	0.654	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-26.1	175.4	-60.5	167.7	11.7	0	0	112	G660 D677 S679	Q658-G660 VanDerWaalsContact C-N 3.28Å; Q658-D677 WeakPolarHBondContact CA-OD2 3.48Å; Q658-D677 VanDerWaalsContact CB-OD2 3.27Å; Q658-D677 WeakPolarHBondContact CB-OD2 3.48Å; Q658-D677 PolarHBondContact N-OD2 2.92Å; Q658-S679 WeakPolarHBondContact CB-OG 3.47Å; Q658-S679 WeakPolarHBondContact CG-OG 3.32Å; Q658-S679 PolarHBondContact N-OG 3.06Å
659	T	54.3	Low	65.6	Low	85 Å²	85	64.4 Å²	64.4	52%	0.521	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-16	168.4	50.5	0	0	0	0	114.4	C657 D677	C657-T659 PolarHBondContact O-N 3.13Å; T659-D677 HydrophobicContact CG2-CB 3.37Å; T659-D677 PolarHBondContact N-OD2 2.91Å; T659-D677 VanDerWaalsContact OG1-CG 3.23Å; T659-D677 PolarHBondContact OG1-OD1 2.89Å
660	G	59.4	Low	65.4	Low	22 Å²	22	62.7 Å²	62.7	23%	0.227	38%	0.38	C	S	.	.	S	Bend	trans	99.7	2.7	174.9	0	0	0	0	0	118.9	P647 C657 Q658	P647-G660 WeakPolarHBondContact CB-O 3.1Å; C657-G660 WeakPolarHBondContact O-CA 3.26Å; C657-G660 PolarHBondContact O-N 3.06Å; Q658-G660 VanDerWaalsContact C-N 3.28Å
661	A	66.6	Low	64.5	Low	36 Å²	36	62.6 Å²	62.6	30%	0.298	38%	0.383	S	S	.	.			trans	-68	145.3	166.8	0	0	0	0	0	111.2	C657 P676	C657-A661 HydrophobicContact CB-CB 4.3Å; C657-A661 WeakPolarHBondContact CB-O 3.43Å; C657-A661 PolarHBondContact N-O 2.8Å; C657-A661 PolarHBondContact SG-O 2.04Å; A661-P676 HydrophobicContact CB-CG 4.1Å
662	C	72.5	Confident	63.5	Low	58 Å²	58	61.4 Å²	61.4	39%	0.392	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	118.5	174	-67.9	0	0	0	0	109.5	C650 F655	C650-C662 VanDerWaalsContact CA-SG 3.52Å; C650-C662 HydrophobicContact CB-CB 3.73Å; C650-C662 WeakPolarHBondContact CB-SG 3.22Å; C650-C662 WeakPolarHBondContact SG-CA 3.2Å; C650-C662 WeakPolarHBondContact SG-CB 3.45Å; C650-C662 CovalentContact SG-SG 2.03Å; C650-C662 PolarHBondContact SG-SG 3.41Å; F655-C662 WeakPolarHBondContact O-CA 3.14Å
663	I	75	Confident	63.4	Low	10 Å²	10	59.1 Å²	59.1	5%	0.051	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	158.2	173.7	64.8	169.9	0	0	0	109.7	Q654 F655 G665 S667 D674 D680	Q654-I663 CarbonylContact C-O 3.56Å; Q654-I663 WeakPolarHBondContact CA-O 3.1Å; Q654-I663 WeakPolarHBondContact CB-O 3.32Å; F655-I663 HydrophobicContact CB-CD1 4.28Å; F655-I663 HydrophobicContact CB-CG1 3.81Å; F655-I663 HydrophobicContact CD1-CD1 3.72Å; F655-I663 HydrophobicContact CD1-CG1 3.84Å; F655-I663 HydrophobicContact CG-CD1 4.45Å; F655-I663 HydrophobicContact CG-CG1 4.33Å; F655-I663 PolarHBondContact N-O 2.83Å; F655-I663 PolarHBondContact O-N 2.88Å; I663-G665 PolarHBondContact O-N 2.91Å; I663-S667 WeakPolarHBondContact CD1-O 3.45Å; I663-D674 HydrophobicContact CB-CB 4.4Å; I663-D674 HydrophobicContact CD1-CB 4.21Å; I663-D674 HydrophobicContact CG2-CB 3.93Å; I663-D674 WeakPolarHBondContact CG2-O 3.16Å; I663-D680 HydrophobicContact CD1-CB 3.48Å; I663-D680 VanDerWaalsContact CD1-CB 3.48Å
664	P	72.4	Confident	63.3	Low	61 Å²	61	58.3 Å²	58.3	40%	0.396	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54	139.1	169.3	-23.4	35.4	0	0	0	110.8	N666 S667	P664-N666 WeakPolarHBondContact CB-OD1 3.08Å; P664-N666 PolarHBondContact O-N 2.89Å; P664-S667 WeakPolarHBondContact O-CA 3.4Å; P664-S667 VanDerWaalsContact O-CB 3.26Å; P664-S667 WeakPolarHBondContact O-CB 3.35Å; P664-S667 PolarHBondContact O-N 3.43Å
665	G	62.2	Low	62.9	Low	33 Å²	33	54 Å²	54	34%	0.34	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-15.7	-178.2	0	0	0	0	0	114.2	A653 I663	A653-G665 WeakPolarHBondContact O-CA 3.41Å; A653-G665 PolarHBondContact O-N 3.36Å; I663-G665 PolarHBondContact O-N 2.91Å
666	N	65.4	Low	62.5	Low	128 Å²	128	56.7 Å²	56.7	68%	0.684	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-10	172.3	62.5	-65.1	0	0	0	114	P664 Q668	P664-N666 WeakPolarHBondContact CB-OD1 3.08Å; P664-N666 PolarHBondContact O-N 2.89Å; N666-Q668 VanDerWaalsContact C-N 3.29Å
667	S	63.4	Low	61.7	Low	11 Å²	11	56.3 Å²	56.3	8%	0.077	34%	0.342	C	S	.	.	S	Bend	trans	-89.3	3.5	172.2	-74.1	0	0	0	0	112.4	I663 P664 D670 D674	I663-S667 WeakPolarHBondContact CD1-O 3.45Å; P664-S667 WeakPolarHBondContact O-CA 3.4Å; P664-S667 VanDerWaalsContact O-CB 3.26Å; P664-S667 WeakPolarHBondContact O-CB 3.35Å; P664-S667 PolarHBondContact O-N 3.43Å; S667-D670 WeakPolarHBondContact CA-OD2 3.33Å; S667-D674 WeakPolarHBondContact CB-OD2 3.5Å; S667-D674 PolarHBondContact OG-OD2 3.18Å
668	Q	61.3	Low	61.4	Low	77 Å²	77	56.7 Å²	56.7	36%	0.36	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	120.7	172.5	-168.5	-174.3	4.3	0	0	108.1	F655 N666	F655-Q668 HydrophobicContact CB-CB 4.1Å; F655-Q668 HydrophobicContact CB-CG 4.42Å; F655-Q668 HydrophobicContact CD1-CB 4.46Å; F655-Q668 HydrophobicContact CD1-CG 4.16Å; F655-Q668 HydrophobicContact CD2-CB 4.45Å; F655-Q668 HydrophobicContact CD2-CG 3.86Å; F655-Q668 VanDerWaalsContact CD2-NE2 3.31Å; F655-Q668 VanDerWaalsContact CD2-OE1 3.29Å; F655-Q668 HydrophobicContact CE1-CG 4.39Å; F655-Q668 VanDerWaalsContact CE2-CD 3.47Å; F655-Q668 HydrophobicContact CE2-CG 4.13Å; F655-Q668 HydrophobicContact CG-CB 4.08Å; F655-Q668 HydrophobicContact CG-CG 3.87Å; F655-Q668 HydrophobicContact CZ-CG 4.36Å; N666-Q668 VanDerWaalsContact C-N 3.29Å
669	C	60.1	Low	61.4	Low	37 Å²	37	50.4 Å²	50.4	25%	0.25	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	65	35.7	178.8	-48.8	0	0	0	0	114.2	D680 E681 C684	C669-D680 PolarHBondContact N-O 3.42Å; C669-E681 VanDerWaalsContact C-OE1 3.23Å; C669-E681 WeakPolarHBondContact CA-OE1 3.48Å; C669-E681 PolarHBondContact N-OE1 3.24Å; C669-C684 WeakPolarHBondContact CA-SG 3.38Å; C669-C684 HydrophobicContact CB-CB 3.55Å; C669-C684 WeakPolarHBondContact CB-SG 3.39Å; C669-C684 WeakPolarHBondContact SG-CA 3.45Å; C669-C684 WeakPolarHBondContact SG-CB 3.35Å; C669-C684 CovalentContact SG-SG 2.01Å; C669-C684 PolarHBondContact SG-SG 3.18Å
670	D	55.3	Low	61.8	Low	79 Å²	79	46.4 Å²	46.4	42%	0.422	29%	0.292	S	S	.	.	S	Bend	trans	-98.9	-1.1	178.1	75.3	-12.8	0	0	0	113	S667 A672 E681	S667-D670 WeakPolarHBondContact CA-OD2 3.33Å; D670-A672 VanDerWaalsContact C-N 3.29Å; D670-A672 WeakPolarHBondContact OD1-CB 3.38Å; D670-A672 PolarHBondContact OD1-N 3.26Å; D670-E681 PolarHBondContact N-OE1 3.05Å
671	G	51.2	Low	62	Low	21 Å²	21	47.6 Å²	47.6	22%	0.216	29%	0.292	C	S	.	.	S	Bend	trans	81.9	3.6	-179.7	0	0	0	0	0	113.7	E681 F1045	G671-E681 PolarHBondContact N-OE1 2.96Å; G671-F1045 WeakPolarHBondContact O-CB 3.32Å; G671-F1045 VanDerWaalsContact O-CG 3.27Å; G671-F1045 WeakPolarHBondContact O-CG 3.41Å
672	A	53.4	Low	61.3	Low	37 Å²	37	49 Å²	49	31%	0.306	30%	0.304	S	S	.	.	S	Bend	trans	-98.3	143.8	171.8	0	0	0	0	0	110.3	D670 D674 E681	D670-A672 VanDerWaalsContact C-N 3.29Å; D670-A672 WeakPolarHBondContact OD1-CB 3.38Å; D670-A672 PolarHBondContact OD1-N 3.26Å; A672-D674 VanDerWaalsContact C-N 3.29Å; A672-D674 PolarHBondContact O-N 2.77Å; A672-D674 VanDerWaalsContact O-N 3.1Å; A672-E681 WeakPolarHBondContact O-CG 3.28Å
673	L	56.1	Low	60.5	Low	108 Å²	108	50.2 Å²	50.2	57%	0.565	31%	0.306	S	S	*	.			trans	-82.7	79.6	170.9	-89.3	163.1	0	0	0	108.6
674	D	62.2	Low	59.5	Low	70 Å²	70	50.6 Å²	50.6	37%	0.374	31%	0.309	S	S	.	.			trans	-87.8	-27.6	178	-72.9	-26.3	0	0	0	111.3	I663 S667 A672 D680	I663-D674 HydrophobicContact CB-CB 4.4Å; I663-D674 HydrophobicContact CD1-CB 4.21Å; I663-D674 HydrophobicContact CG2-CB 3.93Å; I663-D674 WeakPolarHBondContact CG2-O 3.16Å; S667-D674 WeakPolarHBondContact CB-OD2 3.5Å; S667-D674 PolarHBondContact OG-OD2 3.18Å; A672-D674 VanDerWaalsContact C-N 3.29Å; A672-D674 PolarHBondContact O-N 2.77Å; A672-D674 VanDerWaalsContact O-N 3.1Å; D674-D680 VanDerWaalsContact CA-OD2 3.32Å; D674-D680 WeakPolarHBondContact CA-OD2 3.47Å; D674-D680 WeakPolarHBondContact CB-OD2 3.4Å; D674-D680 PolarHBondContact N-OD2 2.96Å
675	C	64.6	Low	58.6	Low	3 Å²	3	48.9 Å²	48.9	2%	0.02	30%	0.298	C	S	.	.	S	Bend	trans	-82.7	134.5	167.3	-73.5	0	0	0	0	112.2	C657 D677 G678 D680	C657-C675 VanDerWaalsContact CA-SG 3.58Å; C657-C675 HydrophobicContact CB-CB 3.7Å; C657-C675 WeakPolarHBondContact CB-SG 3.32Å; C657-C675 WeakPolarHBondContact SG-CA 3.42Å; C657-C675 WeakPolarHBondContact SG-CB 3.35Å; C657-C675 CovalentContact SG-SG 2.01Å; C657-C675 PolarHBondContact SG-SG 2.7Å; C675-D677 WeakPolarHBondContact CB-OD1 3.2Å; C675-D677 PolarHBondContact O-N 2.82Å; C675-G678 PolarHBondContact O-N 3.29Å; C675-D680 HydrophobicContact CB-CB 4.12Å; C675-D680 WeakPolarHBondContact CB-OD1 3.32Å; C675-D680 PolarHBondContact N-OD2 3.13Å; C675-D680 VanDerWaalsContact SG-CB 3.56Å; C675-D680 PolarHBondContact SG-N 3.31Å
676	P	59.1	Low	58.1	Low	105 Å²	105	51.7 Å²	51.7	68%	0.682	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-26.2	176.8	-23	31.6	0	0	0	114.6	A661	A661-P676 HydrophobicContact CB-CG 4.1Å
677	D	53.4	Low	57.7	Low	60 Å²	60	46.6 Å²	46.6	32%	0.321	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-1.9	177.2	50.1	-28	0	0	0	114.8	C657 Q658 T659 C675 S679	C657-D677 WeakPolarHBondContact CB-OD1 3.48Å; Q658-D677 WeakPolarHBondContact CA-OD2 3.48Å; Q658-D677 VanDerWaalsContact CB-OD2 3.27Å; Q658-D677 WeakPolarHBondContact CB-OD2 3.48Å; Q658-D677 PolarHBondContact N-OD2 2.92Å; T659-D677 HydrophobicContact CG2-CB 3.37Å; T659-D677 PolarHBondContact N-OD2 2.91Å; T659-D677 VanDerWaalsContact OG1-CG 3.23Å; T659-D677 PolarHBondContact OG1-OD1 2.89Å; C675-D677 WeakPolarHBondContact CB-OD1 3.2Å; C675-D677 PolarHBondContact O-N 2.82Å; D677-S679 PolarHBondContact O-N 3.01Å; D677-S679 WeakPolarHBondContact OD2-CB 3.41Å; D677-S679 PolarHBondContact OD2-OG 3.48Å
678	G	59.4	Low	57.3	Low	10 Å²	10	51 Å²	51	10%	0.103	29%	0.293	C	S	.	.	S	Bend	trans	64.7	24.7	-173.8	0	0	0	0	0	114.7	C675 D680 E681 A682	C675-G678 PolarHBondContact O-N 3.29Å; G678-D680 VanDerWaalsContact C-N 3.26Å; G678-D680 VanDerWaalsContact CA-OD1 3.24Å; G678-D680 WeakPolarHBondContact CA-OD1 3.23Å; G678-D680 PolarHBondContact O-N 3.5Å; G678-E681 PolarHBondContact O-N 3.25Å; G678-A682 WeakPolarHBondContact O-CB 3.22Å; G678-A682 PolarHBondContact O-N 2.8Å; G678-A682 VanDerWaalsContact O-N 3.07Å
679	S	62.2	Low	57	Low	7 Å²	7	50.4 Å²	50.4	5%	0.049	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-26.8	178.8	-84.7	0	0	0	0	114.2	Q658 D677 E681	Q658-S679 WeakPolarHBondContact CB-OG 3.47Å; Q658-S679 WeakPolarHBondContact CG-OG 3.32Å; Q658-S679 PolarHBondContact N-OG 3.06Å; D677-S679 PolarHBondContact O-N 3.01Å; D677-S679 WeakPolarHBondContact OD2-CB 3.41Å; D677-S679 PolarHBondContact OD2-OG 3.48Å; S679-E681 PolarHBondContact O-N 2.94Å
680	D	62.1	Low	56.6	Low	1 Å²	1	53.2 Å²	53.2	1%	0.005	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-34.1	170	50	-13.3	0	0	0	113	F655 I663 C669 D674 C675 G678 C684	F655-D680 HydrophobicContact CD1-CB 4.38Å; F655-D680 HydrophobicContact CE1-CB 4.23Å; I663-D680 HydrophobicContact CD1-CB 3.48Å; I663-D680 VanDerWaalsContact CD1-CB 3.48Å; C669-D680 PolarHBondContact N-O 3.42Å; D674-D680 VanDerWaalsContact CA-OD2 3.32Å; D674-D680 WeakPolarHBondContact CA-OD2 3.47Å; D674-D680 WeakPolarHBondContact CB-OD2 3.4Å; D674-D680 PolarHBondContact N-OD2 2.96Å; C675-D680 HydrophobicContact CB-CB 4.12Å; C675-D680 WeakPolarHBondContact CB-OD1 3.32Å; C675-D680 PolarHBondContact N-OD2 3.13Å; C675-D680 VanDerWaalsContact SG-CB 3.56Å; C675-D680 PolarHBondContact SG-N 3.31Å; G678-D680 VanDerWaalsContact C-N 3.26Å; G678-D680 VanDerWaalsContact CA-OD1 3.24Å; G678-D680 WeakPolarHBondContact CA-OD1 3.23Å; G678-D680 PolarHBondContact O-N 3.5Å; D680-C684 PolarHBondContact O-SG 3.29Å
681	E	64.1	Low	56.2	Low	48 Å²	48	53.4 Å²	53.4	22%	0.224	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-7.8	-176.5	-67.2	-60.4	138.3	0	0	113.6	C669 D670 G671 A672 G678 S679	C669-E681 VanDerWaalsContact C-OE1 3.23Å; C669-E681 WeakPolarHBondContact CA-OE1 3.48Å; C669-E681 PolarHBondContact N-OE1 3.24Å; D670-E681 PolarHBondContact N-OE1 3.05Å; G671-E681 PolarHBondContact N-OE1 2.96Å; A672-E681 WeakPolarHBondContact O-CG 3.28Å; G678-E681 PolarHBondContact O-N 3.25Å; S679-E681 PolarHBondContact O-N 2.94Å
682	A	52.5	Low	56.3	Low	65 Å²	65	55.3 Å²	55.3	54%	0.537	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-23.3	-169.7	0	0	0	0	0	115.1	G678	G678-A682 WeakPolarHBondContact O-CB 3.22Å; G678-A682 PolarHBondContact O-N 2.8Å; G678-A682 VanDerWaalsContact O-N 3.07Å
683	D	55.6	Low	56.7	Low	84 Å²	84	61.4 Å²	61.4	45%	0.449	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.9	37.6	-172.4	-157.5	17	0	0	0	112.5	V685 K686	D683-V685 VanDerWaalsContact C-N 3.35Å; D683-K686 WeakPolarHBondContact OD1-CE 3.3Å; D683-K686 IonicContact OD1-NZ 3.95Å; D683-K686 WeakPolarHBondContact OD2-CE 3.41Å; D683-K686 IonicContact OD2-NZ 2.83Å; D683-K686 PolarHBondContact OD2-NZ 2.92Å
684	C	54.2	Low	57.3	Low	17 Å²	17	57.5 Å²	57.5	12%	0.115	33%	0.33	C	S	.	.			trans	-76.8	-18.7	-174.1	-74.3	0	0	0	0	115.7	C669 D680 Q698	C669-C684 WeakPolarHBondContact CA-SG 3.38Å; C669-C684 HydrophobicContact CB-CB 3.55Å; C669-C684 WeakPolarHBondContact CB-SG 3.39Å; C669-C684 WeakPolarHBondContact SG-CA 3.45Å; C669-C684 WeakPolarHBondContact SG-CB 3.35Å; C669-C684 CovalentContact SG-SG 2.01Å; C669-C684 PolarHBondContact SG-SG 3.18Å; D680-C684 PolarHBondContact O-SG 3.29Å; C684-Q698 VanDerWaalsContact O-O 3.14Å
685	V	52.3	Low	57.7	Low	25 Å²	25	54.2 Å²	54.2	15%	0.152	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	100.2	-171.4	174.9	0	0	0	0	107.6	D683 L687 V697 Y722 L757 T759	D683-V685 VanDerWaalsContact C-N 3.35Å; V685-L687 HydrophobicContact CG1-CD1 4.48Å; V685-L687 HydrophobicContact CG1-CG 4.41Å; V685-V697 HydrophobicContact CB-CG1 4.27Å; V685-V697 HydrophobicContact CG1-CG1 3.46Å; V685-V697 VanDerWaalsContact CG1-CG1 3.46Å; V685-V697 HydrophobicContact CG1-CG2 4.36Å; V685-V697 HydrophobicContact CG2-CG1 4.43Å; V685-Y722 PolarHBondContact O-OH 2Å; V685-Y722 VanDerWaalsContact O-OH 3.06Å; V685-L757 HydrophobicContact CG1-CD2 4.2Å; V685-T759 HydrophobicContact CG2-CG2 4.42Å
686	K	52.8	Low	58	Low	92 Å²	92	57.2 Å²	57.2	40%	0.4	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	114	169.1	-67.1	-177.4	179.9	179.7	0	109.8	D683 V697 Q698	D683-K686 WeakPolarHBondContact OD1-CE 3.3Å; D683-K686 IonicContact OD1-NZ 3.95Å; D683-K686 WeakPolarHBondContact OD2-CE 3.41Å; D683-K686 IonicContact OD2-NZ 2.83Å; D683-K686 PolarHBondContact OD2-NZ 2.92Å; K686-V697 WeakPolarHBondContact O-CA 3.13Å; K686-Q698 HydrophobicContact CB-CB 4.14Å; K686-Q698 PolarHBondContact N-O 2.93Å; K686-Q698 PolarHBondContact O-N 3.28Å
687	L	56.8	Low	58.3	Low	21 Å²	21	52.2 Å²	52.2	11%	0.11	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	113.1	174	-77.5	146.7	0	0	0	108.6	V685 L695 R696 V697 T719 Y722 L723	V685-L687 HydrophobicContact CG1-CD1 4.48Å; V685-L687 HydrophobicContact CG1-CG 4.41Å; L687-L695 HydrophobicContact CD2-CD1 3.5Å; L687-L695 VanDerWaalsContact CD2-CD1 3.5Å; L687-L695 HydrophobicContact CD2-CD2 4.07Å; L687-L695 HydrophobicContact CD2-CG 3.92Å; L687-R696 WeakPolarHBondContact CA-O 3.47Å; L687-V697 HydrophobicContact CD2-CG2 3.48Å; L687-V697 VanDerWaalsContact CD2-CG2 3.48Å; L687-V697 HydrophobicContact CG-CG2 4.07Å; L687-T719 HydrophobicContact CD1-CG2 3.74Å; L687-T719 HydrophobicContact CD2-CG2 3.56Å; L687-T719 HydrophobicContact CG-CG2 4.24Å; L687-Y722 HydrophobicContact CB-CD1 4.37Å; L687-Y722 HydrophobicContact CD1-CD1 3.35Å; L687-Y722 HydrophobicContact CD1-CE1 3.8Å; L687-Y722 HydrophobicContact CD1-CG 4.01Å; L687-Y722 HydrophobicContact CG-CD1 4.41Å; L687-L723 HydrophobicContact CB-CD2 3.78Å; L687-L723 HydrophobicContact CB-CG 4.36Å; L687-L723 WeakPolarHBondContact O-CD2 3.44Å
688	Q	54.9	Low	58.7	Low	103 Å²	103	52.1 Å²	52.1	48%	0.481	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	128.2	175	-70.2	-175.4	-0.3	0	0	109.7	R696	Q688-R696 PolarHBondContact N-O 2.92Å; Q688-R696 PolarHBondContact O-N 2.87Å; Q688-R696 VanDerWaalsContact O-N 3.08Å
689	V	55	Low	58.7	Low	66 Å²	66	53.2 Å²	53.2	40%	0.4	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	104.3	169.9	-173.5	0	0	0	0	107	L695 L723	V689-L695 HydrophobicContact CG2-CD1 4.23Å; V689-L723 HydrophobicContact CG2-CD1 3.77Å
690	N	51	Low	58.6	Low	96 Å²	96	55 Å²	55	51%	0.513	31%	0.311	S	S	.	.			trans	-76.5	165.4	176.5	-149.5	-8.6	0	0	0	110.1	S692 R693	N690-S692 PolarHBondContact O-N 2.82Å; N690-R693 PolarHBondContact O-N 2.89Å
691	G	47.5	Very low	58.3	Low	82 Å²	82	60.1 Å²	60.1	85%	0.845	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-8.4	-179.1	0	0	0	0	0	116
692	S	52.4	Low	58	Low	62 Å²	62	61.1 Å²	61.1	43%	0.434	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	7	171.5	52	0	0	0	0	114.9	N690 R694	N690-S692 PolarHBondContact O-N 2.82Å; S692-R694 PolarHBondContact O-N 3.36Å; S692-R694 VanDerWaalsContact O-N 3.12Å
693	R	61.6	Low	58.7	Low	164 Å²	164	61.4 Å²	61.4	62%	0.619	35%	0.353	S	S	*	.			trans	59.1	12.7	180	-58.7	-179.3	178.5	165.6	-1.6	115.8	N690 S772	N690-R693 PolarHBondContact O-N 2.89Å; R693-S772 VanDerWaalsContact CB-OG 3.31Å; R693-S772 WeakPolarHBondContact CB-OG 3.41Å; R693-S772 WeakPolarHBondContact O-CA 3.29Å; R693-S772 WeakPolarHBondContact O-CB 3.38Å; R693-S772 PolarHBondContact O-OG 3.19Å
694	R	70.4	Confident	59.6	Low	27 Å²	27	58 Å²	58	10%	0.102	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-83.9	131.7	178.6	-69.5	167.8	173	-129.3	-16.2	110.7	S692 R696 L733 P734 D739	S692-R694 PolarHBondContact O-N 3.36Å; S692-R694 VanDerWaalsContact O-N 3.12Å; R694-R696 PolarHBondContact O-N 3.44Å; R694-L733 HydrophobicContact CG-CD1 3.97Å; R694-P734 PolarHBondContact NH2-O 3.36Å; R694-D739 IonicContact CZ-OD2 3.72Å; R694-D739 IonicContact NH1-OD1 2.9Å; R694-D739 PolarHBondContact NH1-OD1 3.03Å; R694-D739 IonicContact NH1-OD2 2.55Å; R694-D739 PolarHBondContact NH1-OD2 3.39Å
695	L	69.9	Low	60.5	Low	0 Å²	0	57.4 Å²	57.4	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	119.7	-179.7	-170.7	62.3	0	0	0	110.7	L687 V689 V706 W711 T719 V771 L773	L687-L695 HydrophobicContact CD2-CD1 3.5Å; L687-L695 VanDerWaalsContact CD2-CD1 3.5Å; L687-L695 HydrophobicContact CD2-CD2 4.07Å; L687-L695 HydrophobicContact CD2-CG 3.92Å; V689-L695 HydrophobicContact CG2-CD1 4.23Å; L695-V706 HydrophobicContact CB-CB 4.33Å; L695-V706 HydrophobicContact CB-CG2 4.23Å; L695-V706 HydrophobicContact CD2-CB 4.06Å; L695-V706 HydrophobicContact CD2-CG1 4.32Å; L695-V706 HydrophobicContact CD2-CG2 3.75Å; L695-V706 HydrophobicContact CG-CB 4.3Å; L695-V706 HydrophobicContact CG-CG2 3.77Å; L695-V706 PolarHBondContact O-N 3.18Å; L695-V706 VanDerWaalsContact O-N 3.08Å; L695-W711 HydrophobicContact CD2-CH2 3.49Å; L695-W711 VanDerWaalsContact CD2-CH2 3.49Å; L695-W711 HydrophobicContact CD2-CZ2 4.08Å; L695-W711 HydrophobicContact CD2-CZ3 4.11Å; L695-T719 HydrophobicContact CD1-CG2 4.33Å; L695-T719 HydrophobicContact CD2-CG2 4.16Å; L695-V771 HydrophobicContact CB-CB 4.47Å; L695-V771 VanDerWaalsContact CB-O 3.32Å; L695-V771 WeakPolarHBondContact CB-O 3.23Å; L695-V771 HydrophobicContact CD2-CG1 4.23Å; L695-V771 PolarHBondContact N-O 3.09Å; L695-L773 HydrophobicContact CD1-CD1 3.69Å; L695-L773 HydrophobicContact CD2-CD1 3.59Å; L695-L773 HydrophobicContact CD2-CG 4.22Å; L695-L773 HydrophobicContact CG-CD1 4.16Å
696	R	70.4	Confident	61.7	Low	66 Å²	66	56.2 Å²	56.2	25%	0.249	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	138.9	172	-67.9	-179.2	176.6	173.6	-2.3	110.1	L687 Q688 R694 H704 D739	L687-R696 WeakPolarHBondContact CA-O 3.47Å; Q688-R696 PolarHBondContact N-O 2.92Å; Q688-R696 PolarHBondContact O-N 2.87Å; Q688-R696 VanDerWaalsContact O-N 3.08Å; R694-R696 PolarHBondContact O-N 3.44Å; R696-H704 CarbonylContact C-O 2.85Å; R696-H704 VanDerWaalsContact CA-O 3.24Å; R696-H704 WeakPolarHBondContact CA-O 3.42Å; R696-D739 IonicContact NH2-OD1 3.96Å
697	V	65.6	Low	63	Low	0 Å²	0	51.8 Å²	51.8	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	121.5	171.2	173.9	0	0	0	0	107.7	V685 K686 L687 I699 H704 V706 V743 I745	V685-V697 HydrophobicContact CB-CG1 4.27Å; V685-V697 HydrophobicContact CG1-CG1 3.46Å; V685-V697 VanDerWaalsContact CG1-CG1 3.46Å; V685-V697 HydrophobicContact CG1-CG2 4.36Å; V685-V697 HydrophobicContact CG2-CG1 4.43Å; K686-V697 WeakPolarHBondContact O-CA 3.13Å; L687-V697 HydrophobicContact CD2-CG2 3.48Å; L687-V697 VanDerWaalsContact CD2-CG2 3.48Å; L687-V697 HydrophobicContact CG-CG2 4.07Å; V697-I699 HydrophobicContact CG1-CD1 4.26Å; V697-I699 HydrophobicContact CG1-CG1 3.69Å; V697-H704 PolarHBondContact N-O 2.88Å; V697-H704 WeakPolarHBondContact O-CA 3.34Å; V697-H704 WeakPolarHBondContact O-CB 3.28Å; V697-H704 PolarHBondContact O-N 3.28Å; V697-V706 HydrophobicContact CB-CG2 4.45Å; V697-V706 HydrophobicContact CG2-CG2 3.7Å; V697-V743 HydrophobicContact CB-CG1 4.27Å; V697-I745 HydrophobicContact CG2-CD1 3.69Å
698	Q	62.3	Low	63.9	Low	58 Å²	58	51.6 Å²	51.6	27%	0.271	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	116.1	170.1	-172.8	176.6	-22	0	0	108.2	C684 K686 G700	C684-Q698 VanDerWaalsContact O-O 3.14Å; K686-Q698 HydrophobicContact CB-CB 4.14Å; K686-Q698 PolarHBondContact N-O 2.93Å; K686-Q698 PolarHBondContact O-N 3.28Å; Q698-G700 PolarHBondContact NE2-O 3.36Å
699	I	58.6	Low	64.7	Low	33 Å²	33	49.4 Å²	49.4	17%	0.169	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	116	173.4	-54.5	-177.8	0	0	0	105.8	V697 S701 T702 V743 T759 V761	V697-I699 HydrophobicContact CG1-CD1 4.26Å; V697-I699 HydrophobicContact CG1-CG1 3.69Å; I699-S701 PolarHBondContact O-N 2.86Å; I699-T702 PolarHBondContact N-O 3.17Å; I699-T702 PolarHBondContact O-N 2.96Å; I699-T702 PolarHBondContact O-OG1 3.04Å; I699-V743 HydrophobicContact CD1-CG2 3.89Å; I699-T759 HydrophobicContact CD1-CG2 4.28Å; I699-V761 HydrophobicContact CD1-CG2 4.1Å
700	G	61.2	Low	65.3	Low	44 Å²	44	49.1 Å²	49.1	45%	0.454	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	-120.8	-168.9	0	0	0	0	0	112.3	Q698	Q698-G700 PolarHBondContact NE2-O 3.36Å
701	S	54.9	Low	66.3	Low	110 Å²	110	46.3 Å²	46.3	77%	0.769	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	-2.4	-177.4	51.6	0	0	0	0	114.6	I699	I699-S701 PolarHBondContact O-N 2.86Å
702	T	58.1	Low	67.5	Low	69 Å²	69	45.9 Å²	45.9	42%	0.423	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	128.6	-176.9	45	0	0	0	0	112.1	I699 H704	I699-T702 PolarHBondContact N-O 3.17Å; I699-T702 PolarHBondContact O-N 2.96Å; I699-T702 PolarHBondContact O-OG1 3.04Å; T702-H704 PolarHBondContact O-CD2 2.82Å; T702-H704 PolarHBondContact OG1-NE2 3.08Å
703	P	67.6	Low	68.2	Low	70 Å²	70	47.3 Å²	47.3	46%	0.455	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	122.8	173.3	30.3	-31.7	0	0	0	110.2
704	H	74.4	Confident	68.4	Low	14 Å²	14	44.2 Å²	44.2	7%	0.065	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	139.9	175.1	-61.9	-89.6	0	0	0	110.6	R696 V697 T702 P741 V743	R696-H704 CarbonylContact C-O 2.85Å; R696-H704 VanDerWaalsContact CA-O 3.24Å; R696-H704 WeakPolarHBondContact CA-O 3.42Å; V697-H704 PolarHBondContact N-O 2.88Å; V697-H704 WeakPolarHBondContact O-CA 3.34Å; V697-H704 WeakPolarHBondContact O-CB 3.28Å; V697-H704 PolarHBondContact O-N 3.28Å; T702-H704 PolarHBondContact O-CD2 2.82Å; T702-H704 PolarHBondContact OG1-NE2 3.08Å; H704-P741 CarbonylContact C-O 3.52Å; H704-P741 VanDerWaalsContact CA-O 3.3Å; H704-P741 WeakPolarHBondContact CA-O 3.02Å; H704-P741 VanDerWaalsContact CE1-CG 3.46Å; H704-P741 WeakPolarHBondContact CE1-CG 3.41Å; H704-P741 WeakPolarHBondContact ND1-CB 3.49Å; H704-P741 VanDerWaalsContact ND1-CG 3.25Å; H704-P741 WeakPolarHBondContact ND1-CG 3.25Å; H704-V743 HydrophobicContact CB-CB 3.91Å; H704-V743 HydrophobicContact CB-CG1 3.84Å
705	T	73.9	Confident	68.4	Low	3 Å²	3	43.1 Å²	43.1	2%	0.018	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	134.8	176	-48.8	0	0	0	0	110.3	C707 D739 P741 F742 V743 V770	T705-C707 PolarHBondContact O-N 3Å; T705-D739 VanDerWaalsContact CB-O 3.32Å; T705-D739 WeakPolarHBondContact CB-O 3.26Å; T705-D739 HydrophobicContact CG2-CB 4.13Å; T705-D739 PolarHBondContact OG1-O 2.94Å; T705-P741 PolarHBondContact N-O 2.8Å; T705-F742 CarbonylContact O-C 3.46Å; T705-F742 VanDerWaalsContact O-CA 3.25Å; T705-F742 WeakPolarHBondContact O-CA 3.46Å; T705-V743 PolarHBondContact O-N 2.78Å; T705-V770 HydrophobicContact CG2-CB 4.02Å; T705-V770 HydrophobicContact CG2-CG1 3.79Å
706	V	77.4	Confident	68.3	Low	0 Å²	0	43.2 Å²	43.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	121.5	-175.6	-175.4	0	0	0	0	110.9	L695 V697 W711 V743 I745 V770 V771	L695-V706 HydrophobicContact CB-CB 4.33Å; L695-V706 HydrophobicContact CB-CG2 4.23Å; L695-V706 HydrophobicContact CD2-CB 4.06Å; L695-V706 HydrophobicContact CD2-CG1 4.32Å; L695-V706 HydrophobicContact CD2-CG2 3.75Å; L695-V706 HydrophobicContact CG-CB 4.3Å; L695-V706 HydrophobicContact CG-CG2 3.77Å; L695-V706 PolarHBondContact O-N 3.18Å; L695-V706 VanDerWaalsContact O-N 3.08Å; V697-V706 HydrophobicContact CB-CG2 4.45Å; V697-V706 HydrophobicContact CG2-CG2 3.7Å; V706-W711 HydrophobicContact CG1-CE3 3.89Å; V706-W711 HydrophobicContact CG1-CZ3 3.63Å; V706-V743 WeakPolarHBondContact CA-O 3.24Å; V706-V743 HydrophobicContact CB-CG1 4.49Å; V706-V743 HydrophobicContact CG2-CG1 3.94Å; V706-I745 HydrophobicContact CB-CD1 4.47Å; V706-I745 HydrophobicContact CG1-CD1 3.88Å; V706-I745 HydrophobicContact CG1-CG1 4.07Å; V706-I745 HydrophobicContact CG2-CD1 3.68Å; V706-V770 WeakPolarHBondContact O-CA 3.29Å; V706-V771 HydrophobicContact CB-CB 4.4Å; V706-V771 HydrophobicContact CG1-CB 4.31Å; V706-V771 HydrophobicContact CG1-CG2 4.06Å; V706-V771 PolarHBondContact O-N 3.28Å
707	C	79.4	Confident	68	Low	0 Å²	0	42.5 Å²	42.5	0%	0	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-82.2	148.9	175.9	-175.8	0	0	0	0	110.6	T705 N709 F742 V743 Y744 C765 S767	T705-C707 PolarHBondContact O-N 3Å; C707-N709 VanDerWaalsContact C-N 3.29Å; C707-N709 PolarHBondContact O-N 2.89Å; C707-F742 HydrophobicContact CB-CB 4.4Å; C707-V743 PolarHBondContact N-O 3.37Å; C707-Y744 HydrophobicContact CB-CD1 3.93Å; C707-Y744 HydrophobicContact CB-CE1 3.69Å; C707-Y744 WeakPolarHBondContact SG-CE1 3.4Å; C707-C765 HydrophobicContact CB-CB 3.88Å; C707-C765 WeakPolarHBondContact CB-SG 3.5Å; C707-C765 WeakPolarHBondContact SG-CA 3.39Å; C707-C765 WeakPolarHBondContact SG-CB 3.42Å; C707-C765 CovalentContact SG-SG 2.04Å; C707-C765 PolarHBondContact SG-SG 2.87Å; C707-S767 PolarHBondContact SG-OG 2.79Å; C707-S767 VanDerWaalsContact SG-OG 3.38Å
708	S	75.3	Confident	67.9	Low	16 Å²	16	45.9 Å²	45.9	11%	0.112	29%	0.285	C	S	.	.	S	Bend	trans	-73	-11.3	-172.8	68.9	0	0	0	0	115.8	G710 W711 L732 S767 E769	S708-G710 PolarHBondContact O-N 2.75Å; S708-W711 WeakPolarHBondContact O-CB 3.41Å; S708-W711 PolarHBondContact O-N 2.84Å; S708-W711 VanDerWaalsContact O-N 3.17Å; S708-L732 VanDerWaalsContact CB-CD2 3.49Å; S708-S767 VanDerWaalsContact OG-CB 3.22Å; S708-S767 WeakPolarHBondContact OG-CB 3.47Å; S708-S767 PolarHBondContact OG-OG 2.89Å; S708-E769 WeakPolarHBondContact CB-O 3.02Å; S708-E769 PolarHBondContact N-O 2.8Å; S708-E769 PolarHBondContact OG-O 2.91Å
709	N	72.6	Confident	68	Low	58 Å²	58	43.3 Å²	43.3	31%	0.31	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	128	-178.3	-63.8	34.4	0	0	0	111.8	C707 W711 Y744 S766 S767	C707-N709 VanDerWaalsContact C-N 3.29Å; C707-N709 PolarHBondContact O-N 2.89Å; N709-W711 PolarHBondContact O-N 2.8Å; N709-Y744 HydrophobicContact CB-CD1 3.68Å; N709-Y744 HydrophobicContact CB-CE1 3.56Å; N709-S766 PolarHBondContact ND2-OG 3.05Å; N709-S767 WeakPolarHBondContact OD1-CB 3.43Å; N709-S767 PolarHBondContact OD1-N 2.85Å; N709-S767 PolarHBondContact OD1-OG 2.96Å
710	G	66	Low	68.3	Low	60 Å²	60	41.7 Å²	41.7	62%	0.619	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	2.4	178.8	0	0	0	0	0	114	S708 T712 L715	S708-G710 PolarHBondContact O-N 2.75Å; G710-T712 PolarHBondContact O-N 2.82Å; G710-L715 VanDerWaalsContact O-CD1 3.28Å; G710-L715 WeakPolarHBondContact O-CD1 3.48Å
711	W	73.3	Confident	68.1	Low	36 Å²	36	46.8 Å²	46.8	14%	0.136	27%	0.27	C	S	.	.			trans	-71.8	127.7	178.3	-159.7	-90.7	0	0	0	111.3	L695 V706 S708 N709 L715 S716 T719 I745 V771 L773	L695-W711 HydrophobicContact CD2-CH2 3.49Å; L695-W711 VanDerWaalsContact CD2-CH2 3.49Å; L695-W711 HydrophobicContact CD2-CZ2 4.08Å; L695-W711 HydrophobicContact CD2-CZ3 4.11Å; V706-W711 HydrophobicContact CG1-CE3 3.89Å; V706-W711 HydrophobicContact CG1-CZ3 3.63Å; S708-W711 WeakPolarHBondContact O-CB 3.41Å; S708-W711 PolarHBondContact O-N 2.84Å; S708-W711 VanDerWaalsContact O-N 3.17Å; N709-W711 PolarHBondContact O-N 2.8Å; W711-L715 HydrophobicContact CD2-CB 4.17Å; W711-L715 HydrophobicContact CE3-CB 4.4Å; W711-L715 HydrophobicContact CE3-CD1 4.49Å; W711-L715 HydrophobicContact CH2-CB 4.4Å; W711-L715 HydrophobicContact CZ2-CB 4.16Å; W711-L715 HydrophobicContact CZ3-CB 4.5Å; W711-S716 PolarHBondContact NE1-OG 2.76Å; W711-T719 HydrophobicContact CH2-CG2 4.4Å; W711-T719 WeakPolarHBondContact CH2-OG1 3.48Å; W711-I745 HydrophobicContact CZ3-CB 4.15Å; W711-I745 HydrophobicContact CZ3-CD1 4.15Å; W711-V771 HydrophobicContact CB-CG2 4.22Å; W711-V771 HydrophobicContact CD2-CB 4.44Å; W711-V771 HydrophobicContact CD2-CG1 3.91Å; W711-V771 HydrophobicContact CD2-CG2 3.76Å; W711-V771 HydrophobicContact CE3-CG1 4.42Å; W711-V771 HydrophobicContact CE3-CG2 3.95Å; W711-V771 HydrophobicContact CG-CG1 4.33Å; W711-V771 HydrophobicContact CG-CG2 3.87Å; W711-V771 HydrophobicContact CH2-CG1 4.38Å; W711-V771 HydrophobicContact CZ2-CG1 3.87Å; W711-L773 HydrophobicContact CZ2-CD1 4.21Å; W711-L773 HydrophobicContact CZ2-CD2 4.06Å; W711-L773 HydrophobicContact CZ2-CG 4.35Å
712	T	72.1	Confident	68.1	Low	73 Å²	73	45.3 Å²	45.3	45%	0.448	25%	0.248	S	C	.	.			trans	-123.9	162.2	-179.8	60.3	0	0	0	0	110.4	G710 H714 L715 S716	G710-T712 PolarHBondContact O-N 2.82Å; T712-H714 PolarHBondContact O-N 3.39Å; T712-L715 WeakPolarHBondContact O-CB 3.39Å; T712-L715 PolarHBondContact O-N 3.2Å; T712-L715 PolarHBondContact OG1-N 3.27Å; T712-S716 PolarHBondContact O-N 2.83Å; T712-S716 VanDerWaalsContact O-N 3.09Å; T712-S716 PolarHBondContact O-OG 3.22Å
713	S	66.7	Low	68	Low	93 Å²	93	44.5 Å²	44.5	65%	0.65	24%	0.241	S	C	*	.	H	α-helix	trans	-57.6	-32.6	173.7	53.8	0	0	0	0	112.8	L715 S716 D717	S713-L715 VanDerWaalsContact C-N 3.34Å; S713-L715 PolarHBondContact O-N 3.06Å; S713-S716 WeakPolarHBondContact O-CB 3.34Å; S713-S716 PolarHBondContact O-N 2.9Å; S713-D717 PolarHBondContact O-N 3.21Å
714	H	66.1	Low	67.1	Low	98 Å²	98	42.5 Å²	42.5	45%	0.454	23%	0.233	S	C	.	.	H	α-helix	trans	-66.7	-33.7	175	-170.8	-71.8	0	0	0	112.6	T712 F718 R749	T712-H714 PolarHBondContact O-N 3.39Å; H714-F718 VanDerWaalsContact O-CB 3.27Å; H714-F718 WeakPolarHBondContact O-CB 3.2Å; H714-F718 PolarHBondContact O-N 3.23Å; H714-R749 PolarHBondContact NE2-NH2 3.49Å
715	L	70.5	Confident	66.2	Low	5 Å²	5	45.3 Å²	45.3	3%	0.026	25%	0.246	C	C	.	.	H	α-helix	trans	-69.5	-39.2	172.3	-82.2	159.5	0	0	0	111.1	G710 W711 T712 S713 F718 T719 I745 L747 L757	G710-L715 VanDerWaalsContact O-CD1 3.28Å; G710-L715 WeakPolarHBondContact O-CD1 3.48Å; W711-L715 HydrophobicContact CD2-CB 4.17Å; W711-L715 HydrophobicContact CE3-CB 4.4Å; W711-L715 HydrophobicContact CE3-CD1 4.49Å; W711-L715 HydrophobicContact CH2-CB 4.4Å; W711-L715 HydrophobicContact CZ2-CB 4.16Å; W711-L715 HydrophobicContact CZ3-CB 4.5Å; T712-L715 WeakPolarHBondContact O-CB 3.39Å; T712-L715 PolarHBondContact O-N 3.2Å; T712-L715 PolarHBondContact OG1-N 3.27Å; S713-L715 VanDerWaalsContact C-N 3.34Å; S713-L715 PolarHBondContact O-N 3.06Å; L715-F718 PolarHBondContact O-N 3.23Å; L715-T719 VanDerWaalsContact O-CB 3.26Å; L715-T719 WeakPolarHBondContact O-CB 3.29Å; L715-T719 PolarHBondContact O-N 2.85Å; L715-T719 PolarHBondContact O-OG1 2.71Å; L715-I745 HydrophobicContact CD2-CG2 4.12Å; L715-L747 HydrophobicContact CD2-CB 4.4Å; L715-L747 HydrophobicContact CD2-CD1 3.48Å; L715-L747 VanDerWaalsContact CD2-CD1 3.48Å; L715-L747 HydrophobicContact CD2-CG 3.58Å; L715-L747 HydrophobicContact CG-CD1 3.87Å; L715-L747 HydrophobicContact CG-CG 4.37Å; L715-L757 HydrophobicContact CD2-CD1 4.31Å
716	S	68.8	Low	65.4	Low	1 Å²	1	46.8 Å²	46.8	1%	0.007	25%	0.251	C	S	.	.	H	α-helix	trans	-60	-47.5	174.6	-52.3	0	0	0	0	112.3	W711 T712 S713 T719 C720 G728 A730	W711-S716 PolarHBondContact NE1-OG 2.76Å; T712-S716 PolarHBondContact O-N 2.83Å; T712-S716 VanDerWaalsContact O-N 3.09Å; T712-S716 PolarHBondContact O-OG 3.22Å; S713-S716 WeakPolarHBondContact O-CB 3.34Å; S713-S716 PolarHBondContact O-N 2.9Å; S716-T719 PolarHBondContact O-N 2.91Å; S716-C720 WeakPolarHBondContact O-CB 3.5Å; S716-C720 PolarHBondContact O-N 2.92Å; S716-G728 WeakPolarHBondContact CB-O 3.15Å; S716-A730 WeakPolarHBondContact OG-CB 3.36Å
717	D	63.3	Low	64.4	Low	52 Å²	52	47.8 Å²	47.8	28%	0.278	26%	0.258	S	S	.	.	H	α-helix	trans	-64.4	-44.1	177	-87	-14.4	0	0	0	112.2	S713 T719 C720 R721 S727 G728	S713-D717 PolarHBondContact O-N 3.21Å; D717-T719 PolarHBondContact O-N 2.89Å; D717-C720 PolarHBondContact O-N 3.3Å; D717-R721 WeakPolarHBondContact O-CB 3.47Å; D717-R721 VanDerWaalsContact O-CG 3.28Å; D717-R721 WeakPolarHBondContact O-CG 3.39Å; D717-R721 PolarHBondContact O-N 2.91Å; D717-S727 WeakPolarHBondContact OD1-CA 3.31Å; D717-S727 WeakPolarHBondContact OD1-CB 3.2Å; D717-G728 PolarHBondContact OD1-N 2.89Å
718	F	63.3	Low	63.7	Low	71 Å²	71	48.2 Å²	48.2	31%	0.311	26%	0.262	S	S	.	.	H	α-helix	trans	-60.1	-46.1	176.5	179.3	-90.4	0	0	0	111.6	H714 L715 R721 Y722 L747 L757	H714-F718 VanDerWaalsContact O-CB 3.27Å; H714-F718 WeakPolarHBondContact O-CB 3.2Å; H714-F718 PolarHBondContact O-N 3.23Å; L715-F718 PolarHBondContact O-N 3.23Å; F718-R721 PolarHBondContact O-N 2.81Å; F718-Y722 PolarHBondContact O-N 3.15Å; F718-L747 HydrophobicContact CB-CD1 4.1Å; F718-L747 HydrophobicContact CD1-CD1 4.47Å; F718-L747 HydrophobicContact CD1-CD2 4.29Å; F718-L747 HydrophobicContact CD2-CD2 4.31Å; F718-L747 HydrophobicContact CE1-CD2 4.26Å; F718-L747 HydrophobicContact CE2-CD2 4.25Å; F718-L747 HydrophobicContact CG-CD1 4.11Å; F718-L747 HydrophobicContact CG-CD2 4.32Å; F718-L747 HydrophobicContact CZ-CD2 4.23Å; F718-L757 HydrophobicContact CD1-CD1 4.08Å; F718-L757 HydrophobicContact CE1-CD1 3.77Å
719	T	65.2	Low	63.3	Low	3 Å²	3	52.8 Å²	52.8	2%	0.018	29%	0.286	C	S	.	.	H	α-helix	trans	-69.3	-38	-177.1	-51.6	0	0	0	0	111.6	L687 L695 W711 L715 S716 D717 Y722 L723 L773	L687-T719 HydrophobicContact CD1-CG2 3.74Å; L687-T719 HydrophobicContact CD2-CG2 3.56Å; L687-T719 HydrophobicContact CG-CG2 4.24Å; L695-T719 HydrophobicContact CD1-CG2 4.33Å; L695-T719 HydrophobicContact CD2-CG2 4.16Å; W711-T719 HydrophobicContact CH2-CG2 4.4Å; W711-T719 WeakPolarHBondContact CH2-OG1 3.48Å; L715-T719 VanDerWaalsContact O-CB 3.26Å; L715-T719 WeakPolarHBondContact O-CB 3.29Å; L715-T719 PolarHBondContact O-N 2.85Å; L715-T719 PolarHBondContact O-OG1 2.71Å; S716-T719 PolarHBondContact O-N 2.91Å; D717-T719 PolarHBondContact O-N 2.89Å; T719-Y722 WeakPolarHBondContact O-CB 3.33Å; T719-Y722 PolarHBondContact O-N 2.96Å; T719-L723 WeakPolarHBondContact O-CG 3.27Å; T719-L723 PolarHBondContact O-N 3.39Å; T719-L723 VanDerWaalsContact O-N 3.09Å; T719-L773 HydrophobicContact CG2-CD1 3.33Å
720	C	63.6	Low	63.2	Low	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-70.1	-34.3	174.6	-74.9	0	0	0	0	112.7	S716 D717 Y722 L723 G724 H725 G728 C775	S716-C720 WeakPolarHBondContact O-CB 3.5Å; S716-C720 PolarHBondContact O-N 2.92Å; D717-C720 PolarHBondContact O-N 3.3Å; C720-Y722 VanDerWaalsContact C-N 3.33Å; C720-L723 CarbonylContact O-C 3.46Å; C720-L723 PolarHBondContact O-N 3.2Å; C720-L723 VanDerWaalsContact O-N 3.15Å; C720-G724 PolarHBondContact O-N 2.77Å; C720-H725 CarbonylContact C-O 3.54Å; C720-H725 HydrophobicContact CB-CB 4.22Å; C720-H725 CarbonylContact O-C 3.39Å; C720-H725 WeakPolarHBondContact O-CA 3.31Å; C720-H725 WeakPolarHBondContact O-CB 3.2Å; C720-H725 PolarHBondContact O-N 3.47Å; C720-G728 WeakPolarHBondContact SG-CA 3.36Å; C720-C775 VanDerWaalsContact CA-SG 3.52Å; C720-C775 HydrophobicContact CB-CB 3.69Å; C720-C775 WeakPolarHBondContact CB-SG 3.29Å; C720-C775 WeakPolarHBondContact SG-CA 3.35Å; C720-C775 WeakPolarHBondContact SG-CB 3.04Å; C720-C775 CovalentContact SG-SG 2.04Å; C720-C775 PolarHBondContact SG-SG 2.6Å
721	R	58.1	Low	63.7	Low	151 Å²	151	51 Å²	51	57%	0.57	27%	0.27	S	S	*	.	H	α-helix	trans	-60.3	-41.5	169	-74.6	177.8	-169.6	175.2	5.8	112.9	D717 F718 L723 G724 H725 R726	D717-R721 WeakPolarHBondContact O-CB 3.47Å; D717-R721 VanDerWaalsContact O-CG 3.28Å; D717-R721 WeakPolarHBondContact O-CG 3.39Å; D717-R721 PolarHBondContact O-N 2.91Å; F718-R721 PolarHBondContact O-N 2.81Å; R721-L723 VanDerWaalsContact C-N 3.26Å; R721-L723 PolarHBondContact O-N 3.1Å; R721-G724 PolarHBondContact O-N 2.87Å; R721-G724 VanDerWaalsContact O-N 3.09Å; R721-H725 WeakPolarHBondContact CA-O 2.96Å; R721-H725 WeakPolarHBondContact CG-O 3.47Å; R721-H725 PolarHBondContact N-O 3.15Å; R721-R726 PolarHBondContact NE-O 3.03Å
722	Y	55.3	Low	63.9	Low	79 Å²	79	53.5 Å²	53.5	31%	0.31	29%	0.285	S	S	.	.	H	α-helix	trans	-61.8	-36.4	173.9	-169.3	-93	0	0	0	112.4	V685 L687 F718 T719 C720 G724	V685-Y722 PolarHBondContact O-OH 2Å; V685-Y722 VanDerWaalsContact O-OH 3.06Å; L687-Y722 HydrophobicContact CB-CD1 4.37Å; L687-Y722 HydrophobicContact CD1-CD1 3.35Å; L687-Y722 HydrophobicContact CD1-CE1 3.8Å; L687-Y722 HydrophobicContact CD1-CG 4.01Å; L687-Y722 HydrophobicContact CG-CD1 4.41Å; F718-Y722 PolarHBondContact O-N 3.15Å; T719-Y722 WeakPolarHBondContact O-CB 3.33Å; T719-Y722 PolarHBondContact O-N 2.96Å; C720-Y722 VanDerWaalsContact C-N 3.33Å; Y722-G724 PolarHBondContact O-N 3.47Å
723	L	54.7	Low	64	Low	51 Å²	51	52.6 Å²	52.6	27%	0.267	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	6.5	175.4	-66.9	171.1	0	0	0	114.2	L687 V689 T719 C720 R721	L687-L723 HydrophobicContact CB-CD2 3.78Å; L687-L723 HydrophobicContact CB-CG 4.36Å; L687-L723 WeakPolarHBondContact O-CD2 3.44Å; V689-L723 HydrophobicContact CG2-CD1 3.77Å; T719-L723 WeakPolarHBondContact O-CG 3.27Å; T719-L723 PolarHBondContact O-N 3.39Å; T719-L723 VanDerWaalsContact O-N 3.09Å; C720-L723 CarbonylContact O-C 3.46Å; C720-L723 PolarHBondContact O-N 3.2Å; C720-L723 VanDerWaalsContact O-N 3.15Å; R721-L723 VanDerWaalsContact C-N 3.26Å; R721-L723 PolarHBondContact O-N 3.1Å
724	G	48.8	Very low	64.4	Low	28 Å²	28	52.5 Å²	52.5	29%	0.289	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.8	5.4	178.7	0	0	0	0	0	115.4	C720 R721 Y722	C720-G724 PolarHBondContact O-N 2.77Å; R721-G724 PolarHBondContact O-N 2.87Å; R721-G724 VanDerWaalsContact O-N 3.09Å; Y722-G724 PolarHBondContact O-N 3.47Å
725	H	56.6	Low	64.5	Low	73 Å²	73	49.4 Å²	49.4	34%	0.338	27%	0.266	S	S	.	.			trans	-104.9	152.8	178.5	-61.8	-73.1	0	0	0	112	C720 R721 C775 N777	C720-H725 CarbonylContact C-O 3.54Å; C720-H725 HydrophobicContact CB-CB 4.22Å; C720-H725 CarbonylContact O-C 3.39Å; C720-H725 WeakPolarHBondContact O-CA 3.31Å; C720-H725 WeakPolarHBondContact O-CB 3.2Å; C720-H725 PolarHBondContact O-N 3.47Å; R721-H725 WeakPolarHBondContact CA-O 2.96Å; R721-H725 WeakPolarHBondContact CG-O 3.47Å; R721-H725 PolarHBondContact N-O 3.15Å; H725-C775 HydrophobicContact CB-CB 3.64Å; H725-N777 PolarHBondContact ND1-OD1 3.27Å; H725-N777 VanDerWaalsContact ND1-OD1 3.14Å
726	R	55.7	Low	64.6	Low	35 Å²	35	52.7 Å²	52.7	13%	0.132	28%	0.283	C	S	.	.	S	Bend	trans	-86.5	-27.8	-170	-70.1	-171.8	-174.1	155.9	7.5	116.1	R721 T776 Q778 I833	R721-R726 PolarHBondContact NE-O 3.03Å; R726-T776 PolarHBondContact N-O 2.86Å; R726-Q778 HydrophobicContact CB-CB 3.81Å; R726-Q778 HydrophobicContact CB-CG 3.86Å; R726-I833 VanDerWaalsContact NH2-C 3.31Å; R726-I833 PolarHBondContact NH2-O 3.22Å
727	S	57.5	Low	64.4	Low	20 Å²	20	58.8 Å²	58.8	14%	0.14	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	157.1	177.8	47.1	0	0	0	0	110.8	D717 T776 Q778	D717-S727 WeakPolarHBondContact OD1-CA 3.31Å; D717-S727 WeakPolarHBondContact OD1-CB 3.2Å; S727-T776 CarbonylContact C-O 3.56Å; S727-T776 PolarHBondContact N-O 3.44Å; S727-T776 CarbonylContact O-C 3.52Å; S727-T776 PolarHBondContact O-N 3.45Å; S727-T776 PolarHBondContact OG-O 2.78Å; S727-T776 PolarHBondContact OG-OG1 3.41Å; S727-Q778 WeakPolarHBondContact OG-CG 3.47Å
728	G	64.8	Low	64.5	Low	9 Å²	9	63.3 Å²	63.3	9%	0.093	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	133.1	-177.2	0	0	0	0	0	111.4	S716 D717 C720	S716-G728 WeakPolarHBondContact CB-O 3.15Å; D717-G728 PolarHBondContact OD1-N 2.89Å; C720-G728 WeakPolarHBondContact SG-CA 3.36Å
729	D	66.3	Low	64.5	Low	113 Å²	113	60 Å²	60	60%	0.604	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.7	143.8	165.1	-158.5	0.8	0	0	0	109.8	N774	D729-N774 PolarHBondContact N-O 2.91Å; D729-N774 PolarHBondContact O-N 3.17Å
730	A	71.5	Confident	64.3	Low	24 Å²	24	63.1 Å²	63.1	20%	0.198	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	126	179.7	0	0	0	0	0	110	S716 V771 S772 L773	S716-A730 WeakPolarHBondContact OG-CB 3.36Å; A730-V771 HydrophobicContact CB-CG1 3.95Å; A730-S772 CarbonylContact C-O 3.59Å; A730-S772 WeakPolarHBondContact CA-O 3.4Å; A730-L773 HydrophobicContact CB-CD2 4.05Å
731	S	75.2	Confident	64.7	Low	57 Å²	57	65.2 Å²	65.2	40%	0.399	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	145.3	167.3	59.2	0	0	0	0	110	S772	S731-S772 PolarHBondContact N-O 3.43Å; S731-S772 WeakPolarHBondContact O-CA 3.31Å; S731-S772 WeakPolarHBondContact O-CB 3.36Å; S731-S772 PolarHBondContact O-N 2.66Å; S731-S772 WeakPolarHBondContact OG-CB 3.38Å; S731-S772 PolarHBondContact OG-O 2.74Å; S731-S772 PolarHBondContact OG-OG 2.67Å
732	L	77.4	Confident	65.5	Low	88 Å²	88	58.8 Å²	58.8	46%	0.461	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	127.5	-178.8	-57.6	179.4	0	0	0	109.2	S708 E769	S708-L732 VanDerWaalsContact CB-CD2 3.49Å; L732-E769 HydrophobicContact CB-CB 4.38Å; L732-E769 WeakPolarHBondContact CD1-OE2 3.38Å
733	L	75	Confident	66.4	Low	53 Å²	53	55 Å²	55	28%	0.277	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	150.8	178.2	-63.9	178.6	0	0	0	110.2	R694 E769 V770	R694-L733 HydrophobicContact CG-CD1 3.97Å; L733-E769 CarbonylContact O-C 3.6Å; L733-E769 VanDerWaalsContact O-CA 3.26Å; L733-E769 WeakPolarHBondContact O-CA 3.45Å; L733-V770 HydrophobicContact CB-CG2 3.98Å; L733-V770 PolarHBondContact N-O 3.3Å; L733-V770 WeakPolarHBondContact O-CG2 3.46Å; L733-V770 PolarHBondContact O-N 2.85Å
734	P	74.1	Confident	67.3	Low	92 Å²	92	54.9 Å²	54.9	60%	0.597	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.9	136.6	176.9	26.3	-33.3	0	0	0	111.8	R694	R694-P734 PolarHBondContact NH2-O 3.36Å
735	A	69.4	Low	68.3	Low	33 Å²	33	53.8 Å²	53.8	27%	0.273	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-69.7	131.1	177.6	0	0	0	0	0	111.3	F742 G768 V770	A735-F742 HydrophobicContact CB-CE1 4.14Å; A735-F742 HydrophobicContact CB-CZ 4.07Å; A735-G768 WeakPolarHBondContact CB-O 3.46Å; A735-G768 PolarHBondContact N-O 3.16Å; A735-V770 HydrophobicContact CB-CG1 3.93Å
736	L	73.1	Confident	68.6	Low	74 Å²	74	52.6 Å²	52.6	39%	0.387	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-102.6	154.5	175.4	-68.2	160.5	0	0	0	110.2	Q738 D739	L736-Q738 HydrophobicContact CB-CG 3.81Å; L736-Q738 VanDerWaalsContact CD1-NE2 3.33Å; L736-Q738 PolarHBondContact O-N 3.26Å; L736-D739 WeakPolarHBondContact CA-OD2 3.35Å; L736-D739 VanDerWaalsContact CB-OD2 3.32Å; L736-D739 WeakPolarHBondContact CB-OD2 3.13Å; L736-D739 PolarHBondContact N-OD2 3.26Å; L736-D739 WeakPolarHBondContact O-CB 3.37Å; L736-D739 PolarHBondContact O-N 3.48Å
737	P	62.8	Low	68.8	Low	128 Å²	128	53.2 Å²	53.2	83%	0.831	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-57.9	-24.4	177.9	-23.9	33.1	0	0	0	114.2	D739	P737-D739 VanDerWaalsContact C-N 3.3Å
738	Q	65.9	Low	68.6	Low	147 Å²	147	54.8 Å²	54.8	69%	0.687	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-80	-2.8	177.2	66.2	-165.6	6.3	0	0	114.5	L736	L736-Q738 HydrophobicContact CB-CG 3.81Å; L736-Q738 VanDerWaalsContact CD1-NE2 3.33Å; L736-Q738 PolarHBondContact O-N 3.26Å
739	D	64.1	Low	67.7	Low	3 Å²	3	63.4 Å²	63.4	2%	0.016	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-97.2	-4.7	179.1	-58.1	-49.1	0	0	0	113.5	R694 R696 T705 L736 P737 F742	R694-D739 IonicContact CZ-OD2 3.72Å; R694-D739 IonicContact NH1-OD1 2.9Å; R694-D739 PolarHBondContact NH1-OD1 3.03Å; R694-D739 IonicContact NH1-OD2 2.55Å; R694-D739 PolarHBondContact NH1-OD2 3.39Å; R696-D739 IonicContact NH2-OD1 3.96Å; T705-D739 VanDerWaalsContact CB-O 3.32Å; T705-D739 WeakPolarHBondContact CB-O 3.26Å; T705-D739 HydrophobicContact CG2-CB 4.13Å; T705-D739 PolarHBondContact OG1-O 2.94Å; L736-D739 WeakPolarHBondContact CA-OD2 3.35Å; L736-D739 VanDerWaalsContact CB-OD2 3.32Å; L736-D739 WeakPolarHBondContact CB-OD2 3.13Å; L736-D739 PolarHBondContact N-OD2 3.26Å; L736-D739 WeakPolarHBondContact O-CB 3.37Å; L736-D739 PolarHBondContact O-N 3.48Å; P737-D739 VanDerWaalsContact C-N 3.3Å; D739-F742 HydrophobicContact CB-CE1 3.82Å; D739-F742 HydrophobicContact CB-CZ 4.11Å
740	S	60.9	Low	66.6	Low	67 Å²	67	61.3 Å²	61.3	47%	0.469	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-70.1	132.9	170.7	174.7	0	0	0	0	109.5
741	P	71.3	Confident	64.8	Low	45 Å²	45	73 Å²	73	29%	0.292	38%	0.383	S	S	.	.	S	Bend	cis	-87	153	11.5	32	-35.7	0	0	0	115.6	H704 T705	H704-P741 CarbonylContact C-O 3.52Å; H704-P741 VanDerWaalsContact CA-O 3.3Å; H704-P741 WeakPolarHBondContact CA-O 3.02Å; H704-P741 VanDerWaalsContact CE1-CG 3.46Å; H704-P741 WeakPolarHBondContact CE1-CG 3.41Å; H704-P741 WeakPolarHBondContact ND1-CB 3.49Å; H704-P741 VanDerWaalsContact ND1-CG 3.25Å; H704-P741 WeakPolarHBondContact ND1-CG 3.25Å; T705-P741 PolarHBondContact N-O 2.8Å
742	F	75.7	Confident	62.8	Low	16 Å²	16	76.1 Å²	76.1	7%	0.07	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	159.4	-178.3	-60.1	-79.9	0	0	0	113.1	T705 C707 A735 D739 S762 C765 V770	T705-F742 CarbonylContact O-C 3.46Å; T705-F742 VanDerWaalsContact O-CA 3.25Å; T705-F742 WeakPolarHBondContact O-CA 3.46Å; C707-F742 HydrophobicContact CB-CB 4.4Å; A735-F742 HydrophobicContact CB-CE1 4.14Å; A735-F742 HydrophobicContact CB-CZ 4.07Å; D739-F742 HydrophobicContact CB-CE1 3.82Å; D739-F742 HydrophobicContact CB-CZ 4.11Å; F742-S762 CarbonylContact C-O 3.54Å; F742-S762 WeakPolarHBondContact CA-O 3.13Å; F742-S762 WeakPolarHBondContact CB-O 3.45Å; F742-S762 PolarHBondContact N-O 3.41Å; F742-S762 PolarHBondContact O-N 3.33Å; F742-C765 HydrophobicContact CB-CB 4.31Å; F742-C765 HydrophobicContact CD1-CB 3.81Å; F742-C765 HydrophobicContact CD2-CB 3.83Å; F742-C765 HydrophobicContact CE1-CB 4.03Å; F742-C765 HydrophobicContact CE2-CB 4.05Å; F742-C765 HydrophobicContact CG-CB 3.71Å; F742-C765 HydrophobicContact CZ-CB 4.15Å; F742-V770 HydrophobicContact CD1-CG1 4.22Å; F742-V770 HydrophobicContact CE1-CG1 3.74Å
743	V	74.7	Confident	61	Low	0 Å²	0	74.6 Å²	74.6	0%	0	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	142.2	173.9	67.3	0	0	0	0	111.7	V697 I699 H704 T705 V706 C707 N760 V761	V697-V743 HydrophobicContact CB-CG1 4.27Å; I699-V743 HydrophobicContact CD1-CG2 3.89Å; H704-V743 HydrophobicContact CB-CB 3.91Å; H704-V743 HydrophobicContact CB-CG1 3.84Å; T705-V743 PolarHBondContact O-N 2.78Å; V706-V743 WeakPolarHBondContact CA-O 3.24Å; V706-V743 HydrophobicContact CB-CG1 4.49Å; V706-V743 HydrophobicContact CG2-CG1 3.94Å; C707-V743 PolarHBondContact N-O 3.37Å; V743-N760 CarbonylContact C-O 3.55Å; V743-N760 WeakPolarHBondContact CA-O 3.49Å; V743-V761 HydrophobicContact CG2-CG2 4.38Å
744	Y	72.8	Confident	59.2	Low	48 Å²	48	76.6 Å²	76.6	19%	0.188	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	138	171.6	-58.3	-74.3	0	0	0	109.7	C707 N709 T759 N760 S762 T764 S766	C707-Y744 HydrophobicContact CB-CD1 3.93Å; C707-Y744 HydrophobicContact CB-CE1 3.69Å; C707-Y744 WeakPolarHBondContact SG-CE1 3.4Å; N709-Y744 HydrophobicContact CB-CD1 3.68Å; N709-Y744 HydrophobicContact CB-CE1 3.56Å; Y744-T759 CarbonylContact O-C 3.55Å; Y744-T759 WeakPolarHBondContact O-CA 3.3Å; Y744-N760 PolarHBondContact N-O 3.09Å; Y744-N760 PolarHBondContact O-N 2.96Å; Y744-S762 VanDerWaalsContact CE2-CB 3.4Å; Y744-T764 PolarHBondContact OH-O 2.81Å; Y744-T764 VanDerWaalsContact OH-O 3.06Å; Y744-S766 PolarHBondContact OH-N 2.81Å; Y744-S766 PolarHBondContact OH-OG 2.87Å
745	I	68.8	Low	57.9	Low	5 Å²	5	74.1 Å²	74.1	3%	0.026	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	129.9	-176.8	-53.9	-174.6	0	0	0	109.2	V697 V706 W711 L715 L757 E758 T759	V697-I745 HydrophobicContact CG2-CD1 3.69Å; V706-I745 HydrophobicContact CB-CD1 4.47Å; V706-I745 HydrophobicContact CG1-CD1 3.88Å; V706-I745 HydrophobicContact CG1-CG1 4.07Å; V706-I745 HydrophobicContact CG2-CD1 3.68Å; W711-I745 HydrophobicContact CZ3-CB 4.15Å; W711-I745 HydrophobicContact CZ3-CD1 4.15Å; L715-I745 HydrophobicContact CD2-CG2 4.12Å; I745-L757 HydrophobicContact CG2-CD1 3.35Å; I745-L757 HydrophobicContact CG2-CD2 3.9Å; I745-L757 HydrophobicContact CG2-CG 3.58Å; I745-E758 WeakPolarHBondContact CA-O 3.49Å; I745-T759 HydrophobicContact CG1-CG2 4.36Å
746	S	63.5	Low	56.8	Low	48 Å²	48	74.4 Å²	74.4	34%	0.336	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	155	175.8	73.2	0	0	0	0	112	E758	S746-E758 PolarHBondContact N-O 3.2Å; S746-E758 PolarHBondContact O-N 2.82Å
747	L	60.4	Low	56.1	Low	47 Å²	47	73.1 Å²	73.1	25%	0.246	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	119.3	-179.8	-81.6	164.1	0	0	0	110.1	L715 F718 S756 L757	L715-L747 HydrophobicContact CD2-CB 4.4Å; L715-L747 HydrophobicContact CD2-CD1 3.48Å; L715-L747 VanDerWaalsContact CD2-CD1 3.48Å; L715-L747 HydrophobicContact CD2-CG 3.58Å; L715-L747 HydrophobicContact CG-CD1 3.87Å; L715-L747 HydrophobicContact CG-CG 4.37Å; F718-L747 HydrophobicContact CB-CD1 4.1Å; F718-L747 HydrophobicContact CD1-CD1 4.47Å; F718-L747 HydrophobicContact CD1-CD2 4.29Å; F718-L747 HydrophobicContact CD2-CD2 4.31Å; F718-L747 HydrophobicContact CE1-CD2 4.26Å; F718-L747 HydrophobicContact CE2-CD2 4.25Å; F718-L747 HydrophobicContact CG-CD1 4.11Å; F718-L747 HydrophobicContact CG-CD2 4.32Å; F718-L747 HydrophobicContact CZ-CD2 4.23Å; L747-S756 WeakPolarHBondContact CA-O 3.4Å; L747-L757 HydrophobicContact CD2-CD1 3.91Å; L747-L757 HydrophobicContact CG-CD1 4.18Å
748	T	53.1	Low	56.1	Low	54 Å²	54	71.1 Å²	71.1	33%	0.331	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	119.4	171.9	36.6	0	0	0	0	109.8	G755 S756 E758	T748-G755 WeakPolarHBondContact O-CA 3.17Å; T748-S756 PolarHBondContact N-O 2.85Å; T748-S756 PolarHBondContact O-N 3.45Å; T748-S756 PolarHBondContact O-OG 2.8Å; T748-S756 PolarHBondContact OG1-OG 2.94Å; T748-E758 VanDerWaalsContact CG2-OE1 3.29Å; T748-E758 WeakPolarHBondContact CG2-OE1 3.28Å; T748-E758 PolarHBondContact OG1-OE1 2.99Å
749	R	46.6	Very low	56	Low	190 Å²	190	66.3 Å²	66.3	72%	0.717	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.8	119.9	-177.1	-177.5	-177.8	-87.5	171	-3.3	110.5	H714	H714-R749 PolarHBondContact NE2-NH2 3.49Å
750	T	41.4	Very low	56.1	Low	68 Å²	68	71.1 Å²	71.1	42%	0.417	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-81.1	154.6	170.2	62.4	0	0	0	0	111.4	T752 G753 N754	T750-T752 PolarHBondContact O-N 2.82Å; T750-T752 PolarHBondContact OG1-OG1 2.87Å; T750-G753 PolarHBondContact O-N 2.81Å; T750-N754 PolarHBondContact N-O 2.91Å; T750-N754 PolarHBondContact OG1-O 3.27Å
751	R	35.3	Very low	56.5	Low	270 Å²	270	71.9 Å²	71.9	100%	1.019	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-15	-176.8	-99.8	-175.5	-172	177.4	3.5	114.9
752	T	33.2	Very low	56.4	Low	122 Å²	122	71.1 Å²	71.1	75%	0.748	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	0.7	179.6	48.8	0	0	0	0	114	T750	T750-T752 PolarHBondContact O-N 2.82Å; T750-T752 PolarHBondContact OG1-OG1 2.87Å
753	G	38.8	Very low	55.9	Low	56 Å²	56	78.3 Å²	78.3	58%	0.577	42%	0.418	S	S	*	.	S	Bend	trans	92.9	-2.7	177	0	0	0	0	0	115.5	T750	T750-G753 PolarHBondContact O-N 2.81Å
754	N	37.3	Very low	55.5	Low	95 Å²	95	83 Å²	83	51%	0.508	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-83.8	126.4	171.8	-75.1	-0.8	0	0	0	110.3	T750	T750-N754 PolarHBondContact N-O 2.91Å; T750-N754 PolarHBondContact OG1-O 3.27Å
755	G	47.5	Very low	55.5	Low	41 Å²	41	81.6 Å²	81.6	42%	0.423	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	131.8	174.6	0	0	0	0	0	111.5	T748	T748-G755 WeakPolarHBondContact O-CA 3.17Å
756	S	45.8	Very low	55.4	Low	38 Å²	38	85.6 Å²	85.6	27%	0.266	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	140.7	170.4	41.5	0	0	0	0	110.5	L747 T748	L747-S756 WeakPolarHBondContact CA-O 3.4Å; T748-S756 PolarHBondContact N-O 2.85Å; T748-S756 PolarHBondContact O-N 3.45Å; T748-S756 PolarHBondContact O-OG 2.8Å; T748-S756 PolarHBondContact OG1-OG 2.94Å
757	L	58.1	Low	55.5	Low	48 Å²	48	85.4 Å²	85.4	25%	0.251	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	116.1	176.9	-164.5	87.9	0	0	0	109	V685 L715 F718 I745 L747 T759	V685-L757 HydrophobicContact CG1-CD2 4.2Å; L715-L757 HydrophobicContact CD2-CD1 4.31Å; F718-L757 HydrophobicContact CD1-CD1 4.08Å; F718-L757 HydrophobicContact CE1-CD1 3.77Å; I745-L757 HydrophobicContact CG2-CD1 3.35Å; I745-L757 HydrophobicContact CG2-CD2 3.9Å; I745-L757 HydrophobicContact CG2-CG 3.58Å; L747-L757 HydrophobicContact CD2-CD1 3.91Å; L747-L757 HydrophobicContact CG-CD1 4.18Å; L757-T759 HydrophobicContact CD2-CG2 4.24Å
758	E	62.1	Low	56.1	Low	85 Å²	85	85 Å²	85	40%	0.397	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	130.8	174.4	-75.6	172	-150.6	0	0	110.1	I745 S746 T748	I745-E758 WeakPolarHBondContact CA-O 3.49Å; S746-E758 PolarHBondContact N-O 3.2Å; S746-E758 PolarHBondContact O-N 2.82Å; T748-E758 VanDerWaalsContact CG2-OE1 3.29Å; T748-E758 WeakPolarHBondContact CG2-OE1 3.28Å; T748-E758 PolarHBondContact OG1-OE1 2.99Å
759	T	64.4	Low	57.3	Low	46 Å²	46	86.3 Å²	86.3	28%	0.282	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	124.5	-180	52.9	0	0	0	0	110.6	V685 I699 Y744 I745 L757	V685-T759 HydrophobicContact CG2-CG2 4.42Å; I699-T759 HydrophobicContact CD1-CG2 4.28Å; Y744-T759 CarbonylContact O-C 3.55Å; Y744-T759 WeakPolarHBondContact O-CA 3.3Å; I745-T759 HydrophobicContact CG1-CG2 4.36Å; L757-T759 HydrophobicContact CD2-CG2 4.24Å
760	N	67.4	Low	58.9	Low	104 Å²	104	77.2 Å²	77.2	56%	0.556	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	114.4	177.8	-84.7	-42.6	0	0	0	110.5	V743 Y744	V743-N760 CarbonylContact C-O 3.55Å; V743-N760 WeakPolarHBondContact CA-O 3.49Å; Y744-N760 PolarHBondContact N-O 3.09Å; Y744-N760 PolarHBondContact O-N 2.96Å
761	V	68.8	Low	60.7	Low	83 Å²	83	74 Å²	74	50%	0.503	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	138.6	-178.2	-177	0	0	0	0	110.7	I699 V743	I699-V761 HydrophobicContact CD1-CG2 4.1Å; V743-V761 HydrophobicContact CG2-CG2 4.38Å
762	S	68.7	Low	62.7	Low	30 Å²	30	61.3 Å²	61.3	21%	0.21	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	140.6	176.9	177.6	0	0	0	0	111.5	F742 Y744 T764	F742-S762 CarbonylContact C-O 3.54Å; F742-S762 WeakPolarHBondContact CA-O 3.13Å; F742-S762 WeakPolarHBondContact CB-O 3.45Å; F742-S762 PolarHBondContact N-O 3.41Å; F742-S762 PolarHBondContact O-N 3.33Å; Y744-S762 VanDerWaalsContact CE2-CB 3.4Å; S762-T764 PolarHBondContact O-N 2.9Å; S762-T764 PolarHBondContact OG-N 3Å; S762-T764 PolarHBondContact OG-O 2.93Å
763	E	65.5	Low	64.5	Low	167 Å²	167	56 Å²	56	78%	0.78	35%	0.346	S	S	*	.	S	Bend	trans	-71.3	-19.5	174.5	-64.8	-168.4	166.4	0	0	112.7
764	T	66.8	Low	65.8	Low	99 Å²	99	57.7 Å²	57.7	61%	0.607	34%	0.342	S	S	*	.	S	Bend	trans	-130.1	137.6	-179.5	57.7	0	0	0	0	111.8	Y744 S762	Y744-T764 PolarHBondContact OH-O 2.81Å; Y744-T764 VanDerWaalsContact OH-O 3.06Å; S762-T764 PolarHBondContact O-N 2.9Å; S762-T764 PolarHBondContact OG-N 3Å; S762-T764 PolarHBondContact OG-O 2.93Å
765	C	71.4	Confident	67	Low	18 Å²	18	54.5 Å²	54.5	12%	0.122	33%	0.327	C	S	.	.			trans	-94.2	108.9	173.5	178	0	0	0	0	108.8	C707 F742 S767 G768 E769	C707-C765 HydrophobicContact CB-CB 3.88Å; C707-C765 WeakPolarHBondContact CB-SG 3.5Å; C707-C765 WeakPolarHBondContact SG-CA 3.39Å; C707-C765 WeakPolarHBondContact SG-CB 3.42Å; C707-C765 CovalentContact SG-SG 2.04Å; C707-C765 PolarHBondContact SG-SG 2.87Å; F742-C765 HydrophobicContact CB-CB 4.31Å; F742-C765 HydrophobicContact CD1-CB 3.81Å; F742-C765 HydrophobicContact CD2-CB 3.83Å; F742-C765 HydrophobicContact CE1-CB 4.03Å; F742-C765 HydrophobicContact CE2-CB 4.05Å; F742-C765 HydrophobicContact CG-CB 3.71Å; F742-C765 HydrophobicContact CZ-CB 4.15Å; C765-S767 VanDerWaalsContact C-N 3.29Å; C765-S767 PolarHBondContact O-N 2.85Å; C765-S767 PolarHBondContact SG-OG 2.91Å; C765-G768 PolarHBondContact O-N 2.96Å; C765-E769 PolarHBondContact SG-O 3.27Å
766	S	67.1	Low	67.5	Low	89 Å²	89	55.8 Å²	55.8	62%	0.622	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-18.9	-172.8	47.7	0	0	0	0	114.3	N709 Y744	N709-S766 PolarHBondContact ND2-OG 3.05Å; Y744-S766 PolarHBondContact OH-N 2.81Å; Y744-S766 PolarHBondContact OH-OG 2.87Å
767	S	66.7	Low	68	Low	44 Å²	44	58.8 Å²	58.8	31%	0.308	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-17.1	171.6	56.1	0	0	0	0	114.6	C707 S708 N709 C765 E769	C707-S767 PolarHBondContact SG-OG 2.79Å; C707-S767 VanDerWaalsContact SG-OG 3.38Å; S708-S767 VanDerWaalsContact OG-CB 3.22Å; S708-S767 WeakPolarHBondContact OG-CB 3.47Å; S708-S767 PolarHBondContact OG-OG 2.89Å; N709-S767 WeakPolarHBondContact OD1-CB 3.43Å; N709-S767 PolarHBondContact OD1-N 2.85Å; N709-S767 PolarHBondContact OD1-OG 2.96Å; C765-S767 VanDerWaalsContact C-N 3.29Å; C765-S767 PolarHBondContact O-N 2.85Å; C765-S767 PolarHBondContact SG-OG 2.91Å; S767-E769 PolarHBondContact O-N 3.27Å; S767-E769 PolarHBondContact OG-N 2.89Å; S767-E769 PolarHBondContact OG-O 2.95Å
768	G	72.4	Confident	67.9	Low	38 Å²	38	59.8 Å²	59.8	39%	0.392	34%	0.343	S	S	.	.	S	Bend	trans	69	7.1	-172.5	0	0	0	0	0	115	A735 C765	A735-G768 WeakPolarHBondContact CB-O 3.46Å; A735-G768 PolarHBondContact N-O 3.16Å; C765-G768 PolarHBondContact O-N 2.96Å
769	E	79	Confident	67.8	Low	81 Å²	81	59.8 Å²	59.8	38%	0.379	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	138.3	-175.8	-65.2	179	151.8	0	0	111.5	S708 L732 L733 C765 S767	S708-E769 WeakPolarHBondContact CB-O 3.02Å; S708-E769 PolarHBondContact N-O 2.8Å; S708-E769 PolarHBondContact OG-O 2.91Å; L732-E769 HydrophobicContact CB-CB 4.38Å; L732-E769 WeakPolarHBondContact CD1-OE2 3.38Å; L733-E769 CarbonylContact O-C 3.6Å; L733-E769 VanDerWaalsContact O-CA 3.26Å; L733-E769 WeakPolarHBondContact O-CA 3.45Å; C765-E769 PolarHBondContact SG-O 3.27Å; S767-E769 PolarHBondContact O-N 3.27Å; S767-E769 PolarHBondContact OG-N 2.89Å; S767-E769 PolarHBondContact OG-O 2.95Å
770	V	80.3	Confident	68.2	Low	0 Å²	0	58.4 Å²	58.4	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	149.6	177.1	-62.5	0	0	0	0	111.2	T705 V706 L733 A735 F742	T705-V770 HydrophobicContact CG2-CB 4.02Å; T705-V770 HydrophobicContact CG2-CG1 3.79Å; V706-V770 WeakPolarHBondContact O-CA 3.29Å; L733-V770 HydrophobicContact CB-CG2 3.98Å; L733-V770 PolarHBondContact N-O 3.3Å; L733-V770 WeakPolarHBondContact O-CG2 3.46Å; L733-V770 PolarHBondContact O-N 2.85Å; A735-V770 HydrophobicContact CB-CG1 3.93Å; F742-V770 HydrophobicContact CD1-CG1 4.22Å; F742-V770 HydrophobicContact CE1-CG1 3.74Å
771	V	77.6	Confident	68.2	Low	0 Å²	0	53.4 Å²	53.4	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	130	-177.6	-179.8	0	0	0	0	110.7	L695 V706 W711 A730 L773	L695-V771 HydrophobicContact CB-CB 4.47Å; L695-V771 VanDerWaalsContact CB-O 3.32Å; L695-V771 WeakPolarHBondContact CB-O 3.23Å; L695-V771 HydrophobicContact CD2-CG1 4.23Å; L695-V771 PolarHBondContact N-O 3.09Å; V706-V771 HydrophobicContact CB-CB 4.4Å; V706-V771 HydrophobicContact CG1-CB 4.31Å; V706-V771 HydrophobicContact CG1-CG2 4.06Å; V706-V771 PolarHBondContact O-N 3.28Å; W711-V771 HydrophobicContact CB-CG2 4.22Å; W711-V771 HydrophobicContact CD2-CB 4.44Å; W711-V771 HydrophobicContact CD2-CG1 3.91Å; W711-V771 HydrophobicContact CD2-CG2 3.76Å; W711-V771 HydrophobicContact CE3-CG1 4.42Å; W711-V771 HydrophobicContact CE3-CG2 3.95Å; W711-V771 HydrophobicContact CG-CG1 4.33Å; W711-V771 HydrophobicContact CG-CG2 3.87Å; W711-V771 HydrophobicContact CH2-CG1 4.38Å; W711-V771 HydrophobicContact CZ2-CG1 3.87Å; A730-V771 HydrophobicContact CB-CG1 3.95Å; V771-L773 HydrophobicContact CG1-CG 4.34Å
772	S	77.3	Confident	68.5	Low	4 Å²	4	55.9 Å²	55.9	3%	0.028	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	113.7	170.5	176.4	0	0	0	0	110	R693 A730 S731	R693-S772 VanDerWaalsContact CB-OG 3.31Å; R693-S772 WeakPolarHBondContact CB-OG 3.41Å; R693-S772 WeakPolarHBondContact O-CA 3.29Å; R693-S772 WeakPolarHBondContact O-CB 3.38Å; R693-S772 PolarHBondContact O-OG 3.19Å; A730-S772 CarbonylContact C-O 3.59Å; A730-S772 WeakPolarHBondContact CA-O 3.4Å; S731-S772 PolarHBondContact N-O 3.43Å; S731-S772 WeakPolarHBondContact O-CA 3.31Å; S731-S772 WeakPolarHBondContact O-CB 3.36Å; S731-S772 PolarHBondContact O-N 2.66Å; S731-S772 WeakPolarHBondContact OG-CB 3.38Å; S731-S772 PolarHBondContact OG-O 2.74Å; S731-S772 PolarHBondContact OG-OG 2.67Å
773	L	71.1	Confident	68.9	Low	10 Å²	10	58.5 Å²	58.5	5%	0.052	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	130	-178.3	-80	170.7	0	0	0	111.8	L695 W711 T719 A730 V771	L695-L773 HydrophobicContact CD1-CD1 3.69Å; L695-L773 HydrophobicContact CD2-CD1 3.59Å; L695-L773 HydrophobicContact CD2-CG 4.22Å; L695-L773 HydrophobicContact CG-CD1 4.16Å; W711-L773 HydrophobicContact CZ2-CD1 4.21Å; W711-L773 HydrophobicContact CZ2-CD2 4.06Å; W711-L773 HydrophobicContact CZ2-CG 4.35Å; T719-L773 HydrophobicContact CG2-CD1 3.33Å; A730-L773 HydrophobicContact CB-CD2 4.05Å; V771-L773 HydrophobicContact CG1-CG 4.34Å
774	N	66.3	Low	68.9	Low	91 Å²	91	56.1 Å²	56.1	49%	0.487	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	92.2	165.9	-168.4	12.4	0	0	0	108.4	D729	D729-N774 PolarHBondContact N-O 2.91Å; D729-N774 PolarHBondContact O-N 3.17Å
775	C	62.5	Low	68.8	Low	29 Å²	29	52.9 Å²	52.9	20%	0.196	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	126.9	178.4	-59.6	0	0	0	0	110.2	C720 H725	C720-C775 VanDerWaalsContact CA-SG 3.52Å; C720-C775 HydrophobicContact CB-CB 3.69Å; C720-C775 WeakPolarHBondContact CB-SG 3.29Å; C720-C775 WeakPolarHBondContact SG-CA 3.35Å; C720-C775 WeakPolarHBondContact SG-CB 3.04Å; C720-C775 CovalentContact SG-SG 2.04Å; C720-C775 PolarHBondContact SG-SG 2.6Å; H725-C775 HydrophobicContact CB-CB 3.64Å
776	T	58	Low	67.8	Low	68 Å²	68	58.3 Å²	58.3	42%	0.417	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	141	175.6	52.6	0	0	0	0	109.1	R726 S727 Q778	R726-T776 PolarHBondContact N-O 2.86Å; S727-T776 CarbonylContact C-O 3.56Å; S727-T776 PolarHBondContact N-O 3.44Å; S727-T776 CarbonylContact O-C 3.52Å; S727-T776 PolarHBondContact O-N 3.45Å; S727-T776 PolarHBondContact OG-O 2.78Å; S727-T776 PolarHBondContact OG-OG1 3.41Å; T776-Q778 PolarHBondContact O-N 3.29Å
777	N	56.4	Low	66.9	Low	100 Å²	100	60.1 Å²	60.1	54%	0.535	32%	0.316	S	S	.	.			trans	-75	117.2	163.9	-69.5	-16.4	0	0	0	106.2	H725	H725-N777 PolarHBondContact ND1-OD1 3.27Å; H725-N777 VanDerWaalsContact ND1-OD1 3.14Å
778	Q	56.3	Low	65.5	Low	69 Å²	69	65 Å²	65	32%	0.322	34%	0.339	S	S	.	.			trans	-42.2	149.5	166	-81.4	-170.7	-25.8	0	0	110.4	R726 S727 T776 C780	R726-Q778 HydrophobicContact CB-CB 3.81Å; R726-Q778 HydrophobicContact CB-CG 3.86Å; S727-Q778 WeakPolarHBondContact OG-CG 3.47Å; T776-Q778 PolarHBondContact O-N 3.29Å; Q778-C780 PolarHBondContact O-N 2.76Å
779	P	60.9	Low	64	Low	86 Å²	86	72 Å²	72	56%	0.558	36%	0.361	S	S	*	.			trans	-53	111.8	-179	22.7	-33.4	0	0	0	110
780	C	71.5	Confident	61.8	Low	16 Å²	16	72.7 Å²	72.7	11%	0.108	38%	0.375	C	S	.	.			trans	-108.4	162.1	173	53.4	0	0	0	0	108.5	Q778 R782 C914 H1000	Q778-C780 PolarHBondContact O-N 2.76Å; C780-R782 PolarHBondContact O-N 2.95Å; C780-R782 VanDerWaalsContact O-N 3.16Å; C780-C914 HydrophobicContact CB-CB 4.09Å; C780-C914 WeakPolarHBondContact CB-SG 3.38Å; C780-C914 PolarHBondContact O-SG 2.81Å; C780-C914 WeakPolarHBondContact SG-CA 2.98Å; C780-C914 WeakPolarHBondContact SG-CB 3.44Å; C780-C914 CovalentContact SG-SG 2.04Å; C780-C914 PolarHBondContact SG-SG 2.78Å; C780-H1000 PolarHBondContact O-CD2 3.41Å
781	G	67.5	Low	59.9	Low	0 Å²	0	80.5 Å²	80.5	0%	0	41%	0.411	C	S	.	.	S	Bend	trans	63.2	27	172.8	0	0	0	0	0	114.2	P912 W1001	G781-P912 PolarHBondContact N-O 3.25Å; G781-W1001 WeakPolarHBondContact CA-O 3.32Å; G781-W1001 VanDerWaalsContact O-CD1 3.26Å; G781-W1001 PolarHBondContact O-N 2.8Å
782	R	76	Confident	58	Low	134 Å²	134	84.4 Å²	84.4	51%	0.506	44%	0.444	S	S	.	.			trans	-109.8	134.7	174	-70.2	-167.2	-177.2	-176.6	2	111	C780 H1000	C780-R782 PolarHBondContact O-N 2.95Å; C780-R782 VanDerWaalsContact O-N 3.16Å; R782-H1000 PolarHBondContact NE-CD2 3.04Å; R782-H1000 PolarHBondContact NE-NE2 3.01Å; R782-H1000 PolarHBondContact NH2-CE1 3.47Å; R782-H1000 VanDerWaalsContact NH2-CE1 3.31Å; R782-H1000 PolarHBondContact NH2-NE2 3.08Å
783	R	77.1	Confident	55.8	Low	85 Å²	85	91.3 Å²	91.3	32%	0.321	48%	0.48	S	S	.	.			trans	-82.2	126.9	170.3	-62.1	177.2	176.9	-176.7	-6.6	108.5	A813 W816	R783-A813 PolarHBondContact NE-O 2.81Å; R783-W816 HydrophobicContact CG-CH2 4.5Å
784	Q	65.4	Low	54	Low	117 Å²	117	96.6 Å²	96.6	55%	0.547	51%	0.513	S	S	.	.			trans	-88.6	-22.4	176.5	-70.8	-169.2	-17.8	0	0	112.6	Q908	Q784-Q908 HydrophobicContact CB-CB 4.38Å
785	V	64.1	Low	52.4	Low	32 Å²	32	99.7 Å²	99.7	19%	0.194	53%	0.529	C	S	.	.	P	Polyproline II helix	trans	-88.5	120.3	176	-173.4	0	0	0	0	108.7	W787 Q908 W909	V785-W787 HydrophobicContact CG1-CD2 4.5Å; V785-W787 HydrophobicContact CG1-CZ2 4.3Å; V785-Q908 HydrophobicContact CG2-CB 4.46Å; V785-W909 HydrophobicContact CG2-CE3 4.31Å; V785-W909 HydrophobicContact CG2-CH2 4.31Å; V785-W909 HydrophobicContact CG2-CZ3 3.84Å
786	T	49.8	Very low	51.1	Low	132 Å²	132	105.4 Å²	105.4	81%	0.81	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-98.5	122.9	170.6	36.8	0	0	0	0	108.1
787	W	48.2	Very low	49.9	Very low	127 Å²	127	111.7 Å²	111.7	48%	0.481	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-83.7	123.4	175.6	-57.1	102.5	0	0	0	108.8	V785 Q789 A810 K811	V785-W787 HydrophobicContact CG1-CD2 4.5Å; V785-W787 HydrophobicContact CG1-CZ2 4.3Å; W787-Q789 PolarHBondContact O-N 3.26Å; W787-A810 HydrophobicContact CD2-CB 4.16Å; W787-A810 VanDerWaalsContact CE2-CB 3.48Å; W787-A810 HydrophobicContact CH2-CB 3.72Å; W787-A810 HydrophobicContact CZ2-CB 3.23Å; W787-A810 HydrophobicContact CZ3-CB 4.34Å; W787-K811 HydrophobicContact CH2-CB 4.22Å; W787-K811 WeakPolarHBondContact CH2-O 3.38Å; W787-K811 WeakPolarHBondContact CZ2-O 3.36Å
788	D	37.5	Very low	48.6	Very low	146 Å²	146	111.8 Å²	111.8	78%	0.781	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-66.2	121	169.6	-107.3	-17.9	0	0	0	108.5	S790	D788-S790 PolarHBondContact O-N 2.9Å
789	Q	40.3	Very low	47.8	Very low	185 Å²	185	111.9 Å²	111.9	86%	0.864	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	15.1	-178.1	-70.4	-176.6	-27.1	0	0	114.4	W787	W787-Q789 PolarHBondContact O-N 3.26Å
790	S	34.6	Very low	46.5	Very low	95 Å²	95	116 Å²	116	66%	0.664	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	-14.4	-176.4	64.6	0	0	0	0	114.5	D788	D788-S790 PolarHBondContact O-N 2.9Å
791	E	38.6	Very low	44.5	Very low	164 Å²	164	121.8 Å²	121.8	77%	0.766	65%	0.647	S	S	*	*	S	Bend	trans	-102.2	-9.4	178.7	-69.1	-172.8	153.9	0	0	114.2	N793	E791-N793 PolarHBondContact O-N 3.04Å
792	A	38.1	Very low	42.9	Very low	82 Å²	82	128.6 Å²	128.6	68%	0.678	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-6	179	0	0	0	0	0	114.7
793	N	31.8	Very low	41.1	Very low	150 Å²	150	122.7 Å²	122.7	80%	0.802	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.3	16.1	-176	-96	-3.6	0	0	0	114.8	E791	E791-N793 PolarHBondContact O-N 3.04Å
794	T	32.4	Very low	39.4	Very low	120 Å²	120	120.6 Å²	120.6	74%	0.736	65%	0.648	S	S	*	*	S	Bend	trans	-119.6	4.8	178.9	52.4	0	0	0	0	116.1
795	L	34.2	Very low	38.7	Very low	156 Å²	156	116.6 Å²	116.6	82%	0.817	64%	0.638	S	S	*	*			trans	-132.3	53.9	178.1	-79.5	156.9	0	0	0	111.9
796	D	35.3	Very low	38.5	Very low	149 Å²	149	115.2 Å²	115.2	80%	0.797	63%	0.631	S	S	*	*			trans	-122.4	48.9	173.9	-163.6	25.3	0	0	0	112.1
797	Q	32.2	Very low	39.6	Very low	201 Å²	201	113 Å²	113	94%	0.939	62%	0.617	S	S	*	*	S	Bend	trans	-145.9	18.7	170.6	-75.7	-159.2	-5.3	0	0	116.6
798	S	29.7	Very low	41.1	Very low	102 Å²	102	112.2 Å²	112.2	71%	0.713	62%	0.622	S	S	*	*			trans	-141.2	97.1	167.9	61	0	0	0	0	110.7	E800	S798-E800 PolarHBondContact O-N 3.13Å; S798-E800 VanDerWaalsContact O-N 3.1Å
799	G	39	Very low	43.2	Very low	70 Å²	70	105.4 Å²	105.4	72%	0.722	59%	0.586	S	S	*	*			trans	-67.7	101.8	170.2	0	0	0	0	0	110.4
800	E	32.5	Very low	45.1	Very low	173 Å²	173	98.5 Å²	98.5	81%	0.808	56%	0.56	S	S	*	*			trans	-136.5	102.2	152	-79.6	-167.5	155.7	0	0	107.5	S798	S798-E800 PolarHBondContact O-N 3.13Å; S798-E800 VanDerWaalsContact O-N 3.1Å
801	H	30.2	Very low	47.1	Very low	138 Å²	138	97 Å²	97	64%	0.639	54%	0.542	S	S	*	.			trans	-81	125.8	179	-64.7	-93.8	0	0	0	109.6
802	R	34	Very low	48.8	Very low	143 Å²	143	90 Å²	90	54%	0.54	51%	0.513	S	S	.	.			trans	-145.6	58.3	179	-71.7	-170.8	81.5	155.1	3	113.7	E936 Q947	R802-E936 HydrophobicContact CB-CG 4.46Å; R802-E936 WeakPolarHBondContact CB-OE2 3.47Å; R802-E936 IonicContact CZ-OE2 3.47Å; R802-E936 IonicContact NE-OE2 3.54Å; R802-E936 PolarHBondContact NE-OE2 3.34Å; R802-E936 IonicContact NH2-OE2 2.79Å; R802-E936 PolarHBondContact NH2-OE2 3.01Å; R802-E936 VanDerWaalsContact O-CD 3.23Å; R802-E936 VanDerWaalsContact O-CG 3.32Å; R802-E936 WeakPolarHBondContact O-CG 3.27Å; R802-E936 VanDerWaalsContact O-OE1 3.14Å; R802-Q947 PolarHBondContact O-OE1 3.46Å
803	V	37	Very low	50.9	Low	10 Å²	10	86.2 Å²	86.2	6%	0.061	48%	0.482	C	S	.	.	S	Bend		-115.1	172	104.3	175.8	0	0	0	0	104.3	G805 G806 E936 Q947	V803-G805 VanDerWaalsContact C-N 3.26Å; V803-G805 PolarHBondContact O-N 3.08Å; V803-G806 PolarHBondContact O-N 3.45Å; V803-E936 CarbonylContact C-O 3.54Å; V803-E936 HydrophobicContact CG2-CG 4.49Å; V803-Q947 HydrophobicContact CG2-CB 3.22Å; V803-Q947 HydrophobicContact CG2-CG 3.22Å
804	V	42.2	Very low	53.5	Low	40 Å²	40	79.6 Å²	79.6	24%	0.242	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	103.2	166.1	-153.6	0	0	0	0	105.9	G806 E936 G981 V982 A1015	V804-G806 PolarHBondContact O-N 3.35Å; V804-E936 WeakPolarHBondContact CG2-O 3.42Å; V804-E936 PolarHBondContact N-O 2.81Å; V804-G981 CarbonylContact C-O 3.55Å; V804-G981 WeakPolarHBondContact CB-O 3.19Å; V804-G981 WeakPolarHBondContact CG1-O 3.49Å; V804-V982 VanDerWaalsContact O-CA 3.27Å; V804-V982 WeakPolarHBondContact O-CA 3.21Å; V804-A1015 HydrophobicContact CB-CB 3.62Å; V804-A1015 HydrophobicContact CG1-CB 3.43Å; V804-A1015 VanDerWaalsContact CG1-CB 3.43Å; V804-A1015 HydrophobicContact CG2-CB 3.96Å
805	G	50.7	Low	56.1	Low	34 Å²	34	74 Å²	74	35%	0.351	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	4.2	-174.2	0	0	0	0	0	120.9	V803 G981	V803-G805 VanDerWaalsContact C-N 3.26Å; V803-G805 PolarHBondContact O-N 3.08Å; G805-G981 WeakPolarHBondContact CA-O 3.1Å; G805-G981 PolarHBondContact N-O 3.25Å
806	G	59.5	Low	58.7	Low	3 Å²	3	66.6 Å²	66.6	3%	0.031	37%	0.373	C	S	.	.			trans	-100.4	172.7	-176.4	0	0	0	0	0	116.3	V803 V804 E948	V803-G806 PolarHBondContact O-N 3.45Å; V804-G806 PolarHBondContact O-N 3.35Å; G806-E948 WeakPolarHBondContact CA-O 3.43Å
807	V	74.6	Confident	61.3	Low	85 Å²	85	59.8 Å²	59.8	52%	0.515	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	153.4	179	-64.4	0	0	0	0	112.2	A809 Q947 E948	V807-A809 PolarHBondContact O-N 2.93Å; V807-Q947 VanDerWaalsContact C-OE1 3.28Å; V807-Q947 PolarHBondContact O-OE1 2.94Å; V807-E948 HydrophobicContact CG2-CG 3.8Å; V807-E948 PolarHBondContact N-O 3.07Å; V807-E948 PolarHBondContact O-N 3.48Å
808	N	79.3	Confident	64.1	Low	111 Å²	111	50.2 Å²	50.2	59%	0.594	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.3	120.1	173.1	-72.2	-20.4	0	0	0	110.1	V945 Q947	N808-V945 HydrophobicContact CB-CG1 4.46Å; N808-Q947 PolarHBondContact OD1-NE2 3.03Å; N808-Q947 PolarHBondContact OD1-OE1 2.91Å
809	A	80.3	Confident	67	Low	3 Å²	3	45.3 Å²	45.3	3%	0.025	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-70.1	140.9	177.3	0	0	0	0	0	110	V807 H862 L946 E948	V807-A809 PolarHBondContact O-N 2.93Å; A809-H862 PolarHBondContact O-CE1 3.09Å; A809-L946 HydrophobicContact CB-CB 4.43Å; A809-L946 HydrophobicContact CB-CD2 4.2Å; A809-L946 HydrophobicContact CB-CG 4.16Å; A809-L946 WeakPolarHBondContact CB-O 3.31Å; A809-L946 PolarHBondContact N-O 2.84Å; A809-E948 HydrophobicContact CB-CB 4.14Å; A809-E948 HydrophobicContact CB-CG 4.04Å
810	A	79.9	Confident	69.4	Low	40 Å²	40	42 Å²	42	33%	0.331	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-68.8	147.2	176	0	0	0	0	0	111.2	W787 G812 A813	W787-A810 HydrophobicContact CD2-CB 4.16Å; W787-A810 VanDerWaalsContact CE2-CB 3.48Å; W787-A810 HydrophobicContact CH2-CB 3.72Å; W787-A810 HydrophobicContact CZ2-CB 3.23Å; W787-A810 HydrophobicContact CZ3-CB 4.34Å; A810-G812 PolarHBondContact O-N 3.43Å; A810-A813 HydrophobicContact CB-CB 4.42Å; A810-A813 WeakPolarHBondContact O-CB 3.37Å; A810-A813 PolarHBondContact O-N 3.5Å
811	K	78.4	Confident	72	Confident	64 Å²	64	34.2 Å²	34.2	28%	0.278	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	113.9	-177.7	-176.5	177.5	-178.5	178	0	111.3	W787 H862 E871 W909	W787-K811 HydrophobicContact CH2-CB 4.22Å; W787-K811 WeakPolarHBondContact CH2-O 3.38Å; W787-K811 WeakPolarHBondContact CZ2-O 3.36Å; K811-H862 HydrophobicContact CG-CB 4.04Å; K811-E871 WeakPolarHBondContact CE-OE1 3.45Å; K811-E871 IonicContact NZ-OE1 3.69Å; K811-E871 PolarHBondContact NZ-OE1 3.47Å; K811-E871 IonicContact NZ-OE2 2.7Å; K811-E871 PolarHBondContact NZ-OE2 2.73Å; K811-E871 VanDerWaalsContact NZ-OE2 3.14Å; K811-W909 HydrophobicContact CD-CH2 4.36Å; K811-W909 HydrophobicContact CG-CE3 4.48Å; K811-W909 HydrophobicContact CG-CH2 4.21Å; K811-W909 HydrophobicContact CG-CZ3 3.98Å; K811-W909 WeakPolarHBondContact O-CZ3 3.48Å
812	G	74.4	Confident	74.6	Confident	16 Å²	16	28.7 Å²	28.7	17%	0.165	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.1	9.3	-176.4	0	0	0	0	0	115.7	A810 W814	A810-G812 PolarHBondContact O-N 3.43Å; G812-W814 PolarHBondContact O-N 2.04Å
813	A	80.3	Confident	76.9	Confident	3 Å²	3	30 Å²	30	3%	0.025	17%	0.165	C	C	.	.	S	Bend	trans	-59.2	-35.1	169.5	0	0	0	0	0	112	R783 A810 P815	R783-A813 PolarHBondContact NE-O 2.81Å; A810-A813 HydrophobicContact CB-CB 4.42Å; A810-A813 WeakPolarHBondContact O-CB 3.37Å; A810-A813 PolarHBondContact O-N 3.5Å; A813-P815 WeakPolarHBondContact O-CD 3.46Å
814	W	87.6	Confident	78.8	Confident	10 Å²	10	32.3 Å²	32.3	4%	0.038	19%	0.192	C	C	.	.			trans	-127.3	77.5	-175.9	-52.7	116.1	0	0	0	112.5	G812 W816 M817 F929 A931 L946 E948 M994 W1001	G812-W814 PolarHBondContact O-N 2.04Å; W814-W816 AromaticContact CE3-CZ2 3.6Å; W814-W816 HydrophobicContact CE3-CZ2 3.6Å; W814-W816 AromaticContact CZ3-CZ2 3.91Å; W814-W816 HydrophobicContact CZ3-CZ2 3.91Å; W814-W816 PolarHBondContact O-N 2.83Å; W814-M817 HydrophobicContact CB-CB 4.48Å; W814-M817 HydrophobicContact CB-CG 3.57Å; W814-M817 WeakPolarHBondContact O-CB 3.15Å; W814-M817 PolarHBondContact O-N 3.01Å; W814-F929 HydrophobicContact CH2-CB 3.71Å; W814-F929 HydrophobicContact CH2-CD1 4.22Å; W814-F929 AromaticContact CH2-CG 3.96Å; W814-F929 HydrophobicContact CH2-CG 3.96Å; W814-F929 HydrophobicContact CZ2-CB 3.9Å; W814-F929 HydrophobicContact CZ2-CD1 4Å; W814-F929 HydrophobicContact CZ2-CG 4.15Å; W814-A931 HydrophobicContact CG-CB 4.05Å; W814-L946 HydrophobicContact CB-CD2 4.24Å; W814-E948 PolarHBondContact NE1-OE2 2.82Å; W814-M994 HydrophobicContact CD2-CE 3.42Å; W814-M994 VanDerWaalsContact CD2-CE 3.42Å; W814-M994 HydrophobicContact CD2-SD 4.3Å; W814-M994 HydrophobicContact CE3-CE 3.09Å; W814-M994 HydrophobicContact CE3-SD 3.38Å; W814-M994 HydrophobicContact CG-CE 4.12Å; W814-M994 HydrophobicContact CH2-CE 3.7Å; W814-M994 HydrophobicContact CH2-CG 4.33Å; W814-M994 HydrophobicContact CH2-SD 3.71Å; W814-M994 HydrophobicContact CZ2-CE 4.06Å; W814-M994 HydrophobicContact CZ3-CE 3.25Å; W814-M994 HydrophobicContact CZ3-CG 4.16Å; W814-M994 HydrophobicContact CZ3-SD 3.02Å; W814-M994 WeakPolarHBondContact CZ3-SD 3.32Å; W814-W1001 HydrophobicContact CH2-CD2 4.39Å; W814-W1001 HydrophobicContact CH2-CE3 4.04Å; W814-W1001 AromaticContact CH2-CH2 3.64Å; W814-W1001 HydrophobicContact CH2-CH2 3.64Å; W814-W1001 HydrophobicContact CH2-CZ2 4.03Å; W814-W1001 AromaticContact CH2-CZ3 3.65Å; W814-W1001 HydrophobicContact CH2-CZ3 3.65Å; W814-W1001 AromaticContact CZ3-CD2 3.82Å; W814-W1001 HydrophobicContact CZ3-CD2 3.82Å; W814-W1001 AromaticContact CZ3-CE2 3.97Å; W814-W1001 AromaticContact CZ3-CE3 3.78Å; W814-W1001 HydrophobicContact CZ3-CE3 3.78Å; W814-W1001 HydrophobicContact CZ3-CH2 4.05Å; W814-W1001 HydrophobicContact CZ3-CZ2 4.1Å; W814-W1001 AromaticContact CZ3-CZ3 3.89Å; W814-W1001 HydrophobicContact CZ3-CZ3 3.89Å
815	P	86.6	Confident	80.6	Confident	4 Å²	4	39 Å²	39	3%	0.026	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-8	-172.5	30.3	-36.8	0	0	0	114.8	A813 W909 V910 Q911	A813-P815 WeakPolarHBondContact O-CD 3.46Å; P815-W909 VanDerWaalsContact CA-O 3.23Å; P815-W909 WeakPolarHBondContact CA-O 3.11Å; P815-W909 WeakPolarHBondContact CB-O 3.44Å; P815-V910 WeakPolarHBondContact O-CA 3.39Å; P815-Q911 CarbonylContact C-O 3.57Å; P815-Q911 HydrophobicContact CB-CB 3.94Å; P815-Q911 HydrophobicContact CB-CG 4.31Å; P815-Q911 HydrophobicContact CG-CB 3.86Å; P815-Q911 HydrophobicContact CG-CG 4.36Å; P815-Q911 PolarHBondContact O-N 2.76Å
816	W	89.1	Confident	82.2	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-3.4	175	39	83.3	0	0	0	113.8	R783 W814 L832 Q911 V913 M994 W1001	R783-W816 HydrophobicContact CG-CH2 4.5Å; W814-W816 AromaticContact CE3-CZ2 3.6Å; W814-W816 HydrophobicContact CE3-CZ2 3.6Å; W814-W816 AromaticContact CZ3-CZ2 3.91Å; W814-W816 HydrophobicContact CZ3-CZ2 3.91Å; W814-W816 PolarHBondContact O-N 2.83Å; W816-L832 HydrophobicContact CB-CB 4.36Å; W816-L832 PolarHBondContact O-N 2.99Å; W816-Q911 WeakPolarHBondContact CA-O 3.36Å; W816-Q911 WeakPolarHBondContact CB-O 3.24Å; W816-Q911 PolarHBondContact N-O 3.3Å; W816-V913 HydrophobicContact CB-CB 3.87Å; W816-V913 HydrophobicContact CD2-CB 3.88Å; W816-V913 HydrophobicContact CD2-CG2 4.05Å; W816-V913 HydrophobicContact CE3-CB 4.4Å; W816-V913 HydrophobicContact CG-CB 3.63Å; W816-V913 HydrophobicContact CG-CG2 4.12Å; W816-M994 HydrophobicContact CZ2-CE 4.43Å; W816-M994 HydrophobicContact CZ2-SD 3.57Å; W816-M994 VanDerWaalsContact CZ2-SD 3.57Å; W816-M994 PolarHBondContact NE1-SD 3.3Å; W816-W1001 HydrophobicContact CH2-CB 3.5Å; W816-W1001 VanDerWaalsContact CH2-CB 3.5Å; W816-W1001 AromaticContact CH2-CD1 3.69Å; W816-W1001 AromaticContact CH2-CG 3.63Å; W816-W1001 HydrophobicContact CH2-CG 3.63Å; W816-W1001 HydrophobicContact CZ2-CB 3.5Å; W816-W1001 VanDerWaalsContact CZ2-CB 3.5Å; W816-W1001 HydrophobicContact CZ2-CD2 4.39Å; W816-W1001 AromaticContact CZ2-CG 3.71Å; W816-W1001 HydrophobicContact CZ2-CG 3.71Å; W816-W1001 HydrophobicContact CZ3-CB 4.5Å
817	M	89.4	Confident	83.3	Confident	5 Å²	5	40.4 Å²	40.4	3%	0.025	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	134.8	178.9	-75	-61.3	-64.6	0	0	111.2	W814 A931 W933 L946 P992	W814-M817 HydrophobicContact CB-CB 4.48Å; W814-M817 HydrophobicContact CB-CG 3.57Å; W814-M817 WeakPolarHBondContact O-CB 3.15Å; W814-M817 PolarHBondContact O-N 3.01Å; M817-A931 HydrophobicContact CE-CB 4.45Å; M817-A931 WeakPolarHBondContact CE-O 3.3Å; M817-A931 HydrophobicContact CG-CB 4.44Å; M817-A931 HydrophobicContact SD-CB 4.15Å; M817-W933 HydrophobicContact CB-CH2 4.17Å; M817-W933 HydrophobicContact CB-CZ3 4.44Å; M817-W933 HydrophobicContact CE-CE3 4.45Å; M817-W933 HydrophobicContact CE-CZ3 4Å; M817-L946 HydrophobicContact CE-CD1 4.07Å; M817-L946 HydrophobicContact CG-CD2 4.25Å; M817-P992 WeakPolarHBondContact SD-CD 3.08Å; M817-P992 HydrophobicContact SD-CG 3.34Å; M817-P992 WeakPolarHBondContact SD-CG 3.45Å
818	V	91.4	Very high	83.9	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	132.2	176.9	-176.8	0	0	0	0	109.1	L820 G829 A830 L832 L838 A857 L859	V818-L820 HydrophobicContact CG1-CD2 4.3Å; V818-G829 CarbonylContact O-C 3.58Å; V818-G829 WeakPolarHBondContact O-CA 3.05Å; V818-A830 HydrophobicContact CB-CB 4.03Å; V818-A830 WeakPolarHBondContact CB-O 3.43Å; V818-A830 HydrophobicContact CG1-CB 4.4Å; V818-A830 PolarHBondContact N-O 3.16Å; V818-A830 PolarHBondContact O-N 2.71Å; V818-L832 HydrophobicContact CG2-CB 4.13Å; V818-L838 HydrophobicContact CG1-CD1 3.97Å; V818-L838 HydrophobicContact CG1-CD2 4.42Å; V818-L838 HydrophobicContact CG2-CD2 3.83Å; V818-A857 HydrophobicContact CG1-CB 3.93Å; V818-L859 HydrophobicContact CB-CG 4.41Å; V818-L859 HydrophobicContact CG1-CD1 4.38Å; V818-L859 HydrophobicContact CG1-CG 4.06Å; V818-L859 HydrophobicContact CG2-CD2 3.55Å; V818-L859 HydrophobicContact CG2-CG 3.73Å
819	S	89.9	Confident	84.3	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	117	172.4	-167.1	0	0	0	0	108.5	H821 H826 V858 Q864	S819-H821 PolarHBondContact OG-CD2 3.05Å; S819-H821 PolarHBondContact OG-NE2 3.49Å; S819-H826 PolarHBondContact OG-CE1 3.01Å; S819-H826 PolarHBondContact OG-ND1 2.65Å; S819-V858 PolarHBondContact N-O 3.23Å; S819-V858 PolarHBondContact O-N 3.12Å; S819-Q864 PolarHBondContact OG-NE2 3.46Å; S819-Q864 VanDerWaalsContact OG-NE2 3.09Å
820	L	89.8	Confident	84.8	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	121.7	175	-60.4	178.5	0	0	0	109.4	V818 V827 C828 A830 L838 T840 W855 A857 M898	V818-L820 HydrophobicContact CG1-CD2 4.3Å; L820-V827 PolarHBondContact O-N 3.04Å; L820-C828 VanDerWaalsContact CB-O 3.32Å; L820-C828 WeakPolarHBondContact CB-O 3.41Å; L820-C828 HydrophobicContact CD1-CB 4.34Å; L820-C828 PolarHBondContact N-O 2.94Å; L820-A830 HydrophobicContact CD1-CB 3.85Å; L820-A830 HydrophobicContact CD2-CB 3.98Å; L820-A830 HydrophobicContact CG-CB 3.78Å; L820-L838 HydrophobicContact CD2-CD1 4.15Å; L820-T840 HydrophobicContact CD1-CG2 4.14Å; L820-W855 HydrophobicContact CB-CE3 4.28Å; L820-W855 HydrophobicContact CB-CZ3 3.79Å; L820-W855 HydrophobicContact CD1-CZ3 4.49Å; L820-A857 HydrophobicContact CD2-CB 4.27Å; L820-M898 HydrophobicContact CD1-SD 3.67Å; L820-M898 HydrophobicContact CD2-CE 4.34Å; L820-M898 HydrophobicContact CD2-SD 3.83Å; L820-M898 HydrophobicContact CG-SD 4.43Å
821	H	88.1	Confident	85.4	Confident	9 Å²	9	29.3 Å²	29.3	4%	0.042	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	129.6	-179.5	-79.2	-152.9	0	0	0	109.9	S819 R825 S856 Q864	S819-H821 PolarHBondContact OG-CD2 3.05Å; S819-H821 PolarHBondContact OG-NE2 3.49Å; H821-R825 CarbonylContact C-O 3.56Å; H821-R825 VanDerWaalsContact CA-O 3.23Å; H821-R825 WeakPolarHBondContact CA-O 3.36Å; H821-S856 WeakPolarHBondContact CB-OG 3.43Å; H821-S856 PolarHBondContact N-O 3.27Å; H821-S856 PolarHBondContact O-N 3.2Å; H821-Q864 PolarHBondContact NE2-OE1 3.29Å
822	W	84.4	Confident	85.9	Confident	22 Å²	22	26.3 Å²	26.3	8%	0.083	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	123	173.2	175.3	-98.5	0	0	0	109	T582 G824 R825 V827 K848 H851 S854 W855	T582-W822 HydrophobicContact CG2-CH2 3.84Å; T582-W822 HydrophobicContact CG2-CZ2 3.6Å; W822-G824 PolarHBondContact O-N 3.16Å; W822-G824 VanDerWaalsContact O-N 3.12Å; W822-R825 PolarHBondContact N-O 2.84Å; W822-R825 PolarHBondContact O-N 2.7Å; W822-V827 HydrophobicContact CB-CG2 3.61Å; W822-K848 HydrophobicContact CD2-CD 4.11Å; W822-K848 HydrophobicContact CE3-CB 4.31Å; W822-K848 HydrophobicContact CE3-CD 4.29Å; W822-K848 HydrophobicContact CH2-CB 3.86Å; W822-K848 HydrophobicContact CH2-CD 4.47Å; W822-K848 HydrophobicContact CH2-CG 4.02Å; W822-K848 HydrophobicContact CZ2-CD 4.43Å; W822-K848 HydrophobicContact CZ2-CG 4.23Å; W822-K848 HydrophobicContact CZ3-CB 3.78Å; W822-K848 HydrophobicContact CZ3-CD 4.45Å; W822-K848 HydrophobicContact CZ3-CG 4.26Å; W822-H851 HydrophobicContact CH2-CB 3.77Å; W822-H851 HydrophobicContact CZ3-CB 4.31Å; W822-S854 WeakPolarHBondContact CA-O 3.32Å; W822-S854 VanDerWaalsContact CZ3-CB 3.49Å; W822-W855 HydrophobicContact CB-CE3 4.45Å; W822-W855 HydrophobicContact CB-CH2 4.46Å; W822-W855 HydrophobicContact CB-CZ3 4.23Å; W822-W855 AromaticContact CE3-CD1 3.66Å; W822-W855 AromaticContact CE3-CD2 3.69Å; W822-W855 HydrophobicContact CE3-CD2 3.69Å; W822-W855 AromaticContact CE3-CE2 3.4Å; W822-W855 HydrophobicContact CE3-CE3 4.36Å; W822-W855 AromaticContact CE3-CG 3.87Å; W822-W855 HydrophobicContact CE3-CG 3.87Å; W822-W855 AromaticContact CE3-CZ2 3.88Å; W822-W855 HydrophobicContact CE3-CZ2 3.88Å; W822-W855 AromaticContact CE3-NE1 3.4Å; W822-W855 AromaticContact CZ3-CD1 3.45Å; W822-W855 VanDerWaalsContact CZ3-CD1 3.45Å; W822-W855 HydrophobicContact CZ3-CD2 4.25Å; W822-W855 AromaticContact CZ3-CE2 3.73Å; W822-W855 HydrophobicContact CZ3-CG 4.11Å; W822-W855 HydrophobicContact CZ3-CZ2 4.37Å; W822-W855 AromaticContact CZ3-NE1 3.2Å
823	R	82.4	Confident	86.4	Confident	170 Å²	170	25.5 Å²	25.5	64%	0.642	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.9	36.9	-174.6	-62.3	-175.8	175.6	178.5	0.6	113	S854	R823-S854 PolarHBondContact N-O 3.32Å
824	G	77.4	Confident	86.3	Confident	60 Å²	60	25.8 Å²	25.8	62%	0.619	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.1	6.8	178.8	0	0	0	0	0	116.1	W822	W822-G824 PolarHBondContact O-N 3.16Å; W822-G824 VanDerWaalsContact O-N 3.12Å
825	R	79.9	Confident	86	Confident	180 Å²	180	27.5 Å²	27.5	68%	0.679	14%	0.141	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-116.3	139.4	176.1	-169.7	177.5	-178	-178.1	2.1	111.2	H821 W822 V827	H821-R825 CarbonylContact C-O 3.56Å; H821-R825 VanDerWaalsContact CA-O 3.23Å; H821-R825 WeakPolarHBondContact CA-O 3.36Å; W822-R825 PolarHBondContact N-O 2.84Å; W822-R825 PolarHBondContact O-N 2.7Å; R825-V827 PolarHBondContact O-N 3.33Å
826	H	83.1	Confident	85.8	Confident	20 Å²	20	28.9 Å²	28.9	9%	0.093	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	131.3	172.7	177.9	59.6	0	0	0	111.6	S819 C828 G987	S819-H826 PolarHBondContact OG-CE1 3.01Å; S819-H826 PolarHBondContact OG-ND1 2.65Å; H826-C828 VanDerWaalsContact CE1-C 3.41Å; H826-C828 PolarHBondContact CE1-O 2.83Å; H826-C828 PolarHBondContact ND1-O 3.08Å; H826-G987 PolarHBondContact NE2-O 2.83Å
827	V	82.4	Confident	85.7	Confident	46 Å²	46	29.8 Å²	29.8	28%	0.279	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	-44.7	178.4	177.7	0	0	0	0	112.2	L820 W822 R825	L820-V827 PolarHBondContact O-N 3.04Å; W822-V827 HydrophobicContact CB-CG2 3.61Å; R825-V827 PolarHBondContact O-N 3.33Å
828	C	88.2	Confident	85.8	Confident	5 Å²	5	29.6 Å²	29.6	3%	0.034	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	160.7	-176.2	-79.7	0	0	0	0	112	L820 H826 C844 S989	L820-C828 VanDerWaalsContact CB-O 3.32Å; L820-C828 WeakPolarHBondContact CB-O 3.41Å; L820-C828 HydrophobicContact CD1-CB 4.34Å; L820-C828 PolarHBondContact N-O 2.94Å; H826-C828 VanDerWaalsContact CE1-C 3.41Å; H826-C828 PolarHBondContact CE1-O 2.83Å; H826-C828 PolarHBondContact ND1-O 3.08Å; C828-C844 HydrophobicContact CB-CB 3.68Å; C828-C844 WeakPolarHBondContact CB-SG 3.07Å; C828-C844 WeakPolarHBondContact SG-CB 3.3Å; C828-C844 CovalentContact SG-SG 2.03Å; C828-C844 PolarHBondContact SG-SG 3.24Å; C828-S989 VanDerWaalsContact CB-O 3.26Å; C828-S989 WeakPolarHBondContact CB-O 3.03Å
829	G	88.1	Confident	85.7	Confident	2 Å²	2	29.6 Å²	29.6	2%	0.021	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	162.2	165.9	0	0	0	0	0	112.7	V818 T840 S989 G990	V818-G829 CarbonylContact O-C 3.58Å; V818-G829 WeakPolarHBondContact O-CA 3.05Å; G829-T840 PolarHBondContact O-OG1 2.86Å; G829-S989 PolarHBondContact N-O 2.88Å; G829-G990 CarbonylContact O-C 3.52Å; G829-G990 WeakPolarHBondContact O-CA 2.95Å
830	A	91	Very high	85.8	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	166.6	168.9	0	0	0	0	0	110.7	V818 L820 L839	V818-A830 HydrophobicContact CB-CB 4.03Å; V818-A830 WeakPolarHBondContact CB-O 3.43Å; V818-A830 HydrophobicContact CG1-CB 4.4Å; V818-A830 PolarHBondContact N-O 3.16Å; V818-A830 PolarHBondContact O-N 2.71Å; L820-A830 HydrophobicContact CD1-CB 3.85Å; L820-A830 HydrophobicContact CD2-CB 3.98Å; L820-A830 HydrophobicContact CG-CB 3.78Å; A830-L839 WeakPolarHBondContact CA-O 2.84Å; A830-L839 WeakPolarHBondContact CB-O 3.21Å
831	S	91.3	Very high	85.7	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	133.4	179.1	-56.4	0	0	0	0	111.5	I833 L838 L839 P992 Q1003	S831-I833 PolarHBondContact O-N 2.66Å; S831-L838 WeakPolarHBondContact O-CA 3.06Å; S831-L839 PolarHBondContact N-O 2.86Å; S831-L839 PolarHBondContact O-N 2.77Å; S831-P992 VanDerWaalsContact OG-CB 3.25Å; S831-P992 WeakPolarHBondContact OG-CB 3.39Å; S831-P992 WeakPolarHBondContact OG-CD 3.35Å; S831-P992 WeakPolarHBondContact OG-CG 3.43Å; S831-Q1003 PolarHBondContact OG-NE2 3.21Å; S831-Q1003 PolarHBondContact OG-OE1 3.44Å; S831-Q1003 VanDerWaalsContact OG-OE1 3.06Å
832	L	89.9	Confident	85.7	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	115.6	174.2	-173.5	65.2	0	0	0	110.9	W816 V818 G834 L838 L859 I904 F906 V910 P912 V913	W816-L832 HydrophobicContact CB-CB 4.36Å; W816-L832 PolarHBondContact O-N 2.99Å; V818-L832 HydrophobicContact CG2-CB 4.13Å; L832-G834 WeakPolarHBondContact CD1-O 3.27Å; L832-G834 WeakPolarHBondContact CG-O 3.49Å; L832-L838 HydrophobicContact CB-CD2 4.38Å; L832-L838 HydrophobicContact CD1-CD2 3.56Å; L832-L859 HydrophobicContact CB-CD2 4.36Å; L832-L859 HydrophobicContact CD1-CD2 3.81Å; L832-L859 HydrophobicContact CD2-CD2 3.87Å; L832-L859 HydrophobicContact CG-CD2 4.23Å; L832-I904 HydrophobicContact CD1-CG2 4.41Å; L832-I904 HydrophobicContact CD2-CG2 4.21Å; L832-F906 HydrophobicContact CD2-CE1 4.18Å; L832-V910 HydrophobicContact CD2-CG1 3.65Å; L832-P912 HydrophobicContact CG-CB 4.3Å; L832-P912 CarbonylContact O-C 3.15Å; L832-P912 VanDerWaalsContact O-CA 3.24Å; L832-P912 WeakPolarHBondContact O-CA 3.33Å; L832-V913 PolarHBondContact O-N 2.71Å
833	I	84.9	Confident	85.7	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.155	C	C	.	.			trans	-112.3	-3.3	-178.2	60.8	163.8	0	0	0	113.5	R726 S831 W837 L839 M897 V913 L915 I1033	R726-I833 VanDerWaalsContact NH2-C 3.31Å; R726-I833 PolarHBondContact NH2-O 3.22Å; S831-I833 PolarHBondContact O-N 2.66Å; I833-W837 HydrophobicContact CD1-CB 3.94Å; I833-W837 HydrophobicContact CG1-CB 3.74Å; I833-W837 WeakPolarHBondContact CG1-O 3.26Å; I833-W837 PolarHBondContact N-O 3.38Å; I833-W837 VanDerWaalsContact N-O 3.09Å; I833-L839 HydrophobicContact CD1-CB 4.29Å; I833-L839 HydrophobicContact CG2-CB 3.82Å; I833-L839 HydrophobicContact CG2-CD2 4.45Å; I833-M897 HydrophobicContact CD1-CE 4.02Å; I833-V913 HydrophobicContact CG2-CG1 4.37Å; I833-L915 HydrophobicContact CB-CD1 4.47Å; I833-L915 HydrophobicContact CG2-CD1 4.23Å; I833-L915 HydrophobicContact CG2-CD2 3.83Å; I833-L915 HydrophobicContact CG2-CG 4.3Å; I833-I1033 HydrophobicContact CD1-CG2 4.35Å
834	G	78.4	Confident	85.8	Confident	9 Å²	9	22.5 Å²	22.5	9%	0.093	13%	0.126	C	C	.	.	S	Bend	trans	-163.4	-168.7	-179.7	0	0	0	0	0	111.3	L832 D836 W837	L832-G834 WeakPolarHBondContact CD1-O 3.27Å; L832-G834 WeakPolarHBondContact CG-O 3.49Å; G834-D836 VanDerWaalsContact C-N 3.29Å; G834-W837 PolarHBondContact N-O 2.85Å
835	S	79.8	Confident	86.1	Confident	46 Å²	46	19.7 Å²	19.7	32%	0.322	10%	0.096	S	C	.	.	S	Bend	trans	-73.2	-26.2	171.4	40.5	0	0	0	0	112.5	P903 I904	S835-P903 CarbonylContact O-C 3.56Å; S835-P903 WeakPolarHBondContact O-CA 3.37Å; S835-I904 WeakPolarHBondContact O-CG2 3.33Å; S835-I904 PolarHBondContact O-N 2.85Å
836	D	83	Confident	86.1	Confident	33 Å²	33	12 Å²	12	18%	0.176	7%	0.067	C	C	.	.	S	Bend	trans	-136.1	-2.9	-165.6	56.1	-40.3	0	0	0	112.3	G834 R899 L900	G834-D836 VanDerWaalsContact C-N 3.29Å; D836-R899 CarbonylContact O-C 3.55Å; D836-R899 WeakPolarHBondContact O-CA 3.4Å; D836-L900 PolarHBondContact O-N 3.4Å
837	W	86.8	Confident	85.6	Confident	19 Å²	19	11 Å²	11	7%	0.072	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	133.5	-176.1	-71.9	98.2	0	0	0	112.3	I833 G834 I881 M897 R899	I833-W837 HydrophobicContact CD1-CB 3.94Å; I833-W837 HydrophobicContact CG1-CB 3.74Å; I833-W837 WeakPolarHBondContact CG1-O 3.26Å; I833-W837 PolarHBondContact N-O 3.38Å; I833-W837 VanDerWaalsContact N-O 3.09Å; G834-W837 PolarHBondContact N-O 2.85Å; W837-I881 HydrophobicContact CH2-CD1 4.16Å; W837-I881 HydrophobicContact CZ3-CD1 4.26Å; W837-M897 HydrophobicContact CD2-CE 3.95Å; W837-M897 HydrophobicContact CE3-CB 4.31Å; W837-M897 HydrophobicContact CE3-CE 3.47Å; W837-M897 VanDerWaalsContact CE3-CE 3.47Å; W837-M897 HydrophobicContact CG-CE 4.48Å; W837-M897 HydrophobicContact CZ3-CB 4.25Å; W837-M897 HydrophobicContact CZ3-CE 3.86Å; W837-R899 HydrophobicContact CD2-CB 4.49Å; W837-R899 HydrophobicContact CE3-CB 4.08Å; W837-R899 HydrophobicContact CH2-CB 4.04Å; W837-R899 HydrophobicContact CH2-CG 4.38Å; W837-R899 HydrophobicContact CZ2-CB 4.41Å; W837-R899 HydrophobicContact CZ2-CG 4.27Å; W837-R899 HydrophobicContact CZ3-CB 3.84Å
838	L	91.1	Very high	85.3	Confident	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	149.8	174	-55	-178.3	0	0	0	110.5	V818 L820 S831 L832 A857 M897 M898 L900	V818-L838 HydrophobicContact CG1-CD1 3.97Å; V818-L838 HydrophobicContact CG1-CD2 4.42Å; V818-L838 HydrophobicContact CG2-CD2 3.83Å; L820-L838 HydrophobicContact CD2-CD1 4.15Å; S831-L838 WeakPolarHBondContact O-CA 3.06Å; L832-L838 HydrophobicContact CB-CD2 4.38Å; L832-L838 HydrophobicContact CD1-CD2 3.56Å; L838-A857 HydrophobicContact CD1-CB 3.63Å; L838-M897 WeakPolarHBondContact O-CA 3.43Å; L838-M898 HydrophobicContact CB-CB 4.25Å; L838-M898 PolarHBondContact N-O 3.26Å; L838-M898 PolarHBondContact O-N 3.35Å; L838-L900 HydrophobicContact CD1-CD2 3.82Å; L838-L900 HydrophobicContact CD1-CG 4.48Å; L838-L900 HydrophobicContact CG-CD2 4.24Å; L838-L900 HydrophobicContact CG-CG 4.37Å
839	L	90.6	Very high	84.5	Confident	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	131.4	172.8	-167.3	68.8	0	0	0	109.4	A830 S831 I833 I895 M897 L915 V1026 I1033	A830-L839 WeakPolarHBondContact CA-O 2.84Å; A830-L839 WeakPolarHBondContact CB-O 3.21Å; S831-L839 PolarHBondContact N-O 2.86Å; S831-L839 PolarHBondContact O-N 2.77Å; I833-L839 HydrophobicContact CD1-CB 4.29Å; I833-L839 HydrophobicContact CG2-CB 3.82Å; I833-L839 HydrophobicContact CG2-CD2 4.45Å; L839-I895 HydrophobicContact CD1-CD1 3.93Å; L839-I895 HydrophobicContact CD1-CG1 3.86Å; L839-I895 HydrophobicContact CD2-CD1 4.44Å; L839-I895 HydrophobicContact CG-CD1 4.47Å; L839-I895 HydrophobicContact CG-CG1 4.45Å; L839-M897 HydrophobicContact CD1-CG 3.8Å; L839-L915 HydrophobicContact CD2-CD2 4.1Å; L839-V1026 HydrophobicContact CD2-CG2 4.23Å; L839-I1033 HydrophobicContact CD1-CD1 4.1Å; L839-I1033 HydrophobicContact CD1-CG1 4.36Å; L839-I1033 HydrophobicContact CD2-CD1 4.22Å
840	T	91.3	Very high	83.6	Confident	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	-176.5	179.4	-168.7	0	0	0	0	110.5	L820 G829 V845 A896 M898	L820-T840 HydrophobicContact CD1-CG2 4.14Å; G829-T840 PolarHBondContact O-OG1 2.86Å; T840-V845 HydrophobicContact CG2-CG1 4.28Å; T840-A896 HydrophobicContact CG2-CB 4.22Å; T840-A896 PolarHBondContact N-O 3.33Å; T840-A896 PolarHBondContact O-N 3.19Å; T840-A896 VanDerWaalsContact O-O 3.11Å; T840-M898 HydrophobicContact CG2-CG 4.07Å; T840-M898 HydrophobicContact CG2-SD 3.79Å
841	A	88.8	Confident	82.6	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.099	C	C	.	.			trans	-84.8	144.8	174.1	0	0	0	0	0	111	C844	A841-C844 WeakPolarHBondContact O-CB 3.4Å; A841-C844 PolarHBondContact O-N 3.29Å
842	A	87.1	Confident	81.9	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-65.3	-37.1	177.7	0	0	0	0	0	112.5	C844 V845 Y846 I882 Y886 D894 A896	A842-C844 PolarHBondContact O-N 2.04Å; A842-C844 VanDerWaalsContact O-N 3.15Å; A842-V845 VanDerWaalsContact O-CG2 3.3Å; A842-V845 WeakPolarHBondContact O-CG2 3.4Å; A842-V845 PolarHBondContact O-N 3.2Å; A842-Y846 WeakPolarHBondContact O-CB 3.22Å; A842-Y846 PolarHBondContact O-N 3.28Å; A842-I882 HydrophobicContact CB-CG2 3.73Å; A842-Y886 HydrophobicContact CB-CD1 4.04Å; A842-Y886 HydrophobicContact CB-CD2 3.66Å; A842-Y886 HydrophobicContact CB-CE1 4.17Å; A842-Y886 HydrophobicContact CB-CE2 3.8Å; A842-Y886 HydrophobicContact CB-CG 3.78Å; A842-D894 VanDerWaalsContact CA-OD1 3.26Å; A842-D894 WeakPolarHBondContact CA-OD1 3.1Å; A842-D894 VanDerWaalsContact CB-OD1 3.29Å; A842-D894 WeakPolarHBondContact CB-OD1 3.49Å; A842-D894 PolarHBondContact N-OD1 2.76Å; A842-A896 HydrophobicContact CB-CB 4.28Å
843	H	84.2	Confident	81.3	Confident	48 Å²	48	30.7 Å²	30.7	22%	0.222	16%	0.155	C	C	.	.	H	α-helix	trans	-62.5	-23.4	179.9	75.9	-100.9	0	0	0	113.4	V845 Y886 D894 S989 I1008	H843-V845 VanDerWaalsContact C-N 3.33Å; H843-Y886 WeakPolarHBondContact CA-OH 3.27Å; H843-Y886 WeakPolarHBondContact CB-OH 3.45Å; H843-D894 IonicContact CE1-OD2 3.93Å; H843-D894 IonicContact CG-OD2 3.42Å; H843-D894 PolarHBondContact N-OD1 3.44Å; H843-D894 IonicContact ND1-OD1 3.83Å; H843-D894 IonicContact ND1-OD2 3.2Å; H843-D894 PolarHBondContact ND1-OD2 2.92Å; H843-S989 PolarHBondContact CE1-OG 2.77Å; H843-S989 WeakPolarHBondContact NE2-CB 3.26Å; H843-S989 PolarHBondContact NE2-OG 3.2Å; H843-I1008 PolarHBondContact CE1-O 2.9Å; H843-I1008 PolarHBondContact ND1-O 2.85Å
844	C	84.6	Confident	81.2	Confident	5 Å²	5	32.2 Å²	32.2	3%	0.034	17%	0.166	C	C	.	.	H	α-helix	trans	-69.8	-32.9	176	-71.8	0	0	0	0	112.6	C828 A841 A842 S989	C828-C844 HydrophobicContact CB-CB 3.68Å; C828-C844 WeakPolarHBondContact CB-SG 3.07Å; C828-C844 WeakPolarHBondContact SG-CB 3.3Å; C828-C844 CovalentContact SG-SG 2.03Å; C828-C844 PolarHBondContact SG-SG 3.24Å; A841-C844 WeakPolarHBondContact O-CB 3.4Å; A841-C844 PolarHBondContact O-N 3.29Å; A842-C844 PolarHBondContact O-N 2.04Å; A842-C844 VanDerWaalsContact O-N 3.15Å; C844-S989 VanDerWaalsContact SG-CB 3.59Å
845	V	83.8	Confident	81.7	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-109.1	-9.3	-173.6	-63.3	0	0	0	0	113.1	T840 A842 H843 G847 K848 N849 W855 I880 I882 A896 M898	T840-V845 HydrophobicContact CG2-CG1 4.28Å; A842-V845 VanDerWaalsContact O-CG2 3.3Å; A842-V845 WeakPolarHBondContact O-CG2 3.4Å; A842-V845 PolarHBondContact O-N 3.2Å; H843-V845 VanDerWaalsContact C-N 3.33Å; V845-G847 PolarHBondContact O-N 3.41Å; V845-K848 CarbonylContact O-C 3.51Å; V845-K848 PolarHBondContact O-N 3.47Å; V845-N849 PolarHBondContact O-N 3.12Å; V845-W855 HydrophobicContact CG1-CH2 4.39Å; V845-W855 HydrophobicContact CG1-CZ2 4.05Å; V845-I880 HydrophobicContact CB-CG2 3.79Å; V845-I880 HydrophobicContact CG1-CD1 4.32Å; V845-I880 HydrophobicContact CG1-CG2 4.11Å; V845-I880 HydrophobicContact CG2-CG2 3.74Å; V845-I882 HydrophobicContact CG2-CD1 4.02Å; V845-I882 HydrophobicContact CG2-CG1 3.8Å; V845-A896 HydrophobicContact CG2-CB 3.66Å; V845-M898 HydrophobicContact CG1-CE 4.06Å; V845-M898 HydrophobicContact CG1-SD 4.04Å
846	Y	80.8	Confident	82.1	Confident	18 Å²	18	30.7 Å²	30.7	7%	0.071	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	126.2	177.4	-166.4	-96.2	0	0	0	110.8	M585 E587 L598 V601 F624 A842 K848 I882 Y886	M585-Y846 HydrophobicContact SD-CD1 3.84Å; M585-Y846 HydrophobicContact SD-CE1 3.76Å; E587-Y846 PolarHBondContact OE2-OH 2.8Å; L598-Y846 HydrophobicContact CD2-CE2 4.33Å; V601-Y846 HydrophobicContact CB-CE2 4.47Å; V601-Y846 HydrophobicContact CG1-CE1 4.27Å; V601-Y846 HydrophobicContact CG1-CE2 4.29Å; V601-Y846 HydrophobicContact CG2-CD2 4.16Å; V601-Y846 HydrophobicContact CG2-CE2 3.44Å; V601-Y846 VanDerWaalsContact CG2-CE2 3.44Å; F624-Y846 HydrophobicContact CZ-CE1 4.03Å; A842-Y846 WeakPolarHBondContact O-CB 3.22Å; A842-Y846 PolarHBondContact O-N 3.28Å; Y846-K848 PolarHBondContact O-N 3.49Å; Y846-K848 VanDerWaalsContact O-N 3.17Å; Y846-I882 HydrophobicContact CD2-CD1 4.46Å; Y846-Y886 AromaticContact CD2-CD1 3.69Å; Y846-Y886 HydrophobicContact CD2-CD1 3.69Å; Y846-Y886 AromaticContact CD2-CE1 3.41Å; Y846-Y886 HydrophobicContact CD2-CE1 3.41Å; Y846-Y886 VanDerWaalsContact CD2-CE1 3.41Å; Y846-Y886 AromaticContact CE2-CD1 3.9Å; Y846-Y886 HydrophobicContact CE2-CD1 3.9Å; Y846-Y886 AromaticContact CE2-CE1 3.84Å; Y846-Y886 HydrophobicContact CE2-CE1 3.84Å; Y846-Y886 AromaticContact CG-CE1 3.99Å; Y846-Y886 HydrophobicContact CG-CE1 3.99Å
847	G	70.9	Confident	82.5	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	-6.4	-174.6	0	0	0	0	0	115.6	M585 T603 V845	M585-G847 WeakPolarHBondContact SD-CA 3.4Å; T603-G847 WeakPolarHBondContact CG2-O 3.07Å; V845-G847 PolarHBondContact O-N 3.41Å
848	K	76	Confident	82.7	Confident	48 Å²	48	28.3 Å²	28.3	21%	0.209	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.4	3.1	177.6	-64.4	177.6	-174.2	172.1	0	112.5	T582 W822 V845 Y846 L850 W855	T582-K848 HydrophobicContact CG2-CG 4.11Å; W822-K848 HydrophobicContact CD2-CD 4.11Å; W822-K848 HydrophobicContact CE3-CB 4.31Å; W822-K848 HydrophobicContact CE3-CD 4.29Å; W822-K848 HydrophobicContact CH2-CB 3.86Å; W822-K848 HydrophobicContact CH2-CD 4.47Å; W822-K848 HydrophobicContact CH2-CG 4.02Å; W822-K848 HydrophobicContact CZ2-CD 4.43Å; W822-K848 HydrophobicContact CZ2-CG 4.23Å; W822-K848 HydrophobicContact CZ3-CB 3.78Å; W822-K848 HydrophobicContact CZ3-CD 4.45Å; W822-K848 HydrophobicContact CZ3-CG 4.26Å; V845-K848 CarbonylContact O-C 3.51Å; V845-K848 PolarHBondContact O-N 3.47Å; Y846-K848 PolarHBondContact O-N 3.49Å; Y846-K848 VanDerWaalsContact O-N 3.17Å; K848-L850 VanDerWaalsContact C-N 3.29Å; K848-L850 PolarHBondContact O-N 2.93Å; K848-W855 HydrophobicContact CB-CZ2 3.81Å; K848-W855 HydrophobicContact CD-CZ2 3.96Å; K848-W855 PolarHBondContact O-NE1 3.21Å
849	N	71.4	Confident	82.6	Confident	38 Å²	38	28.4 Å²	28.4	20%	0.203	14%	0.143	C	C	.	.	S	Bend	trans	-69.6	-23.1	-177.3	60.4	-37	0	0	0	113.5	V845 I880 I882	V845-N849 PolarHBondContact O-N 3.12Å; N849-I880 HydrophobicContact CB-CB 4.34Å; N849-I880 HydrophobicContact CB-CG2 4.16Å; N849-I882 HydrophobicContact CB-CD1 4.29Å
850	L	69.1	Low	82.2	Confident	77 Å²	77	29.1 Å²	29.1	40%	0.403	15%	0.15	S	C	.	.	S	Bend	trans	-83.3	-28.4	-177.9	-76.8	150.7	0	0	0	113.6	V601 T603 K848 L852	V601-L850 WeakPolarHBondContact O-CD1 3.48Å; T603-L850 HydrophobicContact CG2-CD1 3.58Å; K848-L850 VanDerWaalsContact C-N 3.29Å; K848-L850 PolarHBondContact O-N 2.93Å; L850-L852 PolarHBondContact O-N 2.92Å
851	H	70.1	Confident	81.9	Confident	61 Å²	61	29.7 Å²	29.7	28%	0.282	15%	0.153	S	C	.	.			trans	-100.3	66.5	-178.8	-55.6	-75.4	0	0	0	111.8	A581 W822 E853 S854	A581-H851 WeakPolarHBondContact CB-NE2 3.21Å; W822-H851 HydrophobicContact CH2-CB 3.77Å; W822-H851 HydrophobicContact CZ3-CB 4.31Å; H851-E853 PolarHBondContact O-N 3.31Å; H851-S854 PolarHBondContact O-N 3.49Å; H851-S854 VanDerWaalsContact O-N 3.07Å
852	L	78	Confident	81.5	Confident	52 Å²	52	31.8 Å²	31.8	27%	0.272	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-57.1	-31.8	-178.3	-61.7	170.7	0	0	0	113.1	L850 S854 W855 V877 D878 I880	L850-L852 PolarHBondContact O-N 2.92Å; L852-S854 PolarHBondContact O-N 2.97Å; L852-W855 PolarHBondContact O-N 3.41Å; L852-W855 VanDerWaalsContact O-N 3.08Å; L852-V877 HydrophobicContact CD2-CG1 4.28Å; L852-D878 VanDerWaalsContact CD1-O 3.31Å; L852-D878 WeakPolarHBondContact CD1-O 3.41Å; L852-I880 HydrophobicContact CD2-CB 4.29Å; L852-I880 HydrophobicContact CD2-CD1 3.69Å; L852-I880 HydrophobicContact CD2-CG1 3.64Å
853	E	77.5	Confident	81.2	Confident	190 Å²	190	32 Å²	32	89%	0.888	16%	0.164	S	C	*	.	G	3₁₀ helix	trans	-62.6	-24.2	178.5	-59.7	-175.4	173.5	0	0	113.7	H851 W855	H851-E853 PolarHBondContact O-N 3.31Å; E853-W855 VanDerWaalsContact C-N 3.33Å
854	S	81.8	Confident	80.8	Confident	33 Å²	33	31.3 Å²	31.3	23%	0.231	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-85.1	-7.6	178.7	-68.4	0	0	0	0	113.3	W822 R823 H851 L852	W822-S854 WeakPolarHBondContact CA-O 3.32Å; W822-S854 VanDerWaalsContact CZ3-CB 3.49Å; R823-S854 PolarHBondContact N-O 3.32Å; H851-S854 PolarHBondContact O-N 3.49Å; H851-S854 VanDerWaalsContact O-N 3.07Å; L852-S854 PolarHBondContact O-N 2.97Å
855	W	88.3	Confident	80.4	Confident	1 Å²	1	35 Å²	35	0%	0.004	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	134.7	-179.6	-77.9	106.1	0	0	0	112.5	L820 W822 V845 K848 L852 E853 V877 I880 M898	L820-W855 HydrophobicContact CB-CE3 4.28Å; L820-W855 HydrophobicContact CB-CZ3 3.79Å; L820-W855 HydrophobicContact CD1-CZ3 4.49Å; W822-W855 HydrophobicContact CB-CE3 4.45Å; W822-W855 HydrophobicContact CB-CH2 4.46Å; W822-W855 HydrophobicContact CB-CZ3 4.23Å; W822-W855 AromaticContact CE3-CD1 3.66Å; W822-W855 AromaticContact CE3-CD2 3.69Å; W822-W855 HydrophobicContact CE3-CD2 3.69Å; W822-W855 AromaticContact CE3-CE2 3.4Å; W822-W855 HydrophobicContact CE3-CE3 4.36Å; W822-W855 AromaticContact CE3-CG 3.87Å; W822-W855 HydrophobicContact CE3-CG 3.87Å; W822-W855 AromaticContact CE3-CZ2 3.88Å; W822-W855 HydrophobicContact CE3-CZ2 3.88Å; W822-W855 AromaticContact CE3-NE1 3.4Å; W822-W855 AromaticContact CZ3-CD1 3.45Å; W822-W855 VanDerWaalsContact CZ3-CD1 3.45Å; W822-W855 HydrophobicContact CZ3-CD2 4.25Å; W822-W855 AromaticContact CZ3-CE2 3.73Å; W822-W855 HydrophobicContact CZ3-CG 4.11Å; W822-W855 HydrophobicContact CZ3-CZ2 4.37Å; W822-W855 AromaticContact CZ3-NE1 3.2Å; V845-W855 HydrophobicContact CG1-CH2 4.39Å; V845-W855 HydrophobicContact CG1-CZ2 4.05Å; K848-W855 HydrophobicContact CB-CZ2 3.81Å; K848-W855 HydrophobicContact CD-CZ2 3.96Å; K848-W855 PolarHBondContact O-NE1 3.21Å; L852-W855 PolarHBondContact O-N 3.41Å; L852-W855 VanDerWaalsContact O-N 3.08Å; E853-W855 VanDerWaalsContact C-N 3.33Å; W855-V877 HydrophobicContact CB-CB 4.06Å; W855-V877 HydrophobicContact CB-CG2 3.89Å; W855-I880 HydrophobicContact CG-CD1 4.29Å; W855-M898 HydrophobicContact CD2-CE 4.09Å; W855-M898 HydrophobicContact CE3-CE 4.26Å; W855-M898 HydrophobicContact CG-CE 4.29Å
856	S	89.8	Confident	80.2	Confident	22 Å²	22	39.4 Å²	39.4	15%	0.154	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	139.6	167.6	55.2	0	0	0	0	110.7	H821	H821-S856 WeakPolarHBondContact CB-OG 3.43Å; H821-S856 PolarHBondContact N-O 3.27Å; H821-S856 PolarHBondContact O-N 3.2Å
857	A	91.2	Very high	79.8	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	122	175.6	0	0	0	0	0	109.2	V818 L820 L838 L859 T874 R875 L900	V818-A857 HydrophobicContact CG1-CB 3.93Å; L820-A857 HydrophobicContact CD2-CB 4.27Å; L838-A857 HydrophobicContact CD1-CB 3.63Å; A857-L859 HydrophobicContact CB-CD1 4.33Å; A857-T874 CarbonylContact O-C 3.55Å; A857-T874 WeakPolarHBondContact O-CA 3.24Å; A857-R875 PolarHBondContact N-O 3.35Å; A857-R875 PolarHBondContact O-N 2.87Å; A857-L900 HydrophobicContact CB-CD2 3.75Å
858	V	89.5	Confident	80	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.012	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	120.3	-179.1	-172.1	0	0	0	0	109	S819 L861 V872 T874	S819-V858 PolarHBondContact N-O 3.23Å; S819-V858 PolarHBondContact O-N 3.12Å; V858-L861 HydrophobicContact CG1-CB 4.24Å; V858-L861 HydrophobicContact CG1-CD1 4.37Å; V858-L861 HydrophobicContact CG1-CD2 4.18Å; V858-V872 HydrophobicContact CG1-CG1 3.35Å; V858-T874 HydrophobicContact CG2-CG2 4.1Å
859	L	89.9	Confident	80.1	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.01	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	149.8	-175.9	-60.8	95.8	0	0	0	111.4	V818 L832 A857 L861 V872 Q873 I904 V910	V818-L859 HydrophobicContact CB-CG 4.41Å; V818-L859 HydrophobicContact CG1-CD1 4.38Å; V818-L859 HydrophobicContact CG1-CG 4.06Å; V818-L859 HydrophobicContact CG2-CD2 3.55Å; V818-L859 HydrophobicContact CG2-CG 3.73Å; L832-L859 HydrophobicContact CB-CD2 4.36Å; L832-L859 HydrophobicContact CD1-CD2 3.81Å; L832-L859 HydrophobicContact CD2-CD2 3.87Å; L832-L859 HydrophobicContact CG-CD2 4.23Å; A857-L859 HydrophobicContact CB-CD1 4.33Å; L859-L861 PolarHBondContact O-N 3.03Å; L859-V872 WeakPolarHBondContact O-CA 3.42Å; L859-Q873 WeakPolarHBondContact CD1-O 3.33Å; L859-Q873 PolarHBondContact N-O 3.03Å; L859-Q873 PolarHBondContact O-N 3.1Å; L859-I904 HydrophobicContact CD1-CD1 3.98Å; L859-I904 HydrophobicContact CD1-CG1 4.46Å; L859-I904 HydrophobicContact CD2-CG1 4.34Å; L859-V910 HydrophobicContact CB-CG1 4.33Å; L859-V910 HydrophobicContact CB-CG2 4.16Å; L859-V910 HydrophobicContact CD2-CG1 4.1Å
860	G	82.7	Confident	80.1	Confident	15 Å²	15	54.3 Å²	54.3	16%	0.155	29%	0.294	C	S	.	.	S	Bend	trans	75.3	13.5	-179.2	0	0	0	0	0	113.9
861	L	83.6	Confident	80.4	Confident	11 Å²	11	53 Å²	53	6%	0.058	29%	0.286	C	S	.	.			trans	-77.8	135.9	178.3	-164.9	68	0	0	0	110.3	V858 L859 A863 I867 V872 W933	V858-L861 HydrophobicContact CG1-CB 4.24Å; V858-L861 HydrophobicContact CG1-CD1 4.37Å; V858-L861 HydrophobicContact CG1-CD2 4.18Å; L859-L861 PolarHBondContact O-N 3.03Å; L861-A863 WeakPolarHBondContact CD1-O 3.45Å; L861-A863 WeakPolarHBondContact CG-O 3.44Å; L861-I867 HydrophobicContact CD1-CG1 4.13Å; L861-V872 HydrophobicContact CD1-CG1 4.41Å; L861-V872 HydrophobicContact CD1-CG2 3.84Å; L861-W933 HydrophobicContact CB-CH2 4.47Å; L861-W933 HydrophobicContact CB-CZ2 4.19Å; L861-W933 HydrophobicContact CD2-CZ2 4.45Å; L861-W933 HydrophobicContact CG-CZ2 4.46Å; L861-W933 WeakPolarHBondContact O-CZ2 3.39Å
862	H	81.3	Confident	81.1	Confident	44 Å²	44	51.1 Å²	51.1	20%	0.204	28%	0.279	C	S	.	.	S	Bend	trans	-110.5	-45.7	172.3	176.5	48	0	0	0	111.4	A809 K811 V945 L946	A809-H862 PolarHBondContact O-CE1 3.09Å; K811-H862 HydrophobicContact CG-CB 4.04Å; H862-V945 WeakPolarHBondContact CE1-CG1 3.05Å; H862-L946 PolarHBondContact O-N 3.07Å
863	A	80.8	Confident	81.5	Confident	4 Å²	4	49.8 Å²	49.8	3%	0.033	27%	0.271	C	S	.	.	B	Isolated β-bridge	trans	-117.1	136.8	173.1	0	0	0	0	0	111	L861 S865 Q866 D944 V945	L861-A863 WeakPolarHBondContact CD1-O 3.45Å; L861-A863 WeakPolarHBondContact CG-O 3.44Å; A863-S865 PolarHBondContact O-N 2.84Å; A863-Q866 HydrophobicContact CB-CB 4.41Å; A863-Q866 HydrophobicContact CB-CG 4.13Å; A863-Q866 PolarHBondContact O-N 3.3Å; A863-D944 CarbonylContact C-O 3.55Å; A863-D944 WeakPolarHBondContact CA-O 2.9Å; A863-V945 HydrophobicContact CB-CG2 4.48Å
864	Q	76.8	Confident	82	Confident	34 Å²	34	43.6 Å²	43.6	16%	0.159	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-62.4	-26.5	179	-69.3	-72.9	-22.3	0	0	112.4	S819 H821 Q866 I867 W933 D944	S819-Q864 PolarHBondContact OG-NE2 3.46Å; S819-Q864 VanDerWaalsContact OG-NE2 3.09Å; H821-Q864 PolarHBondContact NE2-OE1 3.29Å; Q864-Q866 VanDerWaalsContact C-N 3.25Å; Q864-Q866 PolarHBondContact O-N 3.01Å; Q864-I867 VanDerWaalsContact O-CD1 3.23Å; Q864-I867 WeakPolarHBondContact O-CD1 3.41Å; Q864-I867 VanDerWaalsContact O-CG1 3.25Å; Q864-I867 WeakPolarHBondContact O-CG1 3.28Å; Q864-W933 HydrophobicContact CG-CG 4.21Å; Q864-W933 VanDerWaalsContact NE2-CG 3.35Å; Q864-D944 WeakPolarHBondContact CA-OD1 3.11Å; Q864-D944 WeakPolarHBondContact CB-OD1 2.91Å; Q864-D944 PolarHBondContact N-O 2.9Å; Q864-D944 PolarHBondContact N-OD1 3.11Å
865	S	75.1	Confident	82.4	Confident	82 Å²	82	44.7 Å²	44.7	57%	0.573	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-69.8	-16.4	173.1	58	0	0	0	0	114.2	A863 D944	A863-S865 PolarHBondContact O-N 2.84Å; S865-D944 WeakPolarHBondContact CB-OD1 3.48Å; S865-D944 WeakPolarHBondContact CB-OD2 3.4Å; S865-D944 PolarHBondContact N-OD1 2.89Å; S865-D944 PolarHBondContact OG-OD1 2.86Å; S865-D944 PolarHBondContact OG-OD2 2.89Å
866	Q	78.8	Confident	82.4	Confident	93 Å²	93	48.9 Å²	48.9	44%	0.435	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-107.9	35.8	-171.2	-63.7	-176.9	-6.8	0	0	114	A863 Q864 Y868 A869	A863-Q866 HydrophobicContact CB-CB 4.41Å; A863-Q866 HydrophobicContact CB-CG 4.13Å; A863-Q866 PolarHBondContact O-N 3.3Å; Q864-Q866 VanDerWaalsContact C-N 3.25Å; Q864-Q866 PolarHBondContact O-N 3.01Å; Q866-Y868 PolarHBondContact O-N 2.73Å; Q866-Y868 VanDerWaalsContact O-N 3.14Å; Q866-A869 HydrophobicContact CB-CB 4.44Å; Q866-A869 WeakPolarHBondContact O-CB 3.37Å; Q866-A869 PolarHBondContact O-N 3.04Å; Q866-A869 VanDerWaalsContact O-N 3.1Å
867	I	74	Confident	82.2	Confident	52 Å²	52	48.2 Å²	48.2	27%	0.267	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-25.8	-177.2	-64.6	156.9	0	0	0	113.2	L861 Q864 V872	L861-I867 HydrophobicContact CD1-CG1 4.13Å; Q864-I867 VanDerWaalsContact O-CD1 3.23Å; Q864-I867 WeakPolarHBondContact O-CD1 3.41Å; Q864-I867 VanDerWaalsContact O-CG1 3.25Å; Q864-I867 WeakPolarHBondContact O-CG1 3.28Å; I867-V872 WeakPolarHBondContact O-CG1 3.33Å
868	Y	74.9	Confident	81.7	Confident	227 Å²	227	51.5 Å²	51.5	89%	0.89	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	8.9	179.5	-57.3	-74.1	0	0	0	114.4	Q866	Q866-Y868 PolarHBondContact O-N 2.73Å; Q866-Y868 VanDerWaalsContact O-N 3.14Å
869	A	76.6	Confident	81.3	Confident	26 Å²	26	54.9 Å²	54.9	22%	0.215	30%	0.296	C	S	.	.	S	Bend	trans	-63.5	145.6	177.2	0	0	0	0	0	111.2	Q866 E871 V872	Q866-A869 HydrophobicContact CB-CB 4.44Å; Q866-A869 WeakPolarHBondContact O-CB 3.37Å; Q866-A869 PolarHBondContact O-N 3.04Å; Q866-A869 VanDerWaalsContact O-N 3.1Å; A869-E871 HydrophobicContact CB-CG 4.19Å; A869-E871 PolarHBondContact O-N 3.36Å; A869-V872 HydrophobicContact CB-CG2 4.07Å; A869-V872 WeakPolarHBondContact O-CB 3.3Å; A869-V872 PolarHBondContact O-N 2.96Å
870	A	71.6	Confident	81.1	Confident	113 Å²	113	55.8 Å²	55.8	93%	0.934	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-18.6	-174.5	0	0	0	0	0	114.3
871	E	76.5	Confident	81.2	Confident	49 Å²	49	57 Å²	57	23%	0.229	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-13.8	177.3	57.8	-129	170.6	0	0	114.3	K811 A869 W909	K811-E871 WeakPolarHBondContact CE-OE1 3.45Å; K811-E871 IonicContact NZ-OE1 3.69Å; K811-E871 PolarHBondContact NZ-OE1 3.47Å; K811-E871 IonicContact NZ-OE2 2.7Å; K811-E871 PolarHBondContact NZ-OE2 2.73Å; K811-E871 VanDerWaalsContact NZ-OE2 3.14Å; A869-E871 HydrophobicContact CB-CG 4.19Å; A869-E871 PolarHBondContact O-N 3.36Å; E871-W909 HydrophobicContact CB-CG 4.28Å
872	V	85.1	Confident	81.3	Confident	21 Å²	21	57.7 Å²	57.7	13%	0.127	31%	0.306	C	S	.	.			trans	-83.5	133	-177.8	176.6	0	0	0	0	109.9	V858 L859 L861 I867 A869	V858-V872 HydrophobicContact CG1-CG1 3.35Å; L859-V872 WeakPolarHBondContact O-CA 3.42Å; L861-V872 HydrophobicContact CD1-CG1 4.41Å; L861-V872 HydrophobicContact CD1-CG2 3.84Å; I867-V872 WeakPolarHBondContact O-CG1 3.33Å; A869-V872 HydrophobicContact CB-CG2 4.07Å; A869-V872 WeakPolarHBondContact O-CB 3.3Å; A869-V872 PolarHBondContact O-N 2.96Å
873	Q	86.8	Confident	81.5	Confident	24 Å²	24	56.4 Å²	56.4	11%	0.112	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	116.4	175.2	-65.2	-179.6	71.8	0	0	110.1	L859 I904 N905	L859-Q873 WeakPolarHBondContact CD1-O 3.33Å; L859-Q873 PolarHBondContact N-O 3.03Å; L859-Q873 PolarHBondContact O-N 3.1Å; Q873-I904 HydrophobicContact CB-CD1 3.5Å; Q873-I904 HydrophobicContact CB-CG1 4.29Å; Q873-I904 HydrophobicContact CG-CD1 4.28Å; Q873-N905 PolarHBondContact NE2-O 2.82Å
874	T	87.8	Confident	81.6	Confident	61 Å²	61	65.1 Å²	65.1	37%	0.374	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	132.6	175.4	-53.4	0	0	0	0	110.4	A857 V858	A857-T874 CarbonylContact O-C 3.55Å; A857-T874 WeakPolarHBondContact O-CA 3.24Å; V858-T874 HydrophobicContact CG2-CG2 4.1Å
875	R	89.4	Confident	81.9	Confident	56 Å²	56	68.2 Å²	68.2	21%	0.211	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	143.8	176.6	-66	-63.6	178.8	-92.5	-0.6	110.9	A857 L900 I904	A857-R875 PolarHBondContact N-O 3.35Å; A857-R875 PolarHBondContact O-N 2.87Å; R875-L900 HydrophobicContact CB-CB 4.43Å; R875-L900 HydrophobicContact CB-CD1 4.25Å; R875-L900 HydrophobicContact CB-CD2 3.99Å; R875-L900 HydrophobicContact CB-CG 4.46Å; R875-L900 HydrophobicContact CG-CD1 4.4Å; R875-I904 HydrophobicContact CG-CD1 3.58Å
876	L	87.3	Confident	82.3	Confident	88 Å²	88	64.4 Å²	64.4	46%	0.461	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	156.5	170.6	-63.6	177.4	0	0	0	110.5	Q901	L876-Q901 HydrophobicContact CB-CB 4.44Å; L876-Q901 PolarHBondContact O-N 3.4Å
877	V	87.2	Confident	82.2	Confident	8 Å²	8	60.2 Å²	60.2	5%	0.048	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	133.4	178.9	-179.2	0	0	0	0	109.1	L852 W855 I880 M898 R899	L852-V877 HydrophobicContact CD2-CG1 4.28Å; W855-V877 HydrophobicContact CB-CB 4.06Å; W855-V877 HydrophobicContact CB-CG2 3.89Å; V877-I880 HydrophobicContact CG1-CD1 4.34Å; V877-I880 HydrophobicContact CG1-CG1 3.8Å; V877-M898 HydrophobicContact CB-CE 4.46Å; V877-M898 HydrophobicContact CG1-CB 4.2Å; V877-M898 HydrophobicContact CG1-CE 3.97Å; V877-M898 HydrophobicContact CG2-CE 3.86Å; V877-R899 WeakPolarHBondContact CA-O 3.36Å; V877-R899 WeakPolarHBondContact CG1-O 3.5Å
878	D	80.5	Confident	82.2	Confident	69 Å²	69	63.6 Å²	63.6	37%	0.369	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	-25	-178.7	176.5	68	0	0	0	112.6	L852 R899 Q901	L852-D878 VanDerWaalsContact CD1-O 3.31Å; L852-D878 WeakPolarHBondContact CD1-O 3.41Å; D878-R899 PolarHBondContact N-O 2.76Å; D878-R899 IonicContact OD2-CZ 3.46Å; D878-R899 VanDerWaalsContact OD2-CZ 3.25Å; D878-R899 IonicContact OD2-NE 3.61Å; D878-R899 PolarHBondContact OD2-NE 3.44Å; D878-R899 VanDerWaalsContact OD2-NE 3.08Å; D878-R899 IonicContact OD2-NH2 3.34Å; D878-R899 PolarHBondContact OD2-NH2 3.01Å; D878-Q901 HydrophobicContact CB-CB 4.1Å; D878-Q901 HydrophobicContact CB-CG 4.49Å
879	Q	81.1	Confident	82.1	Confident	74 Å²	74	58.7 Å²	58.7	35%	0.346	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	143.3	177.9	-164.9	175.9	7.5	0	0	111.5	I881 M898 R899	Q879-I881 HydrophobicContact CG-CG1 4.11Å; Q879-M898 CarbonylContact O-C 3.59Å; Q879-M898 WeakPolarHBondContact O-CA 3.41Å; Q879-R899 HydrophobicContact CB-CB 4.1Å; Q879-R899 PolarHBondContact N-O 3.03Å; Q879-R899 PolarHBondContact O-N 3.34Å
880	I	85.1	Confident	81.8	Confident	20 Å²	20	59.4 Å²	59.4	10%	0.103	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	128.7	172.2	-61.8	173	0	0	0	108.3	V845 N849 L852 W855 V877 I882 M898	V845-I880 HydrophobicContact CB-CG2 3.79Å; V845-I880 HydrophobicContact CG1-CD1 4.32Å; V845-I880 HydrophobicContact CG1-CG2 4.11Å; V845-I880 HydrophobicContact CG2-CG2 3.74Å; N849-I880 HydrophobicContact CB-CB 4.34Å; N849-I880 HydrophobicContact CB-CG2 4.16Å; L852-I880 HydrophobicContact CD2-CB 4.29Å; L852-I880 HydrophobicContact CD2-CD1 3.69Å; L852-I880 HydrophobicContact CD2-CG1 3.64Å; W855-I880 HydrophobicContact CG-CD1 4.29Å; V877-I880 HydrophobicContact CG1-CD1 4.34Å; V877-I880 HydrophobicContact CG1-CG1 3.8Å; I880-I882 HydrophobicContact CG2-CG1 4.45Å; I880-M898 HydrophobicContact CD1-CE 3.64Å; I880-M898 HydrophobicContact CG1-CE 3.8Å; I880-M898 HydrophobicContact CG1-CG 4.14Å; I880-M898 HydrophobicContact CG2-CG 4.5Å
881	I	84.8	Confident	82	Confident	41 Å²	41	56 Å²	56	21%	0.21	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	113.1	-178.2	-53.9	175.8	0	0	0	108.1	W837 Q879 A896 M897 W1032 T1036	W837-I881 HydrophobicContact CH2-CD1 4.16Å; W837-I881 HydrophobicContact CZ3-CD1 4.26Å; Q879-I881 HydrophobicContact CG-CG1 4.11Å; I881-A896 CarbonylContact O-C 3.59Å; I881-A896 VanDerWaalsContact O-CA 3.28Å; I881-A896 WeakPolarHBondContact O-CA 3.4Å; I881-A896 WeakPolarHBondContact O-CB 3.07Å; I881-M897 PolarHBondContact N-O 3.08Å; I881-M897 PolarHBondContact O-N 2.77Å; I881-W1032 HydrophobicContact CG2-CZ2 4.08Å; I881-T1036 HydrophobicContact CB-CG2 4.47Å; I881-T1036 HydrophobicContact CD1-CG2 3.47Å; I881-T1036 VanDerWaalsContact CD1-CG2 3.47Å; I881-T1036 HydrophobicContact CG2-CG2 4.22Å
882	I	85.6	Confident	82.2	Confident	26 Å²	26	55.7 Å²	55.7	13%	0.133	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	143.1	176.3	-60.6	172	0	0	0	108.9	A842 V845 Y846 N849 I880 Y886 A896	A842-I882 HydrophobicContact CB-CG2 3.73Å; V845-I882 HydrophobicContact CG2-CD1 4.02Å; V845-I882 HydrophobicContact CG2-CG1 3.8Å; Y846-I882 HydrophobicContact CD2-CD1 4.46Å; N849-I882 HydrophobicContact CB-CD1 4.29Å; I880-I882 HydrophobicContact CG2-CG1 4.45Å; I882-Y886 HydrophobicContact CG2-CD1 4.2Å; I882-Y886 HydrophobicContact CG2-CG 4.21Å; I882-A896 HydrophobicContact CG1-CB 4.33Å
883	H	85.1	Confident	82	Confident	17 Å²	17	54.8 Å²	54.8	8%	0.079	26%	0.257	C	S	.	.			trans	-61.8	137.2	175.8	-166.5	-94.2	0	0	0	112	E885 Y886 I895 F1029 W1032	H883-E885 VanDerWaalsContact C-N 3.27Å; H883-E885 IonicContact CE1-OE2 2.83Å; H883-E885 PolarHBondContact ND1-N 3.28Å; H883-E885 PolarHBondContact O-N 2.98Å; H883-Y886 VanDerWaalsContact O-CB 3.23Å; H883-Y886 WeakPolarHBondContact O-CB 3.25Å; H883-Y886 PolarHBondContact O-N 2.75Å; H883-Y886 VanDerWaalsContact O-N 3.09Å; H883-I895 HydrophobicContact CB-CG2 3.79Å; H883-I895 WeakPolarHBondContact CB-O 2.98Å; H883-I895 PolarHBondContact N-O 2.74Å; H883-F1029 AromaticContact CD2-CD1 3.78Å; H883-F1029 AromaticContact CE1-CE1 3.77Å; H883-F1029 AromaticContact NE2-CD1 3.59Å; H883-F1029 AromaticContact NE2-CE1 3.73Å; H883-W1032 HydrophobicContact CB-CZ2 4.35Å; H883-W1032 AromaticContact CD2-CD1 3.87Å; H883-W1032 AromaticContact CD2-CD2 3.59Å; H883-W1032 AromaticContact CD2-CE2 3.7Å; H883-W1032 AromaticContact CD2-CG 3.73Å; H883-W1032 AromaticContact CD2-NE1 3.85Å
884	R	83.1	Confident	82	Confident	186 Å²	186	53.7 Å²	53.7	70%	0.702	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-27	-175.1	-65.8	-175.7	-178.8	-174.1	-0.2	113.9	L598 Y886	L598-R884 VanDerWaalsContact CB-O 3.3Å; L598-R884 WeakPolarHBondContact CB-O 3.18Å; L598-R884 PolarHBondContact N-O 3.42Å; R884-Y886 VanDerWaalsContact C-N 3.26Å
885	E	83.1	Confident	82	Confident	100 Å²	100	50.8 Å²	50.8	47%	0.467	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	11.4	178.6	-56.6	178.3	159.6	0	0	112.4	H883 N887 H892	H883-E885 VanDerWaalsContact C-N 3.27Å; H883-E885 IonicContact CE1-OE2 2.83Å; H883-E885 PolarHBondContact ND1-N 3.28Å; H883-E885 PolarHBondContact O-N 2.98Å; E885-N887 PolarHBondContact O-N 2.87Å; E885-H892 PolarHBondContact O-CD2 2.58Å; E885-H892 IonicContact OE2-NE2 3.76Å
886	Y	83.7	Confident	82	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.008	22%	0.224	C	C	.	.			trans	-62.4	126.2	-179.9	-180	-117.2	0	0	0	111.3	R589 A842 H843 Y846 I882 H883 R884 H892 G893 D894	R589-Y886 PolarHBondContact NH1-O 3.41Å; R589-Y886 PolarHBondContact NH2-O 2.81Å; A842-Y886 HydrophobicContact CB-CD1 4.04Å; A842-Y886 HydrophobicContact CB-CD2 3.66Å; A842-Y886 HydrophobicContact CB-CE1 4.17Å; A842-Y886 HydrophobicContact CB-CE2 3.8Å; A842-Y886 HydrophobicContact CB-CG 3.78Å; H843-Y886 WeakPolarHBondContact CA-OH 3.27Å; H843-Y886 WeakPolarHBondContact CB-OH 3.45Å; Y846-Y886 AromaticContact CD2-CD1 3.69Å; Y846-Y886 HydrophobicContact CD2-CD1 3.69Å; Y846-Y886 AromaticContact CD2-CE1 3.41Å; Y846-Y886 HydrophobicContact CD2-CE1 3.41Å; Y846-Y886 VanDerWaalsContact CD2-CE1 3.41Å; Y846-Y886 AromaticContact CE2-CD1 3.9Å; Y846-Y886 HydrophobicContact CE2-CD1 3.9Å; Y846-Y886 AromaticContact CE2-CE1 3.84Å; Y846-Y886 HydrophobicContact CE2-CE1 3.84Å; Y846-Y886 AromaticContact CG-CE1 3.99Å; Y846-Y886 HydrophobicContact CG-CE1 3.99Å; I882-Y886 HydrophobicContact CG2-CD1 4.2Å; I882-Y886 HydrophobicContact CG2-CG 4.21Å; H883-Y886 VanDerWaalsContact O-CB 3.23Å; H883-Y886 WeakPolarHBondContact O-CB 3.25Å; H883-Y886 PolarHBondContact O-N 2.75Å; H883-Y886 VanDerWaalsContact O-N 3.09Å; R884-Y886 VanDerWaalsContact C-N 3.26Å; Y886-H892 VanDerWaalsContact CA-O 3.29Å; Y886-H892 WeakPolarHBondContact CA-O 3.3Å; Y886-H892 WeakPolarHBondContact CD2-O 3.41Å; Y886-G893 WeakPolarHBondContact CD2-O 3.2Å; Y886-D894 HydrophobicContact CD2-CB 4.02Å; Y886-D894 HydrophobicContact CE2-CB 3.61Å; Y886-D894 WeakPolarHBondContact CE2-OD1 3.44Å
887	N	77.1	Confident	82.1	Confident	5 Å²	5	43.9 Å²	43.9	3%	0.027	20%	0.202	C	C	.	.			trans	-125.6	121.2	175.1	-179.8	-26.3	0	0	0	109.8	S594 N595 E885 L889 T890 K891 H892	S594-N887 PolarHBondContact O-ND2 3.35Å; N595-N887 PolarHBondContact OD1-ND2 3.41Å; E885-N887 PolarHBondContact O-N 2.87Å; N887-L889 VanDerWaalsContact C-N 3.33Å; N887-L889 PolarHBondContact O-N 2.96Å; N887-L889 PolarHBondContact OD1-N 3.37Å; N887-T890 WeakPolarHBondContact CB-OG1 3.32Å; N887-T890 PolarHBondContact ND2-OG1 2.64Å; N887-T890 PolarHBondContact OD1-N 2.85Å; N887-K891 WeakPolarHBondContact O-CA 3.19Å; N887-K891 PolarHBondContact O-N 3.39Å; N887-H892 HydrophobicContact CB-CB 4.46Å; N887-H892 PolarHBondContact N-O 2.81Å
888	R	74.8	Confident	82.2	Confident	122 Å²	122	43.5 Å²	43.5	46%	0.46	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-33.5	-177.1	179.4	179.8	170.5	-175.2	-0.5	113.4	K891	R888-K891 WeakPolarHBondContact O-CD 3.45Å; R888-K891 VanDerWaalsContact O-CE 3.22Å; R888-K891 WeakPolarHBondContact O-CE 3.37Å; R888-K891 PolarHBondContact O-NZ 2.81Å
889	L	71.8	Confident	82.5	Confident	124 Å²	124	43 Å²	43	65%	0.649	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-50.9	-175.3	-66.2	172.1	0	0	0	111.2	N887 K891	N887-L889 VanDerWaalsContact C-N 3.33Å; N887-L889 PolarHBondContact O-N 2.96Å; N887-L889 PolarHBondContact OD1-N 3.37Å; L889-K891 VanDerWaalsContact C-N 3.31Å
890	T	71.3	Confident	82.7	Confident	41 Å²	41	39.8 Å²	39.8	25%	0.252	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-10.1	-179.4	61.8	0	0	0	0	113.1	N887 H892	N887-T890 WeakPolarHBondContact CB-OG1 3.32Å; N887-T890 PolarHBondContact ND2-OG1 2.64Å; N887-T890 PolarHBondContact OD1-N 2.85Å; T890-H892 PolarHBondContact O-N 3.32Å; T890-H892 VanDerWaalsContact O-N 3.08Å; T890-H892 WeakPolarHBondContact OG1-CB 3.37Å; T890-H892 PolarHBondContact OG1-N 2.96Å
891	K	75.1	Confident	82.4	Confident	41 Å²	41	44.2 Å²	44.2	18%	0.178	20%	0.198	C	C	.	.			trans	56.1	17.9	-172.1	-55.6	-60.7	-175.3	-164.3	0	113.8	N887 R888 L889 D894 I1008 F1010	N887-K891 WeakPolarHBondContact O-CA 3.19Å; N887-K891 PolarHBondContact O-N 3.39Å; R888-K891 WeakPolarHBondContact O-CD 3.45Å; R888-K891 VanDerWaalsContact O-CE 3.22Å; R888-K891 WeakPolarHBondContact O-CE 3.37Å; R888-K891 PolarHBondContact O-NZ 2.81Å; L889-K891 VanDerWaalsContact C-N 3.31Å; K891-D894 WeakPolarHBondContact O-CB 3.28Å; K891-I1008 HydrophobicContact CB-CG2 3.84Å; K891-I1008 HydrophobicContact CG-CG2 4.29Å; K891-F1010 HydrophobicContact CB-CD1 3.93Å; K891-F1010 HydrophobicContact CB-CE1 4.17Å; K891-F1010 HydrophobicContact CG-CB 4.34Å; K891-F1010 HydrophobicContact CG-CD1 3.86Å; K891-F1010 HydrophobicContact CG-CG 4.34Å
892	H	81.8	Confident	82.1	Confident	44 Å²	44	47.8 Å²	47.8	20%	0.204	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	140	173.8	-174.1	65.9	0	0	0	109.8	E885 Y886 N887 T890 D894 T969 S971	E885-H892 PolarHBondContact O-CD2 2.58Å; E885-H892 IonicContact OE2-NE2 3.76Å; Y886-H892 VanDerWaalsContact CA-O 3.29Å; Y886-H892 WeakPolarHBondContact CA-O 3.3Å; Y886-H892 WeakPolarHBondContact CD2-O 3.41Å; N887-H892 HydrophobicContact CB-CB 4.46Å; N887-H892 PolarHBondContact N-O 2.81Å; T890-H892 PolarHBondContact O-N 3.32Å; T890-H892 VanDerWaalsContact O-N 3.08Å; T890-H892 WeakPolarHBondContact OG1-CB 3.37Å; T890-H892 PolarHBondContact OG1-N 2.96Å; H892-D894 VanDerWaalsContact C-N 3.3Å; H892-D894 PolarHBondContact O-N 3.3Å; H892-T969 PolarHBondContact ND1-OG1 2.87Å; H892-T969 VanDerWaalsContact ND1-OG1 3.16Å; H892-S971 PolarHBondContact CE1-OG 3.06Å; H892-S971 VanDerWaalsContact CE1-OG 3.3Å; H892-S971 PolarHBondContact ND1-OG 3.09Å
893	G	80.7	Confident	81.8	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.01	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.9	25.3	178.2	0	0	0	0	0	114.9	Y886 I895	Y886-G893 WeakPolarHBondContact CD2-O 3.2Å; G893-I895 PolarHBondContact O-N 2.88Å
894	D	85.9	Confident	81.7	Confident	1 Å²	1	50 Å²	50	1%	0.005	23%	0.231	C	C	.	.			trans	-74.6	66.2	-177.3	-163.7	-0.4	0	0	0	113	A842 H843 Y886 K891 H892 I1008	A842-D894 VanDerWaalsContact CA-OD1 3.26Å; A842-D894 WeakPolarHBondContact CA-OD1 3.1Å; A842-D894 VanDerWaalsContact CB-OD1 3.29Å; A842-D894 WeakPolarHBondContact CB-OD1 3.49Å; A842-D894 PolarHBondContact N-OD1 2.76Å; H843-D894 IonicContact CE1-OD2 3.93Å; H843-D894 IonicContact CG-OD2 3.42Å; H843-D894 PolarHBondContact N-OD1 3.44Å; H843-D894 IonicContact ND1-OD1 3.83Å; H843-D894 IonicContact ND1-OD2 3.2Å; H843-D894 PolarHBondContact ND1-OD2 2.92Å; Y886-D894 HydrophobicContact CD2-CB 4.02Å; Y886-D894 HydrophobicContact CE2-CB 3.61Å; Y886-D894 WeakPolarHBondContact CE2-OD1 3.44Å; K891-D894 WeakPolarHBondContact O-CB 3.28Å; H892-D894 VanDerWaalsContact C-N 3.3Å; H892-D894 PolarHBondContact O-N 3.3Å; D894-I1008 HydrophobicContact CB-CD1 3.95Å; D894-I1008 HydrophobicContact CB-CG1 3.92Å; D894-I1008 HydrophobicContact CB-CG2 3.87Å; D894-I1008 VanDerWaalsContact OD2-CG2 3.29Å; D894-I1008 WeakPolarHBondContact OD2-CG2 3.18Å
895	I	88.2	Confident	81.7	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.226	C	C	.	.			trans	-140.6	137.6	179.9	-163.9	169.9	0	0	0	109.7	L839 H883 G893 F1029 W1032 I1033	L839-I895 HydrophobicContact CD1-CD1 3.93Å; L839-I895 HydrophobicContact CD1-CG1 3.86Å; L839-I895 HydrophobicContact CD2-CD1 4.44Å; L839-I895 HydrophobicContact CG-CD1 4.47Å; L839-I895 HydrophobicContact CG-CG1 4.45Å; H883-I895 HydrophobicContact CB-CG2 3.79Å; H883-I895 WeakPolarHBondContact CB-O 2.98Å; H883-I895 PolarHBondContact N-O 2.74Å; G893-I895 PolarHBondContact O-N 2.88Å; I895-F1029 HydrophobicContact CB-CD2 4.47Å; I895-F1029 HydrophobicContact CD1-CB 3.88Å; I895-F1029 HydrophobicContact CD1-CD2 3.88Å; I895-F1029 HydrophobicContact CD1-CG 4.06Å; I895-F1029 HydrophobicContact CG2-CB 4.45Å; I895-F1029 HydrophobicContact CG2-CD1 3.94Å; I895-F1029 HydrophobicContact CG2-CD2 4.03Å; I895-F1029 HydrophobicContact CG2-CE1 4.17Å; I895-F1029 HydrophobicContact CG2-CE2 4.25Å; I895-F1029 HydrophobicContact CG2-CG 3.87Å; I895-F1029 HydrophobicContact CG2-CZ 4.31Å; I895-W1032 HydrophobicContact CD1-CZ3 4.49Å; I895-W1032 HydrophobicContact CG1-CZ3 4.28Å; I895-W1032 HydrophobicContact CG2-CE3 4.34Å; I895-W1032 HydrophobicContact CG2-CH2 4.46Å; I895-W1032 HydrophobicContact CG2-CZ3 3.94Å; I895-I1033 HydrophobicContact CD1-CD1 4.27Å
896	A	89.8	Confident	81.6	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	149.8	176.8	0	0	0	0	0	111.2	T840 A842 V845 I881 I882	T840-A896 HydrophobicContact CG2-CB 4.22Å; T840-A896 PolarHBondContact N-O 3.33Å; T840-A896 PolarHBondContact O-N 3.19Å; T840-A896 VanDerWaalsContact O-O 3.11Å; A842-A896 HydrophobicContact CB-CB 4.28Å; V845-A896 HydrophobicContact CG2-CB 3.66Å; I881-A896 CarbonylContact O-C 3.59Å; I881-A896 VanDerWaalsContact O-CA 3.28Å; I881-A896 WeakPolarHBondContact O-CA 3.4Å; I881-A896 WeakPolarHBondContact O-CB 3.07Å; I882-A896 HydrophobicContact CG1-CB 4.33Å
897	M	89.1	Confident	81.5	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	138.9	174.3	-73.4	-177.8	59.2	0	0	110	I833 W837 L838 L839 I881 W1032 I1033 T1036 R1037	I833-M897 HydrophobicContact CD1-CE 4.02Å; W837-M897 HydrophobicContact CD2-CE 3.95Å; W837-M897 HydrophobicContact CE3-CB 4.31Å; W837-M897 HydrophobicContact CE3-CE 3.47Å; W837-M897 VanDerWaalsContact CE3-CE 3.47Å; W837-M897 HydrophobicContact CG-CE 4.48Å; W837-M897 HydrophobicContact CZ3-CB 4.25Å; W837-M897 HydrophobicContact CZ3-CE 3.86Å; L838-M897 WeakPolarHBondContact O-CA 3.43Å; L839-M897 HydrophobicContact CD1-CG 3.8Å; I881-M897 PolarHBondContact N-O 3.08Å; I881-M897 PolarHBondContact O-N 2.77Å; M897-W1032 HydrophobicContact CB-CH2 4.29Å; M897-W1032 HydrophobicContact CG-CH2 3.81Å; M897-W1032 HydrophobicContact CG-CZ3 3.82Å; M897-W1032 HydrophobicContact SD-CE3 4.46Å; M897-W1032 HydrophobicContact SD-CH2 4.19Å; M897-W1032 HydrophobicContact SD-CZ3 3.95Å; M897-I1033 HydrophobicContact CE-CG2 4.37Å; M897-I1033 HydrophobicContact SD-CB 4.2Å; M897-I1033 HydrophobicContact SD-CG1 4.11Å; M897-I1033 HydrophobicContact SD-CG2 4.01Å; M897-T1036 HydrophobicContact CE-CG2 4.13Å; M897-T1036 HydrophobicContact SD-CG2 3.9Å; M897-R1037 HydrophobicContact CE-CG 4.17Å
898	M	88.9	Confident	81.6	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	134.8	175.9	-50	174.7	78.8	0	0	109.4	L820 L838 T840 V845 W855 V877 Q879 I880	L820-M898 HydrophobicContact CD1-SD 3.67Å; L820-M898 HydrophobicContact CD2-CE 4.34Å; L820-M898 HydrophobicContact CD2-SD 3.83Å; L820-M898 HydrophobicContact CG-SD 4.43Å; L838-M898 HydrophobicContact CB-CB 4.25Å; L838-M898 PolarHBondContact N-O 3.26Å; L838-M898 PolarHBondContact O-N 3.35Å; T840-M898 HydrophobicContact CG2-CG 4.07Å; T840-M898 HydrophobicContact CG2-SD 3.79Å; V845-M898 HydrophobicContact CG1-CE 4.06Å; V845-M898 HydrophobicContact CG1-SD 4.04Å; W855-M898 HydrophobicContact CD2-CE 4.09Å; W855-M898 HydrophobicContact CE3-CE 4.26Å; W855-M898 HydrophobicContact CG-CE 4.29Å; V877-M898 HydrophobicContact CB-CE 4.46Å; V877-M898 HydrophobicContact CG1-CB 4.2Å; V877-M898 HydrophobicContact CG1-CE 3.97Å; V877-M898 HydrophobicContact CG2-CE 3.86Å; Q879-M898 CarbonylContact O-C 3.59Å; Q879-M898 WeakPolarHBondContact O-CA 3.41Å; I880-M898 HydrophobicContact CD1-CE 3.64Å; I880-M898 HydrophobicContact CG1-CE 3.8Å; I880-M898 HydrophobicContact CG1-CG 4.14Å; I880-M898 HydrophobicContact CG2-CG 4.5Å
899	R	87.2	Confident	82	Confident	58 Å²	58	48.4 Å²	48.4	22%	0.219	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	132.6	175.1	-170.7	173.2	70	-166.6	-1.7	110.4	D836 W837 V877 D878 Q879	D836-R899 CarbonylContact O-C 3.55Å; D836-R899 WeakPolarHBondContact O-CA 3.4Å; W837-R899 HydrophobicContact CD2-CB 4.49Å; W837-R899 HydrophobicContact CE3-CB 4.08Å; W837-R899 HydrophobicContact CH2-CB 4.04Å; W837-R899 HydrophobicContact CH2-CG 4.38Å; W837-R899 HydrophobicContact CZ2-CB 4.41Å; W837-R899 HydrophobicContact CZ2-CG 4.27Å; W837-R899 HydrophobicContact CZ3-CB 3.84Å; V877-R899 WeakPolarHBondContact CA-O 3.36Å; V877-R899 WeakPolarHBondContact CG1-O 3.5Å; D878-R899 PolarHBondContact N-O 2.76Å; D878-R899 IonicContact OD2-CZ 3.46Å; D878-R899 VanDerWaalsContact OD2-CZ 3.25Å; D878-R899 IonicContact OD2-NE 3.61Å; D878-R899 PolarHBondContact OD2-NE 3.44Å; D878-R899 VanDerWaalsContact OD2-NE 3.08Å; D878-R899 IonicContact OD2-NH2 3.34Å; D878-R899 PolarHBondContact OD2-NH2 3.01Å; Q879-R899 HydrophobicContact CB-CB 4.1Å; Q879-R899 PolarHBondContact N-O 3.03Å; Q879-R899 PolarHBondContact O-N 3.34Å
900	L	84.8	Confident	82.6	Confident	6 Å²	6	42.5 Å²	42.5	3%	0.031	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	143.9	174.5	-59	179.5	0	0	0	110.6	D836 L838 A857 R875 Q902	D836-L900 PolarHBondContact O-N 3.4Å; L838-L900 HydrophobicContact CD1-CD2 3.82Å; L838-L900 HydrophobicContact CD1-CG 4.48Å; L838-L900 HydrophobicContact CG-CD2 4.24Å; L838-L900 HydrophobicContact CG-CG 4.37Å; A857-L900 HydrophobicContact CB-CD2 3.75Å; R875-L900 HydrophobicContact CB-CB 4.43Å; R875-L900 HydrophobicContact CB-CD1 4.25Å; R875-L900 HydrophobicContact CB-CD2 3.99Å; R875-L900 HydrophobicContact CB-CG 4.46Å; R875-L900 HydrophobicContact CG-CD1 4.4Å; L900-Q902 PolarHBondContact O-N 3.4Å
901	Q	79.7	Confident	83.3	Confident	114 Å²	114	41.8 Å²	41.8	53%	0.533	20%	0.204	S	C	.	.	S	Bend	trans	-64.9	-30.6	177	-167.8	-176.3	31.9	0	0	112.8	L876 D878	L876-Q901 HydrophobicContact CB-CB 4.44Å; L876-Q901 PolarHBondContact O-N 3.4Å; D878-Q901 HydrophobicContact CB-CB 4.1Å; D878-Q901 HydrophobicContact CB-CG 4.49Å
902	Q	76.8	Confident	83.8	Confident	115 Å²	115	40 Å²	40	54%	0.537	20%	0.196	S	C	.	.	S	Bend	trans	-134	142.1	177.1	-63.9	179.6	1.7	0	0	110	L900	L900-Q902 PolarHBondContact O-N 3.4Å
903	P	79.6	Confident	84	Confident	83 Å²	83	37.9 Å²	37.9	54%	0.539	19%	0.187	S	C	.	.	P	Polyproline II helix	trans	-63.8	146.1	177.1	27.4	-33.9	0	0	0	111.3	S835	S835-P903 CarbonylContact O-C 3.56Å; S835-P903 WeakPolarHBondContact O-CA 3.37Å
904	I	82.9	Confident	84.2	Confident	7 Å²	7	38.6 Å²	38.6	4%	0.036	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-85.8	149.4	177.6	-150.1	70.4	0	0	0	110.8	L832 S835 L859 Q873 R875 F906 V910	L832-I904 HydrophobicContact CD1-CG2 4.41Å; L832-I904 HydrophobicContact CD2-CG2 4.21Å; S835-I904 WeakPolarHBondContact O-CG2 3.33Å; S835-I904 PolarHBondContact O-N 2.85Å; L859-I904 HydrophobicContact CD1-CD1 3.98Å; L859-I904 HydrophobicContact CD1-CG1 4.46Å; L859-I904 HydrophobicContact CD2-CG1 4.34Å; Q873-I904 HydrophobicContact CB-CD1 3.5Å; Q873-I904 HydrophobicContact CB-CG1 4.29Å; Q873-I904 HydrophobicContact CG-CD1 4.28Å; R875-I904 HydrophobicContact CG-CD1 3.58Å; I904-F906 HydrophobicContact CG2-CD1 4.29Å; I904-F906 HydrophobicContact CG2-CE1 4.07Å; I904-V910 HydrophobicContact CG1-CG1 4.12Å; I904-V910 HydrophobicContact CG2-CG1 4.23Å
905	N	82.9	Confident	84	Confident	111 Å²	111	40.6 Å²	40.6	59%	0.594	20%	0.202	S	C	*	.	P	Polyproline II helix	trans	-90	126.1	172.1	-69.1	-26.3	0	0	0	109.6	Q873 T907	Q873-N905 PolarHBondContact NE2-O 2.82Å; N905-T907 PolarHBondContact O-N 3.17Å
906	F	81.6	Confident	83.5	Confident	79 Å²	79	40.7 Å²	40.7	35%	0.346	20%	0.202	S	C	.	.	P	Polyproline II helix	trans	-71.9	129.7	175.2	-59.5	-51.2	0	0	0	110.6	L832 I904 V910 P912	L832-F906 HydrophobicContact CD2-CE1 4.18Å; I904-F906 HydrophobicContact CG2-CD1 4.29Å; I904-F906 HydrophobicContact CG2-CE1 4.07Å; F906-V910 WeakPolarHBondContact CA-O 3.27Å; F906-P912 HydrophobicContact CE1-CB 4.45Å; F906-P912 HydrophobicContact CE1-CG 4.01Å; F906-P912 HydrophobicContact CZ-CG 4.23Å
907	T	81.7	Confident	82.6	Confident	48 Å²	48	43.4 Å²	43.4	29%	0.294	23%	0.225	S	C	.	.			trans	-132.9	179.9	179.5	65.6	0	0	0	0	109.4	N905 W909 V910 Q911	N905-T907 PolarHBondContact O-N 3.17Å; T907-W909 PolarHBondContact O-N 2.99Å; T907-W909 PolarHBondContact OG1-N 2.74Å; T907-V910 PolarHBondContact N-O 2.52Å; T907-V910 CarbonylContact O-C 3.53Å; T907-V910 PolarHBondContact O-N 3.37Å; T907-V910 PolarHBondContact OG1-N 3.3Å; T907-Q911 PolarHBondContact O-NE2 2.83Å
908	Q	79.7	Confident	81.8	Confident	98 Å²	98	50 Å²	50	46%	0.458	26%	0.255	S	S	.	.	S	Bend	trans	-60.9	-21.5	172.6	67.4	-170.1	-1.3	0	0	113.5	Q784 V785	Q784-Q908 HydrophobicContact CB-CB 4.38Å; V785-Q908 HydrophobicContact CG2-CB 4.46Å
909	W	82.4	Confident	80.5	Confident	45 Å²	45	52.6 Å²	52.6	17%	0.17	28%	0.282	C	S	.	.	S	Bend	trans	-102.7	-13.6	-179.4	-47.6	117.1	0	0	0	113.6	V785 K811 P815 E871 T907	V785-W909 HydrophobicContact CG2-CE3 4.31Å; V785-W909 HydrophobicContact CG2-CH2 4.31Å; V785-W909 HydrophobicContact CG2-CZ3 3.84Å; K811-W909 HydrophobicContact CD-CH2 4.36Å; K811-W909 HydrophobicContact CG-CE3 4.48Å; K811-W909 HydrophobicContact CG-CH2 4.21Å; K811-W909 HydrophobicContact CG-CZ3 3.98Å; K811-W909 WeakPolarHBondContact O-CZ3 3.48Å; P815-W909 VanDerWaalsContact CA-O 3.23Å; P815-W909 WeakPolarHBondContact CA-O 3.11Å; P815-W909 WeakPolarHBondContact CB-O 3.44Å; E871-W909 HydrophobicContact CB-CG 4.28Å; T907-W909 PolarHBondContact O-N 2.99Å; T907-W909 PolarHBondContact OG1-N 2.74Å
910	V	85.6	Confident	79.7	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.283	C	S	.	.			trans	-128.9	101.8	-177.4	-176.9	0	0	0	0	108.6	P815 L832 L859 I904 F906 T907	P815-V910 WeakPolarHBondContact O-CA 3.39Å; L832-V910 HydrophobicContact CD2-CG1 3.65Å; L859-V910 HydrophobicContact CB-CG1 4.33Å; L859-V910 HydrophobicContact CB-CG2 4.16Å; L859-V910 HydrophobicContact CD2-CG1 4.1Å; I904-V910 HydrophobicContact CG1-CG1 4.12Å; I904-V910 HydrophobicContact CG2-CG1 4.23Å; F906-V910 WeakPolarHBondContact CA-O 3.27Å; T907-V910 PolarHBondContact N-O 2.52Å; T907-V910 CarbonylContact O-C 3.53Å; T907-V910 PolarHBondContact O-N 3.37Å; T907-V910 PolarHBondContact OG1-N 3.3Å
911	Q	84.3	Confident	79	Confident	27 Å²	27	57.6 Å²	57.6	13%	0.126	31%	0.312	C	S	.	.			trans	-137.7	147.2	178.7	-70.2	-64.9	-35	0	0	109.1	P815 W816 T907	P815-Q911 CarbonylContact C-O 3.57Å; P815-Q911 HydrophobicContact CB-CB 3.94Å; P815-Q911 HydrophobicContact CB-CG 4.31Å; P815-Q911 HydrophobicContact CG-CB 3.86Å; P815-Q911 HydrophobicContact CG-CG 4.36Å; P815-Q911 PolarHBondContact O-N 2.76Å; W816-Q911 WeakPolarHBondContact CA-O 3.36Å; W816-Q911 WeakPolarHBondContact CB-O 3.24Å; W816-Q911 PolarHBondContact N-O 3.3Å; T907-Q911 PolarHBondContact O-NE2 2.83Å
912	P	86.8	Confident	78.8	Confident	2 Å²	2	54 Å²	54	1%	0.013	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-84.4	149.8	179.8	33.5	-37	0	0	0	113.1	G781 L832 F906	G781-P912 PolarHBondContact N-O 3.25Å; L832-P912 HydrophobicContact CG-CB 4.3Å; L832-P912 CarbonylContact O-C 3.15Å; L832-P912 VanDerWaalsContact O-CA 3.24Å; L832-P912 WeakPolarHBondContact O-CA 3.33Å; F906-P912 HydrophobicContact CE1-CB 4.45Å; F906-P912 HydrophobicContact CE1-CG 4.01Å; F906-P912 HydrophobicContact CZ-CG 4.23Å
913	V	86.3	Confident	78.8	Confident	1 Å²	1	52 Å²	52	1%	0.006	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-83.6	156	176.2	73.5	0	0	0	0	111.9	W816 L832 I833 Q1003	W816-V913 HydrophobicContact CB-CB 3.87Å; W816-V913 HydrophobicContact CD2-CB 3.88Å; W816-V913 HydrophobicContact CD2-CG2 4.05Å; W816-V913 HydrophobicContact CE3-CB 4.4Å; W816-V913 HydrophobicContact CG-CB 3.63Å; W816-V913 HydrophobicContact CG-CG2 4.12Å; L832-V913 PolarHBondContact O-N 2.71Å; I833-V913 HydrophobicContact CG2-CG1 4.37Å; V913-Q1003 HydrophobicContact CG1-CB 3.98Å; V913-Q1003 HydrophobicContact CG2-CB 3.95Å
914	C	83.9	Confident	78.8	Confident	15 Å²	15	51 Å²	51	10%	0.101	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	151.7	168.1	-58.6	0	0	0	0	110.5	C780 W1001 Q1003	C780-C914 HydrophobicContact CB-CB 4.09Å; C780-C914 WeakPolarHBondContact CB-SG 3.38Å; C780-C914 PolarHBondContact O-SG 2.81Å; C780-C914 WeakPolarHBondContact SG-CA 2.98Å; C780-C914 WeakPolarHBondContact SG-CB 3.44Å; C780-C914 CovalentContact SG-SG 2.04Å; C780-C914 PolarHBondContact SG-SG 2.78Å; C914-W1001 WeakPolarHBondContact CB-O 3.38Å; C914-W1001 PolarHBondContact N-O 2.97Å; C914-Q1003 PolarHBondContact O-N 2.78Å
915	L	82	Confident	78.5	Confident	44 Å²	44	53.1 Å²	53.1	23%	0.23	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	143.3	175.3	-62.1	177.6	0	0	0	109.8	I833 L839 Q1003 V1026 I1033 R1037	I833-L915 HydrophobicContact CB-CD1 4.47Å; I833-L915 HydrophobicContact CG2-CD1 4.23Å; I833-L915 HydrophobicContact CG2-CD2 3.83Å; I833-L915 HydrophobicContact CG2-CG 4.3Å; L839-L915 HydrophobicContact CD2-CD2 4.1Å; L915-Q1003 HydrophobicContact CD2-CB 4.29Å; L915-V1026 HydrophobicContact CB-CG1 4.2Å; L915-V1026 HydrophobicContact CD2-CG1 3.94Å; L915-I1033 HydrophobicContact CD1-CD1 4.29Å; L915-I1033 HydrophobicContact CD1-CG2 3.98Å; L915-R1037 VanDerWaalsContact CD1-NH2 3.28Å
916	A	78.3	Confident	78.6	Confident	2 Å²	2	51.6 Å²	51.6	2%	0.017	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-61.3	137.1	173.9	0	0	0	0	0	111.1	F922 T1002 Q1003	A916-F922 HydrophobicContact CB-CE2 3.99Å; A916-F922 HydrophobicContact CB-CZ 4.29Å; A916-T1002 HydrophobicContact CB-CG2 4.11Å; A916-Q1003 PolarHBondContact N-O 2.9Å
917	A	71.2	Confident	78.7	Confident	57 Å²	57	55.8 Å²	55.8	47%	0.471	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-71.2	157.6	178.4	0	0	0	0	0	111.7	G919 Q920 S1027	A917-G919 PolarHBondContact O-N 3.31Å; A917-Q920 HydrophobicContact CB-CB 4.37Å; A917-Q920 VanDerWaalsContact O-CB 3.25Å; A917-Q920 WeakPolarHBondContact O-CB 3.01Å; A917-Q920 PolarHBondContact O-N 3.07Å; A917-Q920 VanDerWaalsContact O-N 3.08Å; A917-S1027 WeakPolarHBondContact O-CB 3.3Å
918	E	71.4	Confident	79	Confident	137 Å²	137	53.5 Å²	53.5	64%	0.64	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	129.7	177.1	-169.8	169	-165.6	0	0	110.8	Q920 A1030	E918-Q920 PolarHBondContact O-N 3.49Å; E918-A1030 HydrophobicContact CB-CB 4.17Å
919	G	62.2	Low	79.3	Confident	55 Å²	55	51.4 Å²	51.4	57%	0.567	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	0.5	-177.4	0	0	0	0	0	115.8	A917 N921	A917-G919 PolarHBondContact O-N 3.31Å; G919-N921 PolarHBondContact O-N 3.49Å
920	Q	69.7	Low	79.5	Confident	48 Å²	48	49.8 Å²	49.8	22%	0.224	29%	0.289	C	S	.	.			trans	-68.3	122.5	172.8	-168	177.5	3.9	0	0	109.9	A917 E918 F922 E997 S1027	A917-Q920 HydrophobicContact CB-CB 4.37Å; A917-Q920 VanDerWaalsContact O-CB 3.25Å; A917-Q920 WeakPolarHBondContact O-CB 3.01Å; A917-Q920 PolarHBondContact O-N 3.07Å; A917-Q920 VanDerWaalsContact O-N 3.08Å; E918-Q920 PolarHBondContact O-N 3.49Å; Q920-F922 HydrophobicContact CG-CE2 4.15Å; Q920-F922 HydrophobicContact CG-CZ 4.05Å; Q920-E997 PolarHBondContact NE2-OE2 2.84Å; Q920-S1027 PolarHBondContact O-OG 3.13Å
921	N	70.1	Confident	79.5	Confident	122 Å²	122	50 Å²	50	65%	0.652	29%	0.291	S	S	*	.			trans	-110.6	136.6	177.1	-76.4	-8.9	0	0	0	110	G919 R1025	G919-N921 PolarHBondContact O-N 3.49Å; N921-R1025 PolarHBondContact OD1-NH2 3.26Å
922	F	76.4	Confident	79.6	Confident	39 Å²	39	48.9 Å²	48.9	17%	0.171	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-101.7	138.8	174.6	-62.6	-89	0	0	0	109.1	A916 Q920 L953 I1004	A916-F922 HydrophobicContact CB-CE2 3.99Å; A916-F922 HydrophobicContact CB-CZ 4.29Å; Q920-F922 HydrophobicContact CG-CE2 4.15Å; Q920-F922 HydrophobicContact CG-CZ 4.05Å; F922-L953 HydrophobicContact CB-CD1 3.66Å; F922-I1004 HydrophobicContact CD1-CG2 4.32Å; F922-I1004 HydrophobicContact CD2-CB 4.21Å; F922-I1004 HydrophobicContact CD2-CG2 3.69Å; F922-I1004 HydrophobicContact CE1-CG2 3.92Å; F922-I1004 HydrophobicContact CE2-CB 4.01Å; F922-I1004 HydrophobicContact CE2-CG2 3.22Å; F922-I1004 HydrophobicContact CG-CG2 4.23Å; F922-I1004 HydrophobicContact CZ-CG2 3.35Å
923	A	76.6	Confident	79.3	Confident	71 Å²	71	49 Å²	49	59%	0.587	29%	0.287	S	S	*	.	P	Polyproline II helix	trans	-65.9	140.2	-179.9	0	0	0	0	0	111.5	R926	A923-R926 VanDerWaalsContact O-CB 3.32Å; A923-R926 WeakPolarHBondContact O-CB 3.42Å; A923-R926 PolarHBondContact O-N 3.34Å
924	A	78.1	Confident	78.6	Confident	63 Å²	63	49 Å²	49	52%	0.521	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	143.5	171.6	0	0	0	0	0	110.5	R926 E955	A924-R926 VanDerWaalsContact C-N 3.31Å; A924-R926 PolarHBondContact O-N 2.99Å; A924-E955 HydrophobicContact CB-CB 4.33Å
925	G	77.3	Confident	77.7	Confident	51 Å²	51	52.6 Å²	52.6	53%	0.526	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.2	-3.3	-174.7	0	0	0	0	0	115.2	R927 L953	G925-R927 PolarHBondContact O-N 3.09Å; G925-L953 PolarHBondContact N-O 3.2Å
926	R	85.1	Confident	76.4	Confident	80 Å²	80	51.9 Å²	51.9	30%	0.302	29%	0.294	S	S	.	.			trans	-65.3	132.4	172.7	-170.5	170.2	-174	163.4	-3.2	109.7	A923 A924 P952 L953 E996 E997	A923-R926 VanDerWaalsContact O-CB 3.32Å; A923-R926 WeakPolarHBondContact O-CB 3.42Å; A923-R926 PolarHBondContact O-N 3.34Å; A924-R926 VanDerWaalsContact C-N 3.31Å; A924-R926 PolarHBondContact O-N 2.99Å; R926-P952 WeakPolarHBondContact O-CA 2.99Å; R926-L953 HydrophobicContact CB-CD1 4.41Å; R926-L953 PolarHBondContact O-N 3.42Å; R926-E996 PolarHBondContact NH2-O 2.82Å; R926-E997 IonicContact NH1-OE1 3.85Å
927	R	84.1	Confident	75.1	Confident	166 Å²	166	53.8 Å²	53.8	63%	0.626	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	123.5	176.8	-67.4	-178.6	-175.6	-102.4	0.6	109.8	G925 T950	G925-R927 PolarHBondContact O-N 3.09Å; R927-T950 HydrophobicContact CB-CG2 3.84Å; R927-T950 HydrophobicContact CG-CG2 4.28Å
928	C	87	Confident	74.1	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	163	177.5	-59.6	0	0	0	0	109.1	T950 L951 L993 M994 C995	C928-T950 CarbonylContact O-C 3.58Å; C928-T950 WeakPolarHBondContact O-CA 3.43Å; C928-L951 PolarHBondContact N-O 3.25Å; C928-L951 PolarHBondContact O-N 3.02Å; C928-L993 HydrophobicContact CB-CD1 4.02Å; C928-L993 HydrophobicContact CB-CG 4.44Å; C928-M994 CarbonylContact C-O 3.6Å; C928-M994 WeakPolarHBondContact CA-O 3.42Å; C928-M994 VanDerWaalsContact CB-O 3.31Å; C928-M994 WeakPolarHBondContact CB-O 3.21Å; C928-C995 HydrophobicContact CB-CB 4.13Å; C928-C995 WeakPolarHBondContact CB-SG 3.38Å; C928-C995 WeakPolarHBondContact SG-CB 3.32Å; C928-C995 CovalentContact SG-SG 2.04Å; C928-C995 PolarHBondContact SG-SG 2.86Å
929	F	87.1	Confident	73.1	Confident	54 Å²	54	53.3 Å²	53.3	24%	0.237	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	142.2	-174.5	-70.8	-103.6	0	0	0	110.4	W814 A949 T950 M994 W1001	W814-F929 HydrophobicContact CH2-CB 3.71Å; W814-F929 HydrophobicContact CH2-CD1 4.22Å; W814-F929 AromaticContact CH2-CG 3.96Å; W814-F929 HydrophobicContact CH2-CG 3.96Å; W814-F929 HydrophobicContact CZ2-CB 3.9Å; W814-F929 HydrophobicContact CZ2-CD1 4Å; W814-F929 HydrophobicContact CZ2-CG 4.15Å; F929-A949 WeakPolarHBondContact CA-O 3.29Å; F929-T950 WeakPolarHBondContact CE1-OG1 3.46Å; F929-T950 HydrophobicContact CE2-CG2 4.37Å; F929-T950 HydrophobicContact CZ-CG2 4.3Å; F929-T950 WeakPolarHBondContact CZ-OG1 3.4Å; F929-M994 HydrophobicContact CB-CG 4.17Å; F929-M994 PolarHBondContact N-O 3.48Å; F929-M994 WeakPolarHBondContact O-CG 3.16Å; F929-M994 PolarHBondContact O-N 2.83Å; F929-W1001 HydrophobicContact CB-CZ3 4.18Å; F929-W1001 AromaticContact CD2-CH2 3.52Å; F929-W1001 HydrophobicContact CD2-CH2 3.52Å; F929-W1001 AromaticContact CD2-CZ3 3.55Å; F929-W1001 HydrophobicContact CD2-CZ3 3.55Å; F929-W1001 AromaticContact CE2-CH2 3.76Å; F929-W1001 HydrophobicContact CE2-CH2 3.76Å; F929-W1001 HydrophobicContact CE2-CZ3 4.21Å; F929-W1001 HydrophobicContact CG-CH2 4.09Å; F929-W1001 HydrophobicContact CG-CZ3 4.06Å; F929-W1001 HydrophobicContact CZ-CH2 4.49Å
930	I	86.9	Confident	72.9	Confident	11 Å²	11	51.5 Å²	51.5	6%	0.056	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	149.5	166.5	58.2	164	0	0	0	108.8	E948 A949 L951 L993 Y1023	I930-E948 WeakPolarHBondContact O-CA 3.35Å; I930-A949 HydrophobicContact CD1-CB 4.16Å; I930-A949 HydrophobicContact CG1-CB 3.84Å; I930-A949 PolarHBondContact N-O 2.78Å; I930-A949 PolarHBondContact O-N 3.37Å; I930-L951 HydrophobicContact CD1-CD1 3.71Å; I930-L951 HydrophobicContact CD1-CG 4.47Å; I930-L951 HydrophobicContact CG1-CD1 4.01Å; I930-L951 HydrophobicContact CG1-CG 4.46Å; I930-L951 HydrophobicContact CG2-CD1 3.95Å; I930-L993 HydrophobicContact CG2-CB 4.34Å; I930-L993 HydrophobicContact CG2-CD1 3.34Å; I930-L993 HydrophobicContact CG2-CG 4.43Å; I930-Y1023 HydrophobicContact CG2-CE1 3.87Å
931	A	85.4	Confident	72.3	Confident	5 Å²	5	52.8 Å²	52.8	4%	0.041	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	143.7	172.8	0	0	0	0	0	110.3	W814 M817 L946 Q947 M994	W814-A931 HydrophobicContact CG-CB 4.05Å; M817-A931 HydrophobicContact CE-CB 4.45Å; M817-A931 WeakPolarHBondContact CE-O 3.3Å; M817-A931 HydrophobicContact CG-CB 4.44Å; M817-A931 HydrophobicContact SD-CB 4.15Å; A931-L946 HydrophobicContact CB-CD1 4.43Å; A931-Q947 WeakPolarHBondContact CA-O 3.07Å; A931-Q947 WeakPolarHBondContact CB-O 3.05Å; A931-M994 HydrophobicContact CB-CE 4.44Å
932	G	85.2	Confident	72.1	Confident	4 Å²	4	50.5 Å²	50.5	4%	0.041	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.2	178	-180	0	0	0	0	0	114.4	Q947 D988	G932-Q947 PolarHBondContact N-O 3.02Å; G932-Q947 VanDerWaalsContact N-O 3.14Å; G932-Q947 PolarHBondContact O-N 3.11Å; G932-D988 WeakPolarHBondContact CA-OD1 3.34Å
933	W	81.6	Confident	71.8	Confident	3 Å²	3	49 Å²	49	1%	0.011	29%	0.292	C	S	.	.			trans	-112.1	23.4	178.7	-64.9	-85.3	0	0	0	111.5	M817 L861 Q864 L942 L946 D988	M817-W933 HydrophobicContact CB-CH2 4.17Å; M817-W933 HydrophobicContact CB-CZ3 4.44Å; M817-W933 HydrophobicContact CE-CE3 4.45Å; M817-W933 HydrophobicContact CE-CZ3 4Å; L861-W933 HydrophobicContact CB-CH2 4.47Å; L861-W933 HydrophobicContact CB-CZ2 4.19Å; L861-W933 HydrophobicContact CD2-CZ2 4.45Å; L861-W933 HydrophobicContact CG-CZ2 4.46Å; L861-W933 WeakPolarHBondContact O-CZ2 3.39Å; Q864-W933 HydrophobicContact CG-CG 4.21Å; Q864-W933 VanDerWaalsContact NE2-CG 3.35Å; W933-L942 WeakPolarHBondContact O-CD2 3.26Å; W933-L946 HydrophobicContact CD2-CD1 3.78Å; W933-L946 HydrophobicContact CE3-CD1 4.01Å; W933-L946 HydrophobicContact CG-CD1 4.38Å; W933-L946 HydrophobicContact CH2-CD1 4Å; W933-L946 HydrophobicContact CZ2-CB 4.04Å; W933-L946 HydrophobicContact CZ2-CD1 3.75Å; W933-L946 HydrophobicContact CZ2-CG 4.32Å; W933-L946 HydrophobicContact CZ3-CD1 4.12Å; W933-D988 PolarHBondContact N-OD1 3.42Å
934	G	70.8	Confident	71.8	Confident	1 Å²	1	49 Å²	49	1%	0.01	28%	0.283	C	S	.	.			trans	-70.8	163.1	176.9	0	0	0	0	0	113	E936 P943 Q986 D988	G934-E936 PolarHBondContact O-N 3.15Å; G934-P943 WeakPolarHBondContact O-CD 3.42Å; G934-P943 VanDerWaalsContact O-CG 3.26Å; G934-P943 WeakPolarHBondContact O-CG 3.38Å; G934-Q986 CarbonylContact C-O 3.58Å; G934-Q986 WeakPolarHBondContact CA-O 3.44Å; G934-D988 VanDerWaalsContact CA-OD1 3.26Å; G934-D988 WeakPolarHBondContact CA-OD1 3.27Å; G934-D988 PolarHBondContact N-OD1 3Å
935	R	64.4	Low	71.9	Confident	91 Å²	91	47.9 Å²	47.9	34%	0.343	27%	0.269	S	S	.	.			trans	-57.5	137	-176.1	-66.3	-177.8	-177.7	-153.6	2.9	111.5	A937 G940 L942 C985 Q986	R935-A937 PolarHBondContact O-N 3.49Å; R935-G940 WeakPolarHBondContact CD-O 3Å; R935-L942 HydrophobicContact CG-CD2 4.02Å; R935-L942 HydrophobicContact CG-CG 4.48Å; R935-C985 VanDerWaalsContact O-CB 3.3Å; R935-C985 WeakPolarHBondContact O-CB 3.08Å; R935-Q986 PolarHBondContact N-O 2.01Å
936	E	54.8	Low	72.2	Confident	29 Å²	29	45.8 Å²	45.8	14%	0.136	25%	0.246	C	C	.	.	S	Bend	trans	-70.7	-14.4	-179.5	-58.6	174.1	165.6	0	0	113.7	R802 V803 V804 G934 P943	R802-E936 HydrophobicContact CB-CG 4.46Å; R802-E936 WeakPolarHBondContact CB-OE2 3.47Å; R802-E936 IonicContact CZ-OE2 3.47Å; R802-E936 IonicContact NE-OE2 3.54Å; R802-E936 PolarHBondContact NE-OE2 3.34Å; R802-E936 IonicContact NH2-OE2 2.79Å; R802-E936 PolarHBondContact NH2-OE2 3.01Å; R802-E936 VanDerWaalsContact O-CD 3.23Å; R802-E936 VanDerWaalsContact O-CG 3.32Å; R802-E936 WeakPolarHBondContact O-CG 3.27Å; R802-E936 VanDerWaalsContact O-OE1 3.14Å; V803-E936 CarbonylContact C-O 3.54Å; V803-E936 HydrophobicContact CG2-CG 4.49Å; V804-E936 WeakPolarHBondContact CG2-O 3.42Å; V804-E936 PolarHBondContact N-O 2.81Å; G934-E936 PolarHBondContact O-N 3.15Å; E936-P943 HydrophobicContact CG-CB 4.05Å; E936-P943 HydrophobicContact CG-CG 4.16Å; E936-P943 WeakPolarHBondContact OE1-CB 3.41Å
937	A	51	Low	72.1	Confident	42 Å²	42	42.4 Å²	42.4	35%	0.347	23%	0.233	S	C	.	.	S	Bend	trans	-158.8	163.9	177.6	0	0	0	0	0	110.9	R935 A939 G940	R935-A937 PolarHBondContact O-N 3.49Å; A937-A939 PolarHBondContact O-N 3.29Å; A937-G940 PolarHBondContact O-N 2.94Å
938	E	51	Low	72.1	Confident	85 Å²	85	36.5 Å²	36.5	40%	0.397	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-31.5	179.3	-77.3	-178.1	-166.8	0	0	113.8	G1013 C1014 R1016	E938-G1013 VanDerWaalsContact CD-CA 3.48Å; E938-G1013 VanDerWaalsContact OE1-C 3.3Å; E938-G1013 WeakPolarHBondContact OE1-CA 3.01Å; E938-C1014 HydrophobicContact CG-CB 3.96Å; E938-C1014 VanDerWaalsContact CG-N 3.33Å; E938-C1014 PolarHBondContact OE1-N 2.8Å; E938-R1016 WeakPolarHBondContact OE1-CG 3.42Å; E938-R1016 IonicContact OE1-CZ 3.57Å; E938-R1016 IonicContact OE1-NE 2.77Å; E938-R1016 PolarHBondContact OE1-NE 2.84Å; E938-R1016 IonicContact OE1-NH2 3.04Å; E938-R1016 PolarHBondContact OE1-NH2 3.15Å; E938-R1016 IonicContact OE2-CZ 3.51Å; E938-R1016 IonicContact OE2-NE 3.14Å; E938-R1016 IonicContact OE2-NH2 3.84Å; E938-R1016 PolarHBondContact OE2-NH2 3.27Å
939	A	51	Low	71.9	Confident	99 Å²	99	36.8 Å²	36.8	82%	0.818	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.6	18.4	175.4	0	0	0	0	0	113.6	A937	A937-A939 PolarHBondContact O-N 3.29Å
940	G	57	Low	71.7	Confident	18 Å²	18	36.2 Å²	36.2	19%	0.186	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-85.7	164.1	-175	0	0	0	0	0	114.9	R935 A937	R935-G940 WeakPolarHBondContact CD-O 3Å; A937-G940 PolarHBondContact O-N 2.94Å
941	S	58.2	Low	71.6	Confident	74 Å²	74	35.7 Å²	35.7	52%	0.517	21%	0.214	S	C	.	.	P	Polyproline II helix	trans	-73.8	157.2	170.9	50.1	0	0	0	0	111.9
942	L	64.9	Low	71.7	Confident	75 Å²	75	36.5 Å²	36.5	39%	0.393	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-68.2	126.7	169.5	-69.5	164.6	0	0	0	108.8	W933 R935	W933-L942 WeakPolarHBondContact O-CD2 3.26Å; R935-L942 HydrophobicContact CG-CD2 4.02Å; R935-L942 HydrophobicContact CG-CG 4.48Å
943	P	69.7	Low	71.8	Confident	6 Å²	6	37 Å²	37	4%	0.039	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-66.2	137.1	176.1	26.9	-32.4	0	0	0	110.1	G934 E936 Q947	G934-P943 WeakPolarHBondContact O-CD 3.42Å; G934-P943 VanDerWaalsContact O-CG 3.26Å; G934-P943 WeakPolarHBondContact O-CG 3.38Å; E936-P943 HydrophobicContact CG-CB 4.05Å; E936-P943 HydrophobicContact CG-CG 4.16Å; E936-P943 WeakPolarHBondContact OE1-CB 3.41Å; P943-Q947 HydrophobicContact CB-CG 4Å; P943-Q947 HydrophobicContact CG-CG 3.87Å
944	D	76.2	Confident	72	Confident	73 Å²	73	38.1 Å²	38.1	39%	0.39	23%	0.226	S	C	.	.	S	Bend	trans	-68.3	-41.1	174.8	-170.5	26.5	0	0	0	110.4	A863 Q864 S865	A863-D944 CarbonylContact C-O 3.55Å; A863-D944 WeakPolarHBondContact CA-O 2.9Å; Q864-D944 WeakPolarHBondContact CA-OD1 3.11Å; Q864-D944 WeakPolarHBondContact CB-OD1 2.91Å; Q864-D944 PolarHBondContact N-O 2.9Å; Q864-D944 PolarHBondContact N-OD1 3.11Å; S865-D944 WeakPolarHBondContact CB-OD1 3.48Å; S865-D944 WeakPolarHBondContact CB-OD2 3.4Å; S865-D944 PolarHBondContact N-OD1 2.89Å; S865-D944 PolarHBondContact OG-OD1 2.86Å; S865-D944 PolarHBondContact OG-OD2 2.89Å
945	V	82.1	Confident	72.8	Confident	39 Å²	39	43.9 Å²	43.9	24%	0.236	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-92.5	140.3	-177.5	-177	0	0	0	0	111.1	N808 H862 A863 Q947	N808-V945 HydrophobicContact CB-CG1 4.46Å; H862-V945 WeakPolarHBondContact CE1-CG1 3.05Å; A863-V945 HydrophobicContact CB-CG2 4.48Å; V945-Q947 PolarHBondContact O-N 3.14Å; V945-Q947 PolarHBondContact O-NE2 2.92Å
946	L	83.5	Confident	73.6	Confident	6 Å²	6	43.4 Å²	43.4	3%	0.031	26%	0.255	C	S	.	.			trans	-55	131.4	173.9	-178.9	70.3	0	0	0	111.2	A809 W814 M817 H862 A931 W933	A809-L946 HydrophobicContact CB-CB 4.43Å; A809-L946 HydrophobicContact CB-CD2 4.2Å; A809-L946 HydrophobicContact CB-CG 4.16Å; A809-L946 WeakPolarHBondContact CB-O 3.31Å; A809-L946 PolarHBondContact N-O 2.84Å; W814-L946 HydrophobicContact CB-CD2 4.24Å; M817-L946 HydrophobicContact CE-CD1 4.07Å; M817-L946 HydrophobicContact CG-CD2 4.25Å; H862-L946 PolarHBondContact O-N 3.07Å; A931-L946 HydrophobicContact CB-CD1 4.43Å; W933-L946 HydrophobicContact CD2-CD1 3.78Å; W933-L946 HydrophobicContact CE3-CD1 4.01Å; W933-L946 HydrophobicContact CG-CD1 4.38Å; W933-L946 HydrophobicContact CH2-CD1 4Å; W933-L946 HydrophobicContact CZ2-CB 4.04Å; W933-L946 HydrophobicContact CZ2-CD1 3.75Å; W933-L946 HydrophobicContact CZ2-CG 4.32Å; W933-L946 HydrophobicContact CZ3-CD1 4.12Å
947	Q	82.8	Confident	75	Confident	9 Å²	9	45 Å²	45	4%	0.042	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	153.1	-179.8	-59.1	-63.9	-42	0	0	111.2	R802 V803 V807 N808 A931 G932 P943 V945	R802-Q947 PolarHBondContact O-OE1 3.46Å; V803-Q947 HydrophobicContact CG2-CB 3.22Å; V803-Q947 HydrophobicContact CG2-CG 3.22Å; V807-Q947 VanDerWaalsContact C-OE1 3.28Å; V807-Q947 PolarHBondContact O-OE1 2.94Å; N808-Q947 PolarHBondContact OD1-NE2 3.03Å; N808-Q947 PolarHBondContact OD1-OE1 2.91Å; A931-Q947 WeakPolarHBondContact CA-O 3.07Å; A931-Q947 WeakPolarHBondContact CB-O 3.05Å; G932-Q947 PolarHBondContact N-O 3.02Å; G932-Q947 VanDerWaalsContact N-O 3.14Å; G932-Q947 PolarHBondContact O-N 3.11Å; P943-Q947 HydrophobicContact CB-CG 4Å; P943-Q947 HydrophobicContact CG-CG 3.87Å; V945-Q947 PolarHBondContact O-N 3.14Å; V945-Q947 PolarHBondContact O-NE2 2.92Å
948	E	83.8	Confident	76.6	Confident	42 Å²	42	46.9 Å²	46.9	20%	0.196	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	147	170.8	66.3	179	-146.5	0	0	112.2	G806 V807 A809 W814 I930	G806-E948 WeakPolarHBondContact CA-O 3.43Å; V807-E948 HydrophobicContact CG2-CG 3.8Å; V807-E948 PolarHBondContact N-O 3.07Å; V807-E948 PolarHBondContact O-N 3.48Å; A809-E948 HydrophobicContact CB-CB 4.14Å; A809-E948 HydrophobicContact CB-CG 4.04Å; W814-E948 PolarHBondContact NE1-OE2 2.82Å; I930-E948 WeakPolarHBondContact O-CA 3.35Å
949	A	81.9	Confident	78.2	Confident	7 Å²	7	42.9 Å²	42.9	6%	0.058	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	151.5	175.8	0	0	0	0	0	111.5	F929 I930 V982	F929-A949 WeakPolarHBondContact CA-O 3.29Å; I930-A949 HydrophobicContact CD1-CB 4.16Å; I930-A949 HydrophobicContact CG1-CB 3.84Å; I930-A949 PolarHBondContact N-O 2.78Å; I930-A949 PolarHBondContact O-N 3.37Å; A949-V982 HydrophobicContact CB-CG1 3.65Å
950	T	83.9	Confident	79.7	Confident	42 Å²	42	41.4 Å²	41.4	26%	0.258	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	130.5	177.6	-51.7	0	0	0	0	110.4	R927 C928 F929 Y977	R927-T950 HydrophobicContact CB-CG2 3.84Å; R927-T950 HydrophobicContact CG-CG2 4.28Å; C928-T950 CarbonylContact O-C 3.58Å; C928-T950 WeakPolarHBondContact O-CA 3.43Å; F929-T950 WeakPolarHBondContact CE1-OG1 3.46Å; F929-T950 HydrophobicContact CE2-CG2 4.37Å; F929-T950 HydrophobicContact CZ-CG2 4.3Å; F929-T950 WeakPolarHBondContact CZ-OG1 3.4Å; T950-Y977 WeakPolarHBondContact O-CE2 3.38Å; T950-Y977 PolarHBondContact O-OH 3.1Å
951	L	85.3	Confident	81	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	140.1	-178.3	-60.4	175	0	0	0	111.2	C928 I930 A975 Y977 V982 Y1023	C928-L951 PolarHBondContact N-O 3.25Å; C928-L951 PolarHBondContact O-N 3.02Å; I930-L951 HydrophobicContact CD1-CD1 3.71Å; I930-L951 HydrophobicContact CD1-CG 4.47Å; I930-L951 HydrophobicContact CG1-CD1 4.01Å; I930-L951 HydrophobicContact CG1-CG 4.46Å; I930-L951 HydrophobicContact CG2-CD1 3.95Å; L951-A975 HydrophobicContact CB-CB 4.13Å; L951-A975 HydrophobicContact CD1-CB 4.48Å; L951-Y977 HydrophobicContact CD2-CD2 4.21Å; L951-Y977 HydrophobicContact CD2-CE2 4.16Å; L951-V982 HydrophobicContact CD2-CB 3.89Å; L951-V982 HydrophobicContact CD2-CG1 3.71Å; L951-V982 WeakPolarHBondContact CD2-O 3.28Å; L951-Y1023 WeakPolarHBondContact CD1-OH 3.37Å
952	P	86.6	Confident	81.9	Confident	21 Å²	21	45.6 Å²	45.6	14%	0.136	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	143	169.9	32.7	-32	0	0	0	110.8	R926 A975 G976 Y977	R926-P952 WeakPolarHBondContact O-CA 2.99Å; P952-A975 VanDerWaalsContact O-CA 3.27Å; P952-A975 WeakPolarHBondContact O-CA 3.32Å; P952-G976 WeakPolarHBondContact CG-O 3Å; P952-G976 PolarHBondContact O-N 2.78Å; P952-Y977 HydrophobicContact CG-CD1 4.04Å; P952-Y977 HydrophobicContact CG-CE1 3.91Å; P952-Y977 HydrophobicContact CG-CG 4.47Å
953	L	87.3	Confident	82.4	Confident	15 Å²	15	42.1 Å²	42.1	8%	0.079	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-72.6	135.9	170	-67	-178.7	0	0	0	111.3	F922 G925 R926 L973 A975 L993 I1004	F922-L953 HydrophobicContact CB-CD1 3.66Å; G925-L953 PolarHBondContact N-O 3.2Å; R926-L953 HydrophobicContact CB-CD1 4.41Å; R926-L953 PolarHBondContact O-N 3.42Å; L953-L973 HydrophobicContact CD2-CD1 4.28Å; L953-A975 HydrophobicContact CD2-CB 3.97Å; L953-L993 HydrophobicContact CD2-CD2 4.08Å; L953-I1004 HydrophobicContact CD1-CD1 3.85Å; L953-I1004 HydrophobicContact CD2-CD1 3.72Å; L953-I1004 HydrophobicContact CG-CD1 4.33Å
954	L	86.6	Confident	82.5	Confident	26 Å²	26	46.7 Å²	46.7	14%	0.136	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-99.2	154.3	176.4	-64.7	172.4	0	0	0	111.3	L962 C974 P1020	L954-L962 HydrophobicContact CD1-CD1 4.29Å; L954-C974 HydrophobicContact CB-CB 4.35Å; L954-C974 HydrophobicContact CD1-CB 4.47Å; L954-C974 PolarHBondContact N-O 2.04Å; L954-P1020 HydrophobicContact CD1-CB 3.43Å; L954-P1020 VanDerWaalsContact CD1-CB 3.43Å; L954-P1020 HydrophobicContact CD1-CG 3.64Å
955	E	86.3	Confident	82.2	Confident	122 Å²	122	48.5 Å²	48.5	57%	0.57	26%	0.261	S	S	*	.	P	Polyproline II helix	trans	-73.9	146.9	172.3	-168.6	173	-177.7	0	0	110.6	A924 A957 E958 C959	A924-E955 HydrophobicContact CB-CB 4.33Å; E955-A957 VanDerWaalsContact C-N 3.3Å; E955-A957 PolarHBondContact O-N 3.07Å; E955-E958 HydrophobicContact CB-CB 4.4Å; E955-E958 PolarHBondContact O-N 3.49Å; E955-E958 VanDerWaalsContact O-N 3.16Å; E955-C959 PolarHBondContact O-N 2.01Å
956	Q	82.4	Confident	81.6	Confident	82 Å²	82	49.3 Å²	49.3	38%	0.383	26%	0.26	S	S	.	.	H	α-helix	trans	-61.6	-37.3	-175.9	-173.8	158.4	16.5	0	0	113.1	C959 Q960 I968 T969	Q956-C959 PolarHBondContact O-N 3.18Å; Q956-Q960 PolarHBondContact O-N 2.88Å; Q956-I968 HydrophobicContact CG-CG2 4.07Å; Q956-I968 PolarHBondContact NE2-O 3.25Å; Q956-T969 PolarHBondContact NE2-O 2.65Å
957	A	83.8	Confident	81.3	Confident	62 Å²	62	53.7 Å²	53.7	51%	0.512	29%	0.287	S	S	.	.	H	α-helix	trans	-65.7	-40.7	176.5	0	0	0	0	0	112	E955 Q960 L961	E955-A957 VanDerWaalsContact C-N 3.3Å; E955-A957 PolarHBondContact O-N 3.07Å; A957-Q960 PolarHBondContact O-N 2.88Å; A957-L961 WeakPolarHBondContact O-CG 3.08Å; A957-L961 PolarHBondContact O-N 3.23Å
958	E	84.6	Confident	81	Confident	82 Å²	82	53.8 Å²	53.8	38%	0.383	29%	0.288	S	S	.	.	H	α-helix	trans	-66.5	-42.1	175.6	-172.1	177.4	-169.4	0	0	111.2	E955 Q960 L961 L962	E955-E958 HydrophobicContact CB-CB 4.4Å; E955-E958 PolarHBondContact O-N 3.49Å; E955-E958 VanDerWaalsContact O-N 3.16Å; E958-Q960 PolarHBondContact O-N 3.47Å; E958-L961 WeakPolarHBondContact O-CB 3.38Å; E958-L961 PolarHBondContact O-N 3.47Å; E958-L962 HydrophobicContact CG-CD1 4.16Å; E958-L962 WeakPolarHBondContact O-CG 3.4Å; E958-L962 PolarHBondContact O-N 3Å
959	C	83.6	Confident	80.7	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62.9	-40.4	176.9	-172.1	0	0	0	0	112.9	E955 Q956 L961 L962 L963 C974	E955-C959 PolarHBondContact O-N 2.01Å; Q956-C959 PolarHBondContact O-N 3.18Å; C959-L961 VanDerWaalsContact C-N 3.25Å; C959-L961 PolarHBondContact O-N 3.39Å; C959-L962 PolarHBondContact O-N 3.49Å; C959-L963 PolarHBondContact O-N 3.01Å; C959-C974 HydrophobicContact CB-CB 3.54Å; C959-C974 WeakPolarHBondContact CB-SG 3.43Å; C959-C974 WeakPolarHBondContact SG-CB 2.98Å; C959-C974 CovalentContact SG-SG 2Å; C959-C974 PolarHBondContact SG-SG 3.33Å
960	Q	83.8	Confident	80.6	Confident	68 Å²	68	57.4 Å²	57.4	32%	0.318	32%	0.316	S	S	.	.	H	α-helix	trans	-64.1	-30.9	176.6	-174.6	60.2	69.6	0	0	112.6	Q956 A957 E958 L963 Y966 I968	Q956-Q960 PolarHBondContact O-N 2.88Å; A957-Q960 PolarHBondContact O-N 2.88Å; E958-Q960 PolarHBondContact O-N 3.47Å; Q960-L963 PolarHBondContact NE2-O 3.24Å; Q960-L963 CarbonylContact O-C 3.56Å; Q960-Y966 PolarHBondContact NE2-O 3.01Å; Q960-Y966 PolarHBondContact OE1-O 2.95Å; Q960-I968 HydrophobicContact CB-CG1 4.42Å
961	L	83.3	Confident	80.3	Confident	143 Å²	143	55.8 Å²	55.8	75%	0.749	31%	0.306	S	S	*	.	H	α-helix	trans	-72.9	-38.4	174.8	-71.1	170.2	0	0	0	112.2	A957 E958 C959	A957-L961 WeakPolarHBondContact O-CG 3.08Å; A957-L961 PolarHBondContact O-N 3.23Å; E958-L961 WeakPolarHBondContact O-CB 3.38Å; E958-L961 PolarHBondContact O-N 3.47Å; C959-L961 VanDerWaalsContact C-N 3.25Å; C959-L961 PolarHBondContact O-N 3.39Å
962	L	76.9	Confident	80.2	Confident	37 Å²	37	56 Å²	56	19%	0.194	31%	0.307	C	S	.	.	H	α-helix	trans	-75.5	-26.9	179.4	-67	172.4	0	0	0	112.7	L954 E958 C959 P964 Q1018 P1020	L954-L962 HydrophobicContact CD1-CD1 4.29Å; E958-L962 HydrophobicContact CG-CD1 4.16Å; E958-L962 WeakPolarHBondContact O-CG 3.4Å; E958-L962 PolarHBondContact O-N 3Å; C959-L962 PolarHBondContact O-N 3.49Å; L962-P964 VanDerWaalsContact C-CD 3.47Å; L962-P964 WeakPolarHBondContact O-CD 3.25Å; L962-Q1018 HydrophobicContact CD2-CB 4.05Å; L962-Q1018 HydrophobicContact CD2-CG 4.49Å; L962-P1020 HydrophobicContact CB-CG 4.25Å; L962-P1020 HydrophobicContact CD1-CG 3.99Å
963	L	75.5	Confident	80.2	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.01	31%	0.308	C	S	.	.			trans	-122.1	70.8	179.8	-63.1	175.3	0	0	0	111.6	C959 Q960 E965 Y966 I968 F1010 K1019 P1020	C959-L963 PolarHBondContact O-N 3.01Å; Q960-L963 PolarHBondContact NE2-O 3.24Å; Q960-L963 CarbonylContact O-C 3.56Å; L963-E965 PolarHBondContact O-N 3.49Å; L963-Y966 HydrophobicContact CB-CD2 4.45Å; L963-Y966 PolarHBondContact O-N 2.79Å; L963-I968 HydrophobicContact CD1-CD1 4.39Å; L963-F1010 HydrophobicContact CD1-CE2 4.02Å; L963-K1019 HydrophobicContact CD2-CB 4.45Å; L963-K1019 HydrophobicContact CD2-CG 4.48Å; L963-P1020 HydrophobicContact CD1-CG 4.48Å
964	P	72.4	Confident	80.2	Confident	102 Å²	102	55.9 Å²	55.9	66%	0.662	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-18.2	179	28.9	-35.5	0	0	0	113.3	L962 Y966	L962-P964 VanDerWaalsContact C-CD 3.47Å; L962-P964 WeakPolarHBondContact O-CD 3.25Å; P964-Y966 VanDerWaalsContact C-N 3.25Å; P964-Y966 PolarHBondContact O-N 2.86Å
965	E	69.1	Low	80.2	Confident	111 Å²	111	54.7 Å²	54.7	52%	0.519	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-18.7	178	-64	165.3	-156.8	0	0	112.8	L963 V1012 K1019	L963-E965 PolarHBondContact O-N 3.49Å; E965-V1012 VanDerWaalsContact OE2-CG2 3.24Å; E965-V1012 WeakPolarHBondContact OE2-CG2 3.41Å; E965-K1019 IonicContact OE1-NZ 2.74Å; E965-K1019 PolarHBondContact OE1-NZ 2.96Å; E965-K1019 IonicContact OE2-NZ 3.63Å; E965-K1019 PolarHBondContact OE2-NZ 2.88Å
966	Y	70.3	Confident	80	Confident	56 Å²	56	48.9 Å²	48.9	22%	0.22	27%	0.272	C	S	.	.	S	Bend	trans	-126.2	145.2	-174.8	-61.1	-80.5	0	0	0	112.2	Q960 L963 P964 I968 F1010	Q960-Y966 PolarHBondContact NE2-O 3.01Å; Q960-Y966 PolarHBondContact OE1-O 2.95Å; L963-Y966 HydrophobicContact CB-CD2 4.45Å; L963-Y966 PolarHBondContact O-N 2.79Å; P964-Y966 VanDerWaalsContact C-N 3.25Å; P964-Y966 PolarHBondContact O-N 2.86Å; Y966-I968 PolarHBondContact O-N 3.42Å; Y966-F1010 AromaticContact CD1-CD2 3.85Å; Y966-F1010 HydrophobicContact CD1-CD2 3.85Å; Y966-F1010 HydrophobicContact CD1-CE2 4.18Å; Y966-F1010 HydrophobicContact CD1-CG 4.39Å; Y966-F1010 AromaticContact CD2-CD2 3.51Å; Y966-F1010 HydrophobicContact CD2-CD2 3.51Å; Y966-F1010 AromaticContact CD2-CE2 3.78Å; Y966-F1010 HydrophobicContact CD2-CE2 3.78Å; Y966-F1010 HydrophobicContact CE1-CB 4.13Å; Y966-F1010 AromaticContact CE1-CD2 3.92Å; Y966-F1010 HydrophobicContact CE1-CD2 3.92Å; Y966-F1010 HydrophobicContact CE1-CG 4.2Å; Y966-F1010 HydrophobicContact CE2-CB 4.46Å; Y966-F1010 AromaticContact CE2-CD2 3.58Å; Y966-F1010 HydrophobicContact CE2-CD2 3.58Å; Y966-F1010 HydrophobicContact CE2-CE2 4.32Å; Y966-F1010 HydrophobicContact CE2-CG 4.43Å; Y966-F1010 AromaticContact CG-CD2 3.65Å; Y966-F1010 HydrophobicContact CG-CD2 3.65Å; Y966-F1010 AromaticContact CG-CE2 3.7Å; Y966-F1010 HydrophobicContact CG-CE2 3.7Å; Y966-F1010 AromaticContact CZ-CD2 3.78Å
967	T	76.4	Confident	79.8	Confident	98 Å²	98	48 Å²	48	60%	0.601	27%	0.266	S	S	*	.			trans	-88.1	101.9	172.9	-51.7	0	0	0	0	110	T969	T967-T969 PolarHBondContact O-N 3.09Å
968	I	77.2	Confident	79.2	Confident	12 Å²	12	47.3 Å²	47.3	6%	0.062	26%	0.256	C	S	.	.			trans	-77.5	93.1	-177.7	-51.7	-59.1	0	0	0	110.1	Q956 Q960 L963 Y966 I972 F1010	Q956-I968 HydrophobicContact CG-CG2 4.07Å; Q956-I968 PolarHBondContact NE2-O 3.25Å; Q960-I968 HydrophobicContact CB-CG1 4.42Å; L963-I968 HydrophobicContact CD1-CD1 4.39Å; Y966-I968 PolarHBondContact O-N 3.42Å; I968-I972 HydrophobicContact CD1-CG2 4.41Å; I968-I972 HydrophobicContact CG2-CB 4.23Å; I968-I972 HydrophobicContact CG2-CG2 4.2Å; I968-F1010 HydrophobicContact CD1-CE2 4.12Å; I968-F1010 HydrophobicContact CD1-CZ 4.05Å
969	T	77.7	Confident	78.5	Confident	43 Å²	43	50 Å²	50	26%	0.264	27%	0.269	S	S	.	.			trans	-75.9	167.7	176.5	62.2	0	0	0	0	112.6	H892 Q956 T967 S971 I972	H892-T969 PolarHBondContact ND1-OG1 2.87Å; H892-T969 VanDerWaalsContact ND1-OG1 3.16Å; Q956-T969 PolarHBondContact NE2-O 2.65Å; T967-T969 PolarHBondContact O-N 3.09Å; T969-S971 PolarHBondContact O-N 3.42Å; T969-S971 PolarHBondContact OG1-OG 2.83Å; T969-I972 PolarHBondContact O-N 3.01Å
970	S	79	Confident	77.7	Confident	82 Å²	82	50.7 Å²	50.7	57%	0.573	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-15.5	175.2	55.7	0	0	0	0	114.5	R1025	S970-R1025 VanDerWaalsContact O-CD 3.32Å; S970-R1025 WeakPolarHBondContact O-CD 3.25Å
971	S	78.6	Confident	76.6	Confident	7 Å²	7	49 Å²	49	5%	0.049	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-6.8	176.5	71.1	0	0	0	0	114.5	H892 T969 R1025	H892-S971 PolarHBondContact CE1-OG 3.06Å; H892-S971 VanDerWaalsContact CE1-OG 3.3Å; H892-S971 PolarHBondContact ND1-OG 3.09Å; T969-S971 PolarHBondContact O-N 3.42Å; T969-S971 PolarHBondContact OG1-OG 2.83Å; S971-R1025 WeakPolarHBondContact O-CB 3.45Å; S971-R1025 PolarHBondContact O-N 3.28Å
972	I	83.9	Confident	75.6	Confident	6 Å²	6	43.4 Å²	43.4	3%	0.031	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	139.1	-177.6	-60.4	173	0	0	0	109	I968 T969 I1008 F1010 Y1023	I968-I972 HydrophobicContact CD1-CG2 4.41Å; I968-I972 HydrophobicContact CG2-CB 4.23Å; I968-I972 HydrophobicContact CG2-CG2 4.2Å; T969-I972 PolarHBondContact O-N 3.01Å; I972-I1008 HydrophobicContact CG1-CD1 4.44Å; I972-F1010 HydrophobicContact CD1-CE1 4.25Å; I972-F1010 HydrophobicContact CD1-CZ 4.22Å; I972-F1010 HydrophobicContact CG2-CE1 4.28Å; I972-F1010 HydrophobicContact CG2-CZ 3.97Å; I972-Y1023 CarbonylContact C-O 3.53Å; I972-Y1023 WeakPolarHBondContact CA-O 3.46Å
973	L	86.3	Confident	74.7	Confident	29 Å²	29	42.2 Å²	42.2	15%	0.152	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	153.4	170.6	66.6	91.8	0	0	0	109.8	L953 L993 I1004 Y1023 R1025	L953-L973 HydrophobicContact CD2-CD1 4.28Å; L973-L993 HydrophobicContact CD1-CD2 3.39Å; L973-I1004 WeakPolarHBondContact CD2-O 3.43Å; L973-Y1023 VanDerWaalsContact CD1-CB 3.48Å; L973-Y1023 HydrophobicContact CD1-CD2 3.92Å; L973-Y1023 HydrophobicContact CD1-CG 3.91Å; L973-Y1023 PolarHBondContact N-O 3.31Å; L973-Y1023 PolarHBondContact O-N 2.91Å; L973-R1025 HydrophobicContact CD2-CB 3.88Å; L973-R1025 HydrophobicContact CD2-CG 4.09Å
974	C	86.7	Confident	74	Confident	4 Å²	4	42.5 Å²	42.5	3%	0.027	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	140.5	-178.7	-49.5	0	0	0	0	110.5	L954 C959 G1021	L954-C974 HydrophobicContact CB-CB 4.35Å; L954-C974 HydrophobicContact CD1-CB 4.47Å; L954-C974 PolarHBondContact N-O 2.04Å; C959-C974 HydrophobicContact CB-CB 3.54Å; C959-C974 WeakPolarHBondContact CB-SG 3.43Å; C959-C974 WeakPolarHBondContact SG-CB 2.98Å; C959-C974 CovalentContact SG-SG 2Å; C959-C974 PolarHBondContact SG-SG 3.33Å; C974-G1021 WeakPolarHBondContact CA-O 3.03Å
975	A	85.6	Confident	73.7	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	134.1	176.9	0	0	0	0	0	109	L951 P952 L953 L993 G1021 Y1023	L951-A975 HydrophobicContact CB-CB 4.13Å; L951-A975 HydrophobicContact CD1-CB 4.48Å; P952-A975 VanDerWaalsContact O-CA 3.27Å; P952-A975 WeakPolarHBondContact O-CA 3.32Å; L953-A975 HydrophobicContact CD2-CB 3.97Å; A975-L993 HydrophobicContact CB-CD2 4.25Å; A975-G1021 PolarHBondContact N-O 2.92Å; A975-G1021 VanDerWaalsContact N-O 3.15Å; A975-G1021 PolarHBondContact O-N 2.84Å; A975-Y1023 HydrophobicContact CB-CD2 4.16Å; A975-Y1023 HydrophobicContact CB-CE2 3.62Å
976	G	82.4	Confident	73.2	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.01	21%	0.214	C	C	.	.			trans	162.4	162.2	-174.7	0	0	0	0	0	112.9	P952	P952-G976 WeakPolarHBondContact CG-O 3Å; P952-G976 PolarHBondContact O-N 2.78Å
977	Y	78.3	Confident	72.6	Confident	62 Å²	62	35.7 Å²	35.7	24%	0.243	21%	0.209	C	C	.	.			trans	-87.6	132.9	172.2	-68	-81.1	0	0	0	110	T950 L951 P952 E979 G980 V982	T950-Y977 WeakPolarHBondContact O-CE2 3.38Å; T950-Y977 PolarHBondContact O-OH 3.1Å; L951-Y977 HydrophobicContact CD2-CD2 4.21Å; L951-Y977 HydrophobicContact CD2-CE2 4.16Å; P952-Y977 HydrophobicContact CG-CD1 4.04Å; P952-Y977 HydrophobicContact CG-CE1 3.91Å; P952-Y977 HydrophobicContact CG-CG 4.47Å; Y977-E979 PolarHBondContact O-N 2.84Å; Y977-G980 PolarHBondContact O-N 3.23Å; Y977-V982 HydrophobicContact CD2-CB 3.93Å; Y977-V982 HydrophobicContact CD2-CG2 3.97Å; Y977-V982 HydrophobicContact CE2-CB 4.11Å; Y977-V982 HydrophobicContact CE2-CG2 3.99Å
978	P	71.4	Confident	72.4	Confident	48 Å²	48	31.7 Å²	31.7	31%	0.312	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-30.5	173.7	-24.3	33.8	0	0	0	113.1	G980 Q1018	P978-G980 PolarHBondContact O-N 2.86Å; P978-Q1018 PolarHBondContact O-N 2.93Å
979	E	69.9	Low	72.5	Confident	140 Å²	140	31.5 Å²	31.5	65%	0.654	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-11.1	177.5	-55.5	80.4	-171	0	0	113.2	Y977	Y977-E979 PolarHBondContact O-N 2.84Å
980	G	67	Low	72.6	Confident	13 Å²	13	29.5 Å²	29.5	13%	0.134	17%	0.171	C	C	.	.			trans	74.7	-163.1	-171.4	0	0	0	0	0	112.3	Y977 P978 V982	Y977-G980 PolarHBondContact O-N 3.23Å; P978-G980 PolarHBondContact O-N 2.86Å; G980-V982 PolarHBondContact O-N 2.99Å
981	G	60.9	Low	72.8	Confident	33 Å²	33	25.6 Å²	25.6	34%	0.34	14%	0.144	S	C	.	.	S	Bend	trans	88.1	-18.7	173.4	0	0	0	0	0	116.3	V804 G805 A1015	V804-G981 CarbonylContact C-O 3.55Å; V804-G981 WeakPolarHBondContact CB-O 3.19Å; V804-G981 WeakPolarHBondContact CG1-O 3.49Å; G805-G981 WeakPolarHBondContact CA-O 3.1Å; G805-G981 PolarHBondContact N-O 3.25Å; G981-A1015 PolarHBondContact N-O 2.97Å
982	V	62.4	Low	73.3	Confident	26 Å²	26	25.2 Å²	25.2	16%	0.158	14%	0.142	C	C	.	.			trans	-134	118.2	169.1	-163.5	0	0	0	0	110.4	V804 A949 L951 Y977 G980	V804-V982 VanDerWaalsContact O-CA 3.27Å; V804-V982 WeakPolarHBondContact O-CA 3.21Å; A949-V982 HydrophobicContact CB-CG1 3.65Å; L951-V982 HydrophobicContact CD2-CB 3.89Å; L951-V982 HydrophobicContact CD2-CG1 3.71Å; L951-V982 WeakPolarHBondContact CD2-O 3.28Å; Y977-V982 HydrophobicContact CD2-CB 3.93Å; Y977-V982 HydrophobicContact CD2-CG2 3.97Å; Y977-V982 HydrophobicContact CE2-CB 4.11Å; Y977-V982 HydrophobicContact CE2-CG2 3.99Å; G980-V982 PolarHBondContact O-N 2.99Å
983	D	58.3	Low	73.5	Confident	11 Å²	11	25 Å²	25	6%	0.059	14%	0.14	C	C	.	.			trans	-161	162.4	-177.5	-160.8	8.9	0	0	0	112.4	A1015 G1021	D983-A1015 VanDerWaalsContact CB-CA 3.5Å; D983-A1015 HydrophobicContact CB-CB 3.59Å; D983-A1015 PolarHBondContact OD2-N 2.03Å; D983-G1021 WeakPolarHBondContact OD1-CA 3.37Å; D983-G1021 PolarHBondContact OD1-N 2.89Å
984	S	60.3	Low	73.6	Confident	8 Å²	8	23.6 Å²	23.6	6%	0.056	13%	0.133	C	C	.	.			trans	-76.2	142.6	168.7	55.5	0	0	0	0	111.1
985	C	66.2	Low	73.6	Confident	2 Å²	2	23.4 Å²	23.4	1%	0.014	13%	0.132	C	C	.	.			trans	-129	-175.1	-179.1	-160.3	0	0	0	0	112.9	R935 G987 D988 C1014	R935-C985 VanDerWaalsContact O-CB 3.3Å; R935-C985 WeakPolarHBondContact O-CB 3.08Å; C985-G987 PolarHBondContact O-N 2.83Å; C985-D988 PolarHBondContact N-OD2 2.85Å; C985-D988 WeakPolarHBondContact O-CB 3.19Å; C985-D988 PolarHBondContact O-N 3.14Å; C985-C1014 WeakPolarHBondContact CA-SG 2.87Å; C985-C1014 HydrophobicContact CB-CB 3.71Å; C985-C1014 WeakPolarHBondContact CB-SG 3.26Å; C985-C1014 WeakPolarHBondContact SG-CB 3.43Å; C985-C1014 CovalentContact SG-SG 2.04Å; C985-C1014 PolarHBondContact SG-SG 3.48Å
986	Q	57.7	Low	73.5	Confident	113 Å²	113	28.3 Å²	28.3	53%	0.528	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	122.2	-179.1	-74.1	-177	-10	0	0	111.6	G934 R935	G934-Q986 CarbonylContact C-O 3.58Å; G934-Q986 WeakPolarHBondContact CA-O 3.44Å; R935-Q986 PolarHBondContact N-O 2.01Å
987	G	57.4	Low	73	Confident	12 Å²	12	31 Å²	31	12%	0.124	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	105.8	-17.4	-176.5	0	0	0	0	0	114.1	H826 C985 S989	H826-G987 PolarHBondContact NE2-O 2.83Å; C985-G987 PolarHBondContact O-N 2.83Å; G987-S989 VanDerWaalsContact C-N 3.31Å
988	D	72.4	Confident	72.4	Confident	13 Å²	13	35.4 Å²	35.4	7%	0.07	20%	0.195	C	C	.	.			trans	-83.8	-10.4	171.2	-61.8	-45.2	0	0	0	113	G932 W933 G934 C985 G990 G991 V1007	G932-D988 WeakPolarHBondContact CA-OD1 3.34Å; W933-D988 PolarHBondContact N-OD1 3.42Å; G934-D988 VanDerWaalsContact CA-OD1 3.26Å; G934-D988 WeakPolarHBondContact CA-OD1 3.27Å; G934-D988 PolarHBondContact N-OD1 3Å; C985-D988 PolarHBondContact N-OD2 2.85Å; C985-D988 WeakPolarHBondContact O-CB 3.19Å; C985-D988 PolarHBondContact O-N 3.14Å; D988-G990 PolarHBondContact O-N 2.78Å; D988-G991 WeakPolarHBondContact O-CA 3.41Å; D988-G991 PolarHBondContact O-N 3.37Å; D988-V1007 WeakPolarHBondContact O-CB 3.42Å
989	S	80.8	Confident	72.2	Confident	9 Å²	9	35.4 Å²	35.4	6%	0.063	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.8	132.3	177.8	-75	0	0	0	0	112.6	C828 G829 H843 C844 G987 G991 S1009	C828-S989 VanDerWaalsContact CB-O 3.26Å; C828-S989 WeakPolarHBondContact CB-O 3.03Å; G829-S989 PolarHBondContact N-O 2.88Å; H843-S989 PolarHBondContact CE1-OG 2.77Å; H843-S989 WeakPolarHBondContact NE2-CB 3.26Å; H843-S989 PolarHBondContact NE2-OG 3.2Å; C844-S989 VanDerWaalsContact SG-CB 3.59Å; G987-S989 VanDerWaalsContact C-N 3.31Å; S989-G991 PolarHBondContact O-N 3.21Å; S989-S1009 VanDerWaalsContact OG-CB 3.26Å; S989-S1009 WeakPolarHBondContact OG-CB 3.49Å
990	G	78.8	Confident	72.4	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.3	-5.9	-176.2	0	0	0	0	0	115.4	G829 D988 V1007	G829-G990 CarbonylContact O-C 3.52Å; G829-G990 WeakPolarHBondContact O-CA 2.95Å; D988-G990 PolarHBondContact O-N 2.78Å; G990-V1007 PolarHBondContact N-O 2.88Å
991	G	83.9	Confident	73.2	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-67.4	163.7	174	0	0	0	0	0	113.9	D988 S989 C1006 V1007	D988-G991 WeakPolarHBondContact O-CA 3.41Å; D988-G991 PolarHBondContact O-N 3.37Å; S989-G991 PolarHBondContact O-N 3.21Å; G991-C1006 CarbonylContact O-C 3.6Å; G991-C1006 WeakPolarHBondContact O-CA 3.36Å; G991-V1007 WeakPolarHBondContact O-CG2 3.39Å; G991-V1007 PolarHBondContact O-N 2.62Å
992	P	88.8	Confident	74.2	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	133.7	179.2	26.2	-27.8	0	0	0	113.3	M817 S831 M994 Q1003	M817-P992 WeakPolarHBondContact SD-CD 3.08Å; M817-P992 HydrophobicContact SD-CG 3.34Å; M817-P992 WeakPolarHBondContact SD-CG 3.45Å; S831-P992 VanDerWaalsContact OG-CB 3.25Å; S831-P992 WeakPolarHBondContact OG-CB 3.39Å; S831-P992 WeakPolarHBondContact OG-CD 3.35Å; S831-P992 WeakPolarHBondContact OG-CG 3.43Å; P992-M994 HydrophobicContact CG-CE 4.25Å; P992-Q1003 HydrophobicContact CB-CG 3.98Å
993	L	88.6	Confident	75.4	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	121	152.4	179.1	72.3	0	0	0	108.6	C928 I930 L953 L973 A975 Q1003 I1004 G1005 Y1023	C928-L993 HydrophobicContact CB-CD1 4.02Å; C928-L993 HydrophobicContact CB-CG 4.44Å; I930-L993 HydrophobicContact CG2-CB 4.34Å; I930-L993 HydrophobicContact CG2-CD1 3.34Å; I930-L993 HydrophobicContact CG2-CG 4.43Å; L953-L993 HydrophobicContact CD2-CD2 4.08Å; L973-L993 HydrophobicContact CD1-CD2 3.39Å; A975-L993 HydrophobicContact CB-CD2 4.25Å; L993-Q1003 WeakPolarHBondContact O-CA 3.47Å; L993-I1004 HydrophobicContact CB-CG1 4.4Å; L993-I1004 HydrophobicContact CD2-CD1 3.63Å; L993-I1004 HydrophobicContact CD2-CG1 3.88Å; L993-I1004 HydrophobicContact CG-CD1 4.01Å; L993-I1004 HydrophobicContact CG-CG1 3.88Å; L993-I1004 WeakPolarHBondContact O-CG1 2.88Å; L993-I1004 PolarHBondContact O-N 2.85Å; L993-G1005 PolarHBondContact N-O 2.87Å; L993-G1005 PolarHBondContact O-N 3.04Å; L993-Y1023 HydrophobicContact CB-CD1 3.75Å; L993-Y1023 HydrophobicContact CB-CE1 3.98Å; L993-Y1023 HydrophobicContact CB-CG 4.5Å; L993-Y1023 HydrophobicContact CD1-CE1 4.19Å; L993-Y1023 HydrophobicContact CD2-CD1 3.99Å; L993-Y1023 HydrophobicContact CD2-CD2 4.24Å; L993-Y1023 HydrophobicContact CD2-CE1 4.27Å; L993-Y1023 HydrophobicContact CD2-CG 3.99Å; L993-Y1023 HydrophobicContact CG-CD1 4.34Å; L993-Y1023 HydrophobicContact CG-CE1 4.37Å
994	M	88.9	Confident	76.6	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	144.1	-172.4	58.8	179.3	131	0	0	113.7	W814 W816 C928 F929 A931 P992 W1001 T1002	W814-M994 HydrophobicContact CD2-CE 3.42Å; W814-M994 VanDerWaalsContact CD2-CE 3.42Å; W814-M994 HydrophobicContact CD2-SD 4.3Å; W814-M994 HydrophobicContact CE3-CE 3.09Å; W814-M994 HydrophobicContact CE3-SD 3.38Å; W814-M994 HydrophobicContact CG-CE 4.12Å; W814-M994 HydrophobicContact CH2-CE 3.7Å; W814-M994 HydrophobicContact CH2-CG 4.33Å; W814-M994 HydrophobicContact CH2-SD 3.71Å; W814-M994 HydrophobicContact CZ2-CE 4.06Å; W814-M994 HydrophobicContact CZ3-CE 3.25Å; W814-M994 HydrophobicContact CZ3-CG 4.16Å; W814-M994 HydrophobicContact CZ3-SD 3.02Å; W814-M994 WeakPolarHBondContact CZ3-SD 3.32Å; W816-M994 HydrophobicContact CZ2-CE 4.43Å; W816-M994 HydrophobicContact CZ2-SD 3.57Å; W816-M994 VanDerWaalsContact CZ2-SD 3.57Å; W816-M994 PolarHBondContact NE1-SD 3.3Å; C928-M994 CarbonylContact C-O 3.6Å; C928-M994 WeakPolarHBondContact CA-O 3.42Å; C928-M994 VanDerWaalsContact CB-O 3.31Å; C928-M994 WeakPolarHBondContact CB-O 3.21Å; F929-M994 HydrophobicContact CB-CG 4.17Å; F929-M994 PolarHBondContact N-O 3.48Å; F929-M994 WeakPolarHBondContact O-CG 3.16Å; F929-M994 PolarHBondContact O-N 2.83Å; A931-M994 HydrophobicContact CB-CE 4.44Å; P992-M994 HydrophobicContact CG-CE 4.25Å; M994-W1001 HydrophobicContact CB-CE3 4.18Å; M994-W1001 HydrophobicContact CG-CE3 3.78Å; M994-W1001 HydrophobicContact CG-CZ3 4.11Å; M994-W1001 HydrophobicContact SD-CD2 4.29Å; M994-W1001 HydrophobicContact SD-CE3 3.74Å; M994-W1001 HydrophobicContact SD-CZ3 4.37Å; M994-T1002 CarbonylContact C-O 3.55Å; M994-T1002 VanDerWaalsContact CA-O 3.27Å; M994-T1002 WeakPolarHBondContact CA-O 3.24Å
995	C	86.2	Confident	77.6	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	144.3	175.1	-42.1	0	0	0	0	109.2	C928 T1002 I1004	C928-C995 HydrophobicContact CB-CB 4.13Å; C928-C995 WeakPolarHBondContact CB-SG 3.38Å; C928-C995 WeakPolarHBondContact SG-CB 3.32Å; C928-C995 CovalentContact SG-SG 2.04Å; C928-C995 PolarHBondContact SG-SG 2.86Å; C995-T1002 PolarHBondContact N-O 2.8Å; C995-T1002 PolarHBondContact O-N 3.3Å; C995-I1004 HydrophobicContact CB-CG2 4.43Å; C995-I1004 WeakPolarHBondContact SG-CD1 3.13Å
996	E	83.2	Confident	78	Confident	104 Å²	104	28.3 Å²	28.3	49%	0.486	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	130.7	176.5	-172.2	176.6	-157.9	0	0	110.6	R926 H1000 W1001	R926-E996 PolarHBondContact NH2-O 2.82Å; E996-H1000 WeakPolarHBondContact CA-O 3.44Å; E996-W1001 HydrophobicContact CB-CD2 4.23Å; E996-W1001 HydrophobicContact CB-CE3 4.17Å; E996-W1001 HydrophobicContact CB-CH2 4.11Å; E996-W1001 HydrophobicContact CB-CZ2 4.15Å; E996-W1001 HydrophobicContact CB-CZ3 4.11Å; E996-W1001 HydrophobicContact CG-CZ2 4.47Å
997	E	71.1	Confident	78.9	Confident	57 Å²	57	23.1 Å²	23.1	27%	0.266	13%	0.131	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	122.9	178.2	-172.4	164.9	-125.6	0	0	109.6	Q920 R926 G999 H1000	Q920-E997 PolarHBondContact NE2-OE2 2.84Å; R926-E997 IonicContact NH1-OE1 3.85Å; E997-G999 PolarHBondContact O-N 3.41Å; E997-G999 VanDerWaalsContact O-N 3.09Å; E997-H1000 PolarHBondContact N-O 3.29Å; E997-H1000 PolarHBondContact O-N 3.17Å; E997-H1000 VanDerWaalsContact O-O 3.09Å
998	D	65.8	Low	79.2	Confident	155 Å²	155	22.6 Å²	22.6	83%	0.829	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.3	40.1	178.7	-59.6	-33.2	0	0	0	114.6	H1000	D998-H1000 VanDerWaalsContact C-N 3.32Å; D998-H1000 PolarHBondContact O-N 2.9Å; D998-H1000 PolarHBondContact O-ND1 3.28Å
999	G	66.8	Low	78.4	Confident	47 Å²	47	24.1 Å²	24.1	49%	0.485	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.1	16.6	-179.5	0	0	0	0	0	115.1	E997	E997-G999 PolarHBondContact O-N 3.41Å; E997-G999 VanDerWaalsContact O-N 3.09Å
1000	H	75.4	Confident	77.3	Confident	51 Å²	51	24.2 Å²	24.2	24%	0.236	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	143.8	173.5	-56.6	76.9	0	0	0	110.6	C780 R782 E996 E997 D998	C780-H1000 PolarHBondContact O-CD2 3.41Å; R782-H1000 PolarHBondContact NE-CD2 3.04Å; R782-H1000 PolarHBondContact NE-NE2 3.01Å; R782-H1000 PolarHBondContact NH2-CE1 3.47Å; R782-H1000 VanDerWaalsContact NH2-CE1 3.31Å; R782-H1000 PolarHBondContact NH2-NE2 3.08Å; E996-H1000 WeakPolarHBondContact CA-O 3.44Å; E997-H1000 PolarHBondContact N-O 3.29Å; E997-H1000 PolarHBondContact O-N 3.17Å; E997-H1000 VanDerWaalsContact O-O 3.09Å; D998-H1000 VanDerWaalsContact C-N 3.32Å; D998-H1000 PolarHBondContact O-N 2.9Å; D998-H1000 PolarHBondContact O-ND1 3.28Å
1001	W	82.7	Confident	75.7	Confident	16 Å²	16	25.8 Å²	25.8	6%	0.061	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	120.2	176.4	-70.1	88.1	0	0	0	111	G781 W814 W816 C914 F929 M994 E996	G781-W1001 WeakPolarHBondContact CA-O 3.32Å; G781-W1001 VanDerWaalsContact O-CD1 3.26Å; G781-W1001 PolarHBondContact O-N 2.8Å; W814-W1001 HydrophobicContact CH2-CD2 4.39Å; W814-W1001 HydrophobicContact CH2-CE3 4.04Å; W814-W1001 AromaticContact CH2-CH2 3.64Å; W814-W1001 HydrophobicContact CH2-CH2 3.64Å; W814-W1001 HydrophobicContact CH2-CZ2 4.03Å; W814-W1001 AromaticContact CH2-CZ3 3.65Å; W814-W1001 HydrophobicContact CH2-CZ3 3.65Å; W814-W1001 AromaticContact CZ3-CD2 3.82Å; W814-W1001 HydrophobicContact CZ3-CD2 3.82Å; W814-W1001 AromaticContact CZ3-CE2 3.97Å; W814-W1001 AromaticContact CZ3-CE3 3.78Å; W814-W1001 HydrophobicContact CZ3-CE3 3.78Å; W814-W1001 HydrophobicContact CZ3-CH2 4.05Å; W814-W1001 HydrophobicContact CZ3-CZ2 4.1Å; W814-W1001 AromaticContact CZ3-CZ3 3.89Å; W814-W1001 HydrophobicContact CZ3-CZ3 3.89Å; W816-W1001 HydrophobicContact CH2-CB 3.5Å; W816-W1001 VanDerWaalsContact CH2-CB 3.5Å; W816-W1001 AromaticContact CH2-CD1 3.69Å; W816-W1001 AromaticContact CH2-CG 3.63Å; W816-W1001 HydrophobicContact CH2-CG 3.63Å; W816-W1001 HydrophobicContact CZ2-CB 3.5Å; W816-W1001 VanDerWaalsContact CZ2-CB 3.5Å; W816-W1001 HydrophobicContact CZ2-CD2 4.39Å; W816-W1001 AromaticContact CZ2-CG 3.71Å; W816-W1001 HydrophobicContact CZ2-CG 3.71Å; W816-W1001 HydrophobicContact CZ3-CB 4.5Å; C914-W1001 WeakPolarHBondContact CB-O 3.38Å; C914-W1001 PolarHBondContact N-O 2.97Å; F929-W1001 HydrophobicContact CB-CZ3 4.18Å; F929-W1001 AromaticContact CD2-CH2 3.52Å; F929-W1001 HydrophobicContact CD2-CH2 3.52Å; F929-W1001 AromaticContact CD2-CZ3 3.55Å; F929-W1001 HydrophobicContact CD2-CZ3 3.55Å; F929-W1001 AromaticContact CE2-CH2 3.76Å; F929-W1001 HydrophobicContact CE2-CH2 3.76Å; F929-W1001 HydrophobicContact CE2-CZ3 4.21Å; F929-W1001 HydrophobicContact CG-CH2 4.09Å; F929-W1001 HydrophobicContact CG-CZ3 4.06Å; F929-W1001 HydrophobicContact CZ-CH2 4.49Å; M994-W1001 HydrophobicContact CB-CE3 4.18Å; M994-W1001 HydrophobicContact CG-CE3 3.78Å; M994-W1001 HydrophobicContact CG-CZ3 4.11Å; M994-W1001 HydrophobicContact SD-CD2 4.29Å; M994-W1001 HydrophobicContact SD-CE3 3.74Å; M994-W1001 HydrophobicContact SD-CZ3 4.37Å; E996-W1001 HydrophobicContact CB-CD2 4.23Å; E996-W1001 HydrophobicContact CB-CE3 4.17Å; E996-W1001 HydrophobicContact CB-CH2 4.11Å; E996-W1001 HydrophobicContact CB-CZ2 4.15Å; E996-W1001 HydrophobicContact CB-CZ3 4.11Å; E996-W1001 HydrophobicContact CG-CZ2 4.47Å
1002	T	83.3	Confident	74	Confident	12 Å²	12	28.6 Å²	28.6	7%	0.074	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	125.7	179.8	-60.9	0	0	0	0	110	A916 M994 C995 I1004	A916-T1002 HydrophobicContact CB-CG2 4.11Å; M994-T1002 CarbonylContact C-O 3.55Å; M994-T1002 VanDerWaalsContact CA-O 3.27Å; M994-T1002 WeakPolarHBondContact CA-O 3.24Å; C995-T1002 PolarHBondContact N-O 2.8Å; C995-T1002 PolarHBondContact O-N 3.3Å; T1002-I1004 PolarHBondContact O-N 3.37Å
1003	Q	87.3	Confident	72.2	Confident	0 Å²	0	30 Å²	30	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	118.3	171.1	-172.4	179.1	-4.2	0	0	109.1	S831 V913 C914 L915 A916 P992 L993 G1005 C1006 V1026	S831-Q1003 PolarHBondContact OG-NE2 3.21Å; S831-Q1003 PolarHBondContact OG-OE1 3.44Å; S831-Q1003 VanDerWaalsContact OG-OE1 3.06Å; V913-Q1003 HydrophobicContact CG1-CB 3.98Å; V913-Q1003 HydrophobicContact CG2-CB 3.95Å; C914-Q1003 PolarHBondContact O-N 2.78Å; L915-Q1003 HydrophobicContact CD2-CB 4.29Å; A916-Q1003 PolarHBondContact N-O 2.9Å; P992-Q1003 HydrophobicContact CB-CG 3.98Å; L993-Q1003 WeakPolarHBondContact O-CA 3.47Å; Q1003-G1005 VanDerWaalsContact CG-O 3.29Å; Q1003-G1005 WeakPolarHBondContact CG-O 3.49Å; Q1003-G1005 PolarHBondContact NE2-O 2.93Å; Q1003-C1006 PolarHBondContact NE2-SG 3.47Å; Q1003-V1026 HydrophobicContact CG-CG2 4.35Å
1004	I	84.2	Confident	70.9	Confident	5 Å²	5	31 Å²	31	3%	0.026	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	-23.1	-178.7	61.7	152.8	0	0	0	111.6	F922 L953 L973 L993 C995 T1002 V1026	F922-I1004 HydrophobicContact CD1-CG2 4.32Å; F922-I1004 HydrophobicContact CD2-CB 4.21Å; F922-I1004 HydrophobicContact CD2-CG2 3.69Å; F922-I1004 HydrophobicContact CE1-CG2 3.92Å; F922-I1004 HydrophobicContact CE2-CB 4.01Å; F922-I1004 HydrophobicContact CE2-CG2 3.22Å; F922-I1004 HydrophobicContact CG-CG2 4.23Å; F922-I1004 HydrophobicContact CZ-CG2 3.35Å; L953-I1004 HydrophobicContact CD1-CD1 3.85Å; L953-I1004 HydrophobicContact CD2-CD1 3.72Å; L953-I1004 HydrophobicContact CG-CD1 4.33Å; L973-I1004 WeakPolarHBondContact CD2-O 3.43Å; L993-I1004 HydrophobicContact CB-CG1 4.4Å; L993-I1004 HydrophobicContact CD2-CD1 3.63Å; L993-I1004 HydrophobicContact CD2-CG1 3.88Å; L993-I1004 HydrophobicContact CG-CD1 4.01Å; L993-I1004 HydrophobicContact CG-CG1 3.88Å; L993-I1004 WeakPolarHBondContact O-CG1 2.88Å; L993-I1004 PolarHBondContact O-N 2.85Å; C995-I1004 HydrophobicContact CB-CG2 4.43Å; C995-I1004 WeakPolarHBondContact SG-CD1 3.13Å; T1002-I1004 PolarHBondContact O-N 3.37Å; I1004-V1026 PolarHBondContact O-N 3.31Å
1005	G	80.6	Confident	69.5	Low	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	163.3	176.9	0	0	0	0	0	115.1	L993 Q1003 A1024	L993-G1005 PolarHBondContact N-O 2.87Å; L993-G1005 PolarHBondContact O-N 3.04Å; Q1003-G1005 VanDerWaalsContact CG-O 3.29Å; Q1003-G1005 WeakPolarHBondContact CG-O 3.49Å; Q1003-G1005 PolarHBondContact NE2-O 2.93Å; G1005-A1024 CarbonylContact C-O 3.5Å; G1005-A1024 WeakPolarHBondContact CA-O 3.12Å
1006	C	75.3	Confident	68.4	Low	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	141	165.2	-57.8	0	0	0	0	109	G991 Q1003 I1008 Y1023 A1024	G991-C1006 CarbonylContact O-C 3.6Å; G991-C1006 WeakPolarHBondContact O-CA 3.36Å; Q1003-C1006 PolarHBondContact NE2-SG 3.47Å; C1006-I1008 PolarHBondContact O-N 3.47Å; C1006-Y1023 CarbonylContact O-C 3.55Å; C1006-Y1023 WeakPolarHBondContact O-CA 3.32Å; C1006-Y1023 WeakPolarHBondContact O-CB 3.31Å; C1006-A1024 HydrophobicContact CB-CB 4.13Å; C1006-A1024 PolarHBondContact N-O 2.75Å; C1006-A1024 PolarHBondContact O-N 3.08Å
1007	V	74.7	Confident	67.7	Low	4 Å²	4	36 Å²	36	2%	0.024	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	117.7	176.7	179.7	0	0	0	0	109.6	D988 G990 G991 Y1023	D988-V1007 WeakPolarHBondContact O-CB 3.42Å; G990-V1007 PolarHBondContact N-O 2.88Å; G991-V1007 WeakPolarHBondContact O-CG2 3.39Å; G991-V1007 PolarHBondContact O-N 2.62Å; V1007-Y1023 HydrophobicContact CB-CD1 4.4Å; V1007-Y1023 HydrophobicContact CB-CE1 4.49Å; V1007-Y1023 HydrophobicContact CG2-CD1 3.96Å; V1007-Y1023 HydrophobicContact CG2-CE1 3.75Å
1008	I	64.6	Low	67.8	Low	2 Å²	2	39.6 Å²	39.6	1%	0.01	24%	0.235	C	C	.	.			trans	-92.3	-23.3	178.7	-68.3	-180	0	0	0	111.1	H843 K891 D894 I972 C1006 F1010 G1022 Y1023 A1024	H843-I1008 PolarHBondContact CE1-O 2.9Å; H843-I1008 PolarHBondContact ND1-O 2.85Å; K891-I1008 HydrophobicContact CB-CG2 3.84Å; K891-I1008 HydrophobicContact CG-CG2 4.29Å; D894-I1008 HydrophobicContact CB-CD1 3.95Å; D894-I1008 HydrophobicContact CB-CG1 3.92Å; D894-I1008 HydrophobicContact CB-CG2 3.87Å; D894-I1008 VanDerWaalsContact OD2-CG2 3.29Å; D894-I1008 WeakPolarHBondContact OD2-CG2 3.18Å; I972-I1008 HydrophobicContact CG1-CD1 4.44Å; C1006-I1008 PolarHBondContact O-N 3.47Å; I1008-F1010 HydrophobicContact CB-CD1 4.33Å; I1008-F1010 HydrophobicContact CB-CE1 4.43Å; I1008-F1010 HydrophobicContact CG2-CD1 3.54Å; I1008-F1010 HydrophobicContact CG2-CE1 3.84Å; I1008-G1022 PolarHBondContact N-O 3.12Å; I1008-Y1023 VanDerWaalsContact CD1-C 3.42Å; I1008-A1024 HydrophobicContact CD1-CB 3.47Å; I1008-A1024 VanDerWaalsContact CD1-CB 3.47Å; I1008-A1024 HydrophobicContact CG1-CB 3.62Å
1009	S	55.9	Low	68.3	Low	44 Å²	44	34.6 Å²	34.6	31%	0.308	21%	0.206	S	C	.	.			trans	50	73.1	-178	-176.6	0	0	0	0	113	S989	S989-S1009 VanDerWaalsContact OG-CB 3.26Å; S989-S1009 WeakPolarHBondContact OG-CB 3.49Å
1010	F	57	Low	68.8	Low	12 Å²	12	32.6 Å²	32.6	5%	0.053	18%	0.184	C	C	.	.			trans	-124.9	136.6	152.9	63.6	-92.6	0	0	0	109.8	K891 L963 Y966 I968 I972 I1008	K891-F1010 HydrophobicContact CB-CD1 3.93Å; K891-F1010 HydrophobicContact CB-CE1 4.17Å; K891-F1010 HydrophobicContact CG-CB 4.34Å; K891-F1010 HydrophobicContact CG-CD1 3.86Å; K891-F1010 HydrophobicContact CG-CG 4.34Å; L963-F1010 HydrophobicContact CD1-CE2 4.02Å; Y966-F1010 AromaticContact CD1-CD2 3.85Å; Y966-F1010 HydrophobicContact CD1-CD2 3.85Å; Y966-F1010 HydrophobicContact CD1-CE2 4.18Å; Y966-F1010 HydrophobicContact CD1-CG 4.39Å; Y966-F1010 AromaticContact CD2-CD2 3.51Å; Y966-F1010 HydrophobicContact CD2-CD2 3.51Å; Y966-F1010 AromaticContact CD2-CE2 3.78Å; Y966-F1010 HydrophobicContact CD2-CE2 3.78Å; Y966-F1010 HydrophobicContact CE1-CB 4.13Å; Y966-F1010 AromaticContact CE1-CD2 3.92Å; Y966-F1010 HydrophobicContact CE1-CD2 3.92Å; Y966-F1010 HydrophobicContact CE1-CG 4.2Å; Y966-F1010 HydrophobicContact CE2-CB 4.46Å; Y966-F1010 AromaticContact CE2-CD2 3.58Å; Y966-F1010 HydrophobicContact CE2-CD2 3.58Å; Y966-F1010 HydrophobicContact CE2-CE2 4.32Å; Y966-F1010 HydrophobicContact CE2-CG 4.43Å; Y966-F1010 AromaticContact CG-CD2 3.65Å; Y966-F1010 HydrophobicContact CG-CD2 3.65Å; Y966-F1010 AromaticContact CG-CE2 3.7Å; Y966-F1010 HydrophobicContact CG-CE2 3.7Å; Y966-F1010 AromaticContact CZ-CD2 3.78Å; I968-F1010 HydrophobicContact CD1-CE2 4.12Å; I968-F1010 HydrophobicContact CD1-CZ 4.05Å; I972-F1010 HydrophobicContact CD1-CE1 4.25Å; I972-F1010 HydrophobicContact CD1-CZ 4.22Å; I972-F1010 HydrophobicContact CG2-CE1 4.28Å; I972-F1010 HydrophobicContact CG2-CZ 3.97Å; I1008-F1010 HydrophobicContact CB-CD1 4.33Å; I1008-F1010 HydrophobicContact CB-CE1 4.43Å; I1008-F1010 HydrophobicContact CG2-CD1 3.54Å; I1008-F1010 HydrophobicContact CG2-CE1 3.84Å
1011	G	46.3	Very low	68.9	Low	32 Å²	32	30.3 Å²	30.3	33%	0.33	18%	0.175	S	C	.	.	S	Bend	trans	169	131.6	-174.6	0	0	0	0	0	108.2	G1013	G1011-G1013 VanDerWaalsContact C-N 3.3Å; G1011-G1013 CarbonylContact C-O 3.56Å; G1011-G1013 PolarHBondContact O-N 2.83Å
1012	V	47.6	Very low	69	Low	60 Å²	60	29.6 Å²	29.6	36%	0.364	17%	0.172	S	C	.	.	S	Bend	trans	-72.9	93.8	173	179.5	0	0	0	0	106.8	E965 R1016 K1019	E965-V1012 VanDerWaalsContact OE2-CG2 3.24Å; E965-V1012 WeakPolarHBondContact OE2-CG2 3.41Å; V1012-R1016 WeakPolarHBondContact O-CD 3.43Å; V1012-R1016 PolarHBondContact O-NE 2.81Å; V1012-K1019 HydrophobicContact CB-CD 4.19Å
1013	G	49.9	Very low	69.1	Low	28 Å²	28	29 Å²	29	29%	0.289	17%	0.169	S	C	.	.	S	Bend	trans	90.8	178	-171.8	0	0	0	0	0	114.2	E938 G1011	E938-G1013 VanDerWaalsContact CD-CA 3.48Å; E938-G1013 VanDerWaalsContact OE1-C 3.3Å; E938-G1013 WeakPolarHBondContact OE1-CA 3.01Å; G1011-G1013 VanDerWaalsContact C-N 3.3Å; G1011-G1013 CarbonylContact C-O 3.56Å; G1011-G1013 PolarHBondContact O-N 2.83Å
1014	C	61.6	Low	69	Low	22 Å²	22	29 Å²	29	15%	0.149	17%	0.169	C	C	.	.	S	Bend	trans	-116.5	129	178.2	-60.4	0	0	0	0	109.1	E938 C985 R1016	E938-C1014 HydrophobicContact CG-CB 3.96Å; E938-C1014 VanDerWaalsContact CG-N 3.33Å; E938-C1014 PolarHBondContact OE1-N 2.8Å; C985-C1014 WeakPolarHBondContact CA-SG 2.87Å; C985-C1014 HydrophobicContact CB-CB 3.71Å; C985-C1014 WeakPolarHBondContact CB-SG 3.26Å; C985-C1014 WeakPolarHBondContact SG-CB 3.43Å; C985-C1014 CovalentContact SG-SG 2.04Å; C985-C1014 PolarHBondContact SG-SG 3.48Å; C1014-R1016 VanDerWaalsContact C-N 3.29Å; C1014-R1016 PolarHBondContact O-N 3.29Å
1015	A	59.3	Low	69.2	Low	10 Å²	10	31.3 Å²	31.3	8%	0.083	18%	0.177	C	C	.	.	S	Bend	trans	60.1	29.5	175.6	0	0	0	0	0	115.9	V804 G981 D983	V804-A1015 HydrophobicContact CB-CB 3.62Å; V804-A1015 HydrophobicContact CG1-CB 3.43Å; V804-A1015 VanDerWaalsContact CG1-CB 3.43Å; V804-A1015 HydrophobicContact CG2-CB 3.96Å; G981-A1015 PolarHBondContact N-O 2.97Å; D983-A1015 VanDerWaalsContact CB-CA 3.5Å; D983-A1015 HydrophobicContact CB-CB 3.59Å; D983-A1015 PolarHBondContact OD2-N 2.03Å
1016	R	63.6	Low	69.4	Low	106 Å²	106	31.3 Å²	31.3	40%	0.4	18%	0.177	S	C	.	.			trans	-71.9	148	173.9	-63.8	-164.9	-176.9	179.5	-2.8	111.2	E938 V1012 C1014 Q1018 K1019	E938-R1016 WeakPolarHBondContact OE1-CG 3.42Å; E938-R1016 IonicContact OE1-CZ 3.57Å; E938-R1016 IonicContact OE1-NE 2.77Å; E938-R1016 PolarHBondContact OE1-NE 2.84Å; E938-R1016 IonicContact OE1-NH2 3.04Å; E938-R1016 PolarHBondContact OE1-NH2 3.15Å; E938-R1016 IonicContact OE2-CZ 3.51Å; E938-R1016 IonicContact OE2-NE 3.14Å; E938-R1016 IonicContact OE2-NH2 3.84Å; E938-R1016 PolarHBondContact OE2-NH2 3.27Å; V1012-R1016 WeakPolarHBondContact O-CD 3.43Å; V1012-R1016 PolarHBondContact O-NE 2.81Å; C1014-R1016 VanDerWaalsContact C-N 3.29Å; C1014-R1016 PolarHBondContact O-N 3.29Å; R1016-Q1018 PolarHBondContact O-N 2.77Å; R1016-K1019 HydrophobicContact CB-CB 4.38Å; R1016-K1019 PolarHBondContact O-N 3.29Å
1017	P	69.1	Low	69.7	Low	92 Å²	92	31.5 Å²	31.5	60%	0.597	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.8	138	171.3	-22.4	32.2	0	0	0	110.8	K1019	P1017-K1019 PolarHBondContact O-N 2.93Å; P1017-K1019 VanDerWaalsContact O-N 3.17Å
1018	Q	72.6	Confident	70.1	Confident	134 Å²	134	33.4 Å²	33.4	63%	0.626	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.7	12.7	178.8	-56.7	-177	-18.7	0	0	116.4	L962 P978 R1016	L962-Q1018 HydrophobicContact CD2-CB 4.05Å; L962-Q1018 HydrophobicContact CD2-CG 4.49Å; P978-Q1018 PolarHBondContact O-N 2.93Å; R1016-Q1018 PolarHBondContact O-N 2.77Å
1019	K	75.8	Confident	70.9	Confident	49 Å²	49	33.8 Å²	33.8	21%	0.213	20%	0.196	C	C	.	.			trans	-121.6	87.3	173.2	-67.2	-154.9	170.3	-159.2	0	110.4	L963 E965 V1012 R1016 P1017	L963-K1019 HydrophobicContact CD2-CB 4.45Å; L963-K1019 HydrophobicContact CD2-CG 4.48Å; E965-K1019 IonicContact OE1-NZ 2.74Å; E965-K1019 PolarHBondContact OE1-NZ 2.96Å; E965-K1019 IonicContact OE2-NZ 3.63Å; E965-K1019 PolarHBondContact OE2-NZ 2.88Å; V1012-K1019 HydrophobicContact CB-CD 4.19Å; R1016-K1019 HydrophobicContact CB-CB 4.38Å; R1016-K1019 PolarHBondContact O-N 3.29Å; P1017-K1019 PolarHBondContact O-N 2.93Å; P1017-K1019 VanDerWaalsContact O-N 3.17Å
1020	P	77.9	Confident	71.9	Confident	5 Å²	5	32.7 Å²	32.7	3%	0.032	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-74.6	156.4	179.6	31.9	-35.6	0	0	0	112.2	L954 L962 L963	L954-P1020 HydrophobicContact CD1-CB 3.43Å; L954-P1020 VanDerWaalsContact CD1-CB 3.43Å; L954-P1020 HydrophobicContact CD1-CG 3.64Å; L962-P1020 HydrophobicContact CB-CG 4.25Å; L962-P1020 HydrophobicContact CD1-CG 3.99Å; L963-P1020 HydrophobicContact CD1-CG 4.48Å
1021	G	78.1	Confident	72.7	Confident	3 Å²	3	34.1 Å²	34.1	3%	0.031	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	141	176.6	0	0	0	0	0	113.5	C974 A975 D983 Y1023	C974-G1021 WeakPolarHBondContact CA-O 3.03Å; A975-G1021 PolarHBondContact N-O 2.92Å; A975-G1021 VanDerWaalsContact N-O 3.15Å; A975-G1021 PolarHBondContact O-N 2.84Å; D983-G1021 WeakPolarHBondContact OD1-CA 3.37Å; D983-G1021 PolarHBondContact OD1-N 2.89Å; G1021-Y1023 WeakPolarHBondContact O-CD2 3.46Å; G1021-Y1023 WeakPolarHBondContact O-CE2 3.22Å
1022	G	83.9	Confident	74.3	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.01	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	138.7	174.7	0	0	0	0	0	113.5	I1008	I1008-G1022 PolarHBondContact N-O 3.12Å
1023	Y	85.8	Confident	75.8	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	148.6	-175.4	-55	-102	0	0	0	111.6	I930 L951 I972 L973 A975 L993 C1006 V1007 I1008 G1021 R1025	I930-Y1023 HydrophobicContact CG2-CE1 3.87Å; L951-Y1023 WeakPolarHBondContact CD1-OH 3.37Å; I972-Y1023 CarbonylContact C-O 3.53Å; I972-Y1023 WeakPolarHBondContact CA-O 3.46Å; L973-Y1023 VanDerWaalsContact CD1-CB 3.48Å; L973-Y1023 HydrophobicContact CD1-CD2 3.92Å; L973-Y1023 HydrophobicContact CD1-CG 3.91Å; L973-Y1023 PolarHBondContact N-O 3.31Å; L973-Y1023 PolarHBondContact O-N 2.91Å; A975-Y1023 HydrophobicContact CB-CD2 4.16Å; A975-Y1023 HydrophobicContact CB-CE2 3.62Å; L993-Y1023 HydrophobicContact CB-CD1 3.75Å; L993-Y1023 HydrophobicContact CB-CE1 3.98Å; L993-Y1023 HydrophobicContact CB-CG 4.5Å; L993-Y1023 HydrophobicContact CD1-CE1 4.19Å; L993-Y1023 HydrophobicContact CD2-CD1 3.99Å; L993-Y1023 HydrophobicContact CD2-CD2 4.24Å; L993-Y1023 HydrophobicContact CD2-CE1 4.27Å; L993-Y1023 HydrophobicContact CD2-CG 3.99Å; L993-Y1023 HydrophobicContact CG-CD1 4.34Å; L993-Y1023 HydrophobicContact CG-CE1 4.37Å; C1006-Y1023 CarbonylContact O-C 3.55Å; C1006-Y1023 WeakPolarHBondContact O-CA 3.32Å; C1006-Y1023 WeakPolarHBondContact O-CB 3.31Å; V1007-Y1023 HydrophobicContact CB-CD1 4.4Å; V1007-Y1023 HydrophobicContact CB-CE1 4.49Å; V1007-Y1023 HydrophobicContact CG2-CD1 3.96Å; V1007-Y1023 HydrophobicContact CG2-CE1 3.75Å; I1008-Y1023 VanDerWaalsContact CD1-C 3.42Å; G1021-Y1023 WeakPolarHBondContact O-CD2 3.46Å; G1021-Y1023 WeakPolarHBondContact O-CE2 3.22Å; Y1023-R1025 PolarHBondContact O-N 2.96Å
1024	A	86.2	Confident	76.7	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	121.6	178.2	0	0	0	0	0	108.3	G1005 C1006 I1008 V1026	G1005-A1024 CarbonylContact C-O 3.5Å; G1005-A1024 WeakPolarHBondContact CA-O 3.12Å; C1006-A1024 HydrophobicContact CB-CB 4.13Å; C1006-A1024 PolarHBondContact N-O 2.75Å; C1006-A1024 PolarHBondContact O-N 3.08Å; I1008-A1024 HydrophobicContact CD1-CB 3.47Å; I1008-A1024 VanDerWaalsContact CD1-CB 3.47Å; I1008-A1024 HydrophobicContact CG1-CB 3.62Å; A1024-V1026 PolarHBondContact O-N 3.32Å; A1024-V1026 VanDerWaalsContact O-N 3.13Å
1025	R	86.6	Confident	76.9	Confident	53 Å²	53	38.9 Å²	38.9	20%	0.2	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	105.7	-179.5	-176.9	-178.6	158.7	169.4	0.6	111.1	N921 S970 S971 L973 Y1023 S1027 A1028 F1029	N921-R1025 PolarHBondContact OD1-NH2 3.26Å; S970-R1025 VanDerWaalsContact O-CD 3.32Å; S970-R1025 WeakPolarHBondContact O-CD 3.25Å; S971-R1025 WeakPolarHBondContact O-CB 3.45Å; S971-R1025 PolarHBondContact O-N 3.28Å; L973-R1025 HydrophobicContact CD2-CB 3.88Å; L973-R1025 HydrophobicContact CD2-CG 4.09Å; Y1023-R1025 PolarHBondContact O-N 2.96Å; R1025-S1027 VanDerWaalsContact C-N 3.28Å; R1025-S1027 WeakPolarHBondContact CG-OG 3.47Å; R1025-S1027 PolarHBondContact NE-OG 2.74Å; R1025-S1027 PolarHBondContact O-N 2.97Å; R1025-A1028 HydrophobicContact CB-CB 4.37Å; R1025-A1028 HydrophobicContact CG-CB 4.35Å; R1025-A1028 WeakPolarHBondContact O-CB 3.09Å; R1025-A1028 PolarHBondContact O-N 3.41Å; R1025-F1029 WeakPolarHBondContact O-CD2 3.25Å
1026	V	85.3	Confident	77.3	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-60.5	-36.1	-177.6	170.3	0	0	0	0	112	L839 L915 Q1003 I1004 A1024 A1028 F1029 A1030 I1033	L839-V1026 HydrophobicContact CD2-CG2 4.23Å; L915-V1026 HydrophobicContact CB-CG1 4.2Å; L915-V1026 HydrophobicContact CD2-CG1 3.94Å; Q1003-V1026 HydrophobicContact CG-CG2 4.35Å; I1004-V1026 PolarHBondContact O-N 3.31Å; A1024-V1026 PolarHBondContact O-N 3.32Å; A1024-V1026 VanDerWaalsContact O-N 3.13Å; V1026-A1028 PolarHBondContact O-N 3.38Å; V1026-F1029 CarbonylContact O-C 3.5Å; V1026-F1029 PolarHBondContact O-N 2.04Å; V1026-A1030 PolarHBondContact O-N 3.4Å; V1026-A1030 VanDerWaalsContact O-N 3.12Å; V1026-I1033 HydrophobicContact CG1-CD1 4.28Å
1027	S	82	Confident	77.4	Confident	5 Å²	5	37.2 Å²	37.2	4%	0.035	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-66	-20.4	178.8	58.3	0	0	0	0	114.1	A917 Q920 R1025	A917-S1027 WeakPolarHBondContact O-CB 3.3Å; Q920-S1027 PolarHBondContact O-OG 3.13Å; R1025-S1027 VanDerWaalsContact C-N 3.28Å; R1025-S1027 WeakPolarHBondContact CG-OG 3.47Å; R1025-S1027 PolarHBondContact NE-OG 2.74Å; R1025-S1027 PolarHBondContact O-N 2.97Å
1028	A	82.8	Confident	76.5	Confident	43 Å²	43	36.2 Å²	36.2	36%	0.355	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-77.2	-24.2	173.4	0	0	0	0	0	112.4	R1025 V1026	R1025-A1028 HydrophobicContact CB-CB 4.37Å; R1025-A1028 HydrophobicContact CG-CB 4.35Å; R1025-A1028 WeakPolarHBondContact O-CB 3.09Å; R1025-A1028 PolarHBondContact O-N 3.41Å; V1026-A1028 PolarHBondContact O-N 3.38Å
1029	F	81.9	Confident	75	Confident	10 Å²	10	38 Å²	38	4%	0.044	20%	0.197	C	C	.	.	S	Bend	trans	-108.5	8.1	-177.4	-57.7	-72.8	0	0	0	113.2	H883 I895 R1025 V1026 S1031 W1032 I1033	H883-F1029 AromaticContact CD2-CD1 3.78Å; H883-F1029 AromaticContact CE1-CE1 3.77Å; H883-F1029 AromaticContact NE2-CD1 3.59Å; H883-F1029 AromaticContact NE2-CE1 3.73Å; I895-F1029 HydrophobicContact CB-CD2 4.47Å; I895-F1029 HydrophobicContact CD1-CB 3.88Å; I895-F1029 HydrophobicContact CD1-CD2 3.88Å; I895-F1029 HydrophobicContact CD1-CG 4.06Å; I895-F1029 HydrophobicContact CG2-CB 4.45Å; I895-F1029 HydrophobicContact CG2-CD1 3.94Å; I895-F1029 HydrophobicContact CG2-CD2 4.03Å; I895-F1029 HydrophobicContact CG2-CE1 4.17Å; I895-F1029 HydrophobicContact CG2-CE2 4.25Å; I895-F1029 HydrophobicContact CG2-CG 3.87Å; I895-F1029 HydrophobicContact CG2-CZ 4.31Å; R1025-F1029 WeakPolarHBondContact O-CD2 3.25Å; V1026-F1029 CarbonylContact O-C 3.5Å; V1026-F1029 PolarHBondContact O-N 2.04Å; F1029-S1031 VanDerWaalsContact C-N 3.32Å; F1029-S1031 PolarHBondContact O-N 2.9Å; F1029-W1032 HydrophobicContact CB-CE3 4.38Å; F1029-W1032 PolarHBondContact O-N 2.88Å; F1029-I1033 VanDerWaalsContact O-CG1 3.3Å; F1029-I1033 WeakPolarHBondContact O-CG1 3.32Å; F1029-I1033 PolarHBondContact O-N 3.21Å
1030	A	77.1	Confident	73.1	Confident	22 Å²	22	45.9 Å²	45.9	18%	0.182	23%	0.226	C	C	.	.	H	α-helix	trans	-59.5	-40.3	-175.4	0	0	0	0	0	112.9	E918 V1026 I1033 A1034	E918-A1030 HydrophobicContact CB-CB 4.17Å; V1026-A1030 PolarHBondContact O-N 3.4Å; V1026-A1030 VanDerWaalsContact O-N 3.12Å; A1030-I1033 PolarHBondContact O-N 3.06Å; A1030-A1034 WeakPolarHBondContact O-CB 3.46Å; A1030-A1034 PolarHBondContact O-N 3.25Å
1031	S	73.1	Confident	71	Confident	42 Å²	42	50.5 Å²	50.5	29%	0.294	25%	0.254	S	S	.	.	H	α-helix	trans	-65.4	-43.4	176.2	53.8	0	0	0	0	112	F1029 A1034 Q1035	F1029-S1031 VanDerWaalsContact C-N 3.32Å; F1029-S1031 PolarHBondContact O-N 2.9Å; S1031-A1034 PolarHBondContact O-N 3.4Å; S1031-Q1035 WeakPolarHBondContact O-CB 3.45Å; S1031-Q1035 VanDerWaalsContact O-CG 3.3Å; S1031-Q1035 WeakPolarHBondContact O-CG 3.26Å; S1031-Q1035 PolarHBondContact O-N 2.96Å
1032	W	80.7	Confident	68.8	Low	38 Å²	38	62.3 Å²	62.3	14%	0.144	30%	0.298	C	S	.	.	H	α-helix	trans	-62.3	-44.4	173.9	174.4	78.9	0	0	0	112.3	I881 H883 I895 M897 F1029 A1034 Q1035 T1036	I881-W1032 HydrophobicContact CG2-CZ2 4.08Å; H883-W1032 HydrophobicContact CB-CZ2 4.35Å; H883-W1032 AromaticContact CD2-CD1 3.87Å; H883-W1032 AromaticContact CD2-CD2 3.59Å; H883-W1032 AromaticContact CD2-CE2 3.7Å; H883-W1032 AromaticContact CD2-CG 3.73Å; H883-W1032 AromaticContact CD2-NE1 3.85Å; I895-W1032 HydrophobicContact CD1-CZ3 4.49Å; I895-W1032 HydrophobicContact CG1-CZ3 4.28Å; I895-W1032 HydrophobicContact CG2-CE3 4.34Å; I895-W1032 HydrophobicContact CG2-CH2 4.46Å; I895-W1032 HydrophobicContact CG2-CZ3 3.94Å; M897-W1032 HydrophobicContact CB-CH2 4.29Å; M897-W1032 HydrophobicContact CG-CH2 3.81Å; M897-W1032 HydrophobicContact CG-CZ3 3.82Å; M897-W1032 HydrophobicContact SD-CE3 4.46Å; M897-W1032 HydrophobicContact SD-CH2 4.19Å; M897-W1032 HydrophobicContact SD-CZ3 3.95Å; F1029-W1032 HydrophobicContact CB-CE3 4.38Å; F1029-W1032 PolarHBondContact O-N 2.88Å; W1032-A1034 VanDerWaalsContact C-N 3.31Å; W1032-A1034 PolarHBondContact O-N 3.35Å; W1032-Q1035 PolarHBondContact O-N 3.19Å; W1032-T1036 WeakPolarHBondContact O-CB 3.43Å; W1032-T1036 PolarHBondContact O-N 3.2Å; W1032-T1036 PolarHBondContact O-OG1 2.95Å
1033	I	77.8	Confident	66.2	Low	3 Å²	3	64.2 Å²	64.2	2%	0.015	32%	0.318	C	S	.	.	H	α-helix	trans	-60.4	-43	175.9	-65.6	166.6	0	0	0	110.2	I833 L839 I895 M897 L915 V1026 F1029 A1030 T1036 R1037	I833-I1033 HydrophobicContact CD1-CG2 4.35Å; L839-I1033 HydrophobicContact CD1-CD1 4.1Å; L839-I1033 HydrophobicContact CD1-CG1 4.36Å; L839-I1033 HydrophobicContact CD2-CD1 4.22Å; I895-I1033 HydrophobicContact CD1-CD1 4.27Å; M897-I1033 HydrophobicContact CE-CG2 4.37Å; M897-I1033 HydrophobicContact SD-CB 4.2Å; M897-I1033 HydrophobicContact SD-CG1 4.11Å; M897-I1033 HydrophobicContact SD-CG2 4.01Å; L915-I1033 HydrophobicContact CD1-CD1 4.29Å; L915-I1033 HydrophobicContact CD1-CG2 3.98Å; V1026-I1033 HydrophobicContact CG1-CD1 4.28Å; F1029-I1033 VanDerWaalsContact O-CG1 3.3Å; F1029-I1033 WeakPolarHBondContact O-CG1 3.32Å; F1029-I1033 PolarHBondContact O-N 3.21Å; A1030-I1033 PolarHBondContact O-N 3.06Å; I1033-T1036 PolarHBondContact O-N 2.71Å; I1033-R1037 WeakPolarHBondContact O-CG 3.46Å; I1033-R1037 PolarHBondContact O-N 3.06Å
1034	A	69.2	Low	63.4	Low	52 Å²	52	73.5 Å²	73.5	43%	0.43	36%	0.358	S	S	.	.	H	α-helix	trans	-65.6	-39.6	178.5	0	0	0	0	0	112.5	A1030 S1031 W1032 T1036 P1038	A1030-A1034 WeakPolarHBondContact O-CB 3.46Å; A1030-A1034 PolarHBondContact O-N 3.25Å; S1031-A1034 PolarHBondContact O-N 3.4Å; W1032-A1034 VanDerWaalsContact C-N 3.31Å; W1032-A1034 PolarHBondContact O-N 3.35Å; A1034-T1036 VanDerWaalsContact C-N 3.34Å; A1034-P1038 WeakPolarHBondContact O-CD 3.36Å
1035	Q	66.2	Low	60.6	Low	148 Å²	148	79.1 Å²	79.1	69%	0.692	38%	0.383	S	S	*	.	H	α-helix	trans	-72.9	-22.6	177.5	-72.2	173.5	27.9	0	0	113.9	S1031 W1032 P1038	S1031-Q1035 WeakPolarHBondContact O-CB 3.45Å; S1031-Q1035 VanDerWaalsContact O-CG 3.3Å; S1031-Q1035 WeakPolarHBondContact O-CG 3.26Å; S1031-Q1035 PolarHBondContact O-N 2.96Å; W1032-Q1035 PolarHBondContact O-N 3.19Å; Q1035-P1038 VanDerWaalsContact C-CD 3.42Å; Q1035-P1038 WeakPolarHBondContact O-CD 3.43Å
1036	T	68.2	Low	57.7	Low	23 Å²	23	84.3 Å²	84.3	14%	0.141	41%	0.414	C	S	.	.	H	α-helix	trans	-86.4	-21.5	-178.7	-55.8	0	0	0	0	112.5	I881 M897 W1032 I1033 A1034 P1038	I881-T1036 HydrophobicContact CB-CG2 4.47Å; I881-T1036 HydrophobicContact CD1-CG2 3.47Å; I881-T1036 VanDerWaalsContact CD1-CG2 3.47Å; I881-T1036 HydrophobicContact CG2-CG2 4.22Å; M897-T1036 HydrophobicContact CE-CG2 4.13Å; M897-T1036 HydrophobicContact SD-CG2 3.9Å; W1032-T1036 WeakPolarHBondContact O-CB 3.43Å; W1032-T1036 PolarHBondContact O-N 3.2Å; W1032-T1036 PolarHBondContact O-OG1 2.95Å; I1033-T1036 PolarHBondContact O-N 2.71Å; A1034-T1036 VanDerWaalsContact C-N 3.34Å; T1036-P1038 VanDerWaalsContact C-CD 3.42Å
1037	R	64.3	Low	54.8	Low	58 Å²	58	91 Å²	91	22%	0.219	45%	0.449	C	S	.	.	S	Bend	trans	-69.2	-27.7	177.9	-77.1	174.2	-180	-169.2	1.5	117.2	M897 L915 I1033	M897-R1037 HydrophobicContact CE-CG 4.17Å; L915-R1037 VanDerWaalsContact CD1-NH2 3.28Å; I1033-R1037 WeakPolarHBondContact O-CG 3.46Å; I1033-R1037 PolarHBondContact O-N 3.06Å
1038	P	50.6	Low	52.1	Low	71 Å²	71	99.9 Å²	99.9	46%	0.461	49%	0.49	S	S	.	.	S	Bend	trans	-67.9	140.6	-178.1	-17.5	31.8	0	0	0	112.6	A1034 Q1035 T1036	A1034-P1038 WeakPolarHBondContact O-CD 3.36Å; Q1035-P1038 VanDerWaalsContact C-CD 3.42Å; Q1035-P1038 WeakPolarHBondContact O-CD 3.43Å; T1036-P1038 VanDerWaalsContact C-CD 3.42Å
1039	W	41.7	Very low	49.5	Very low	171 Å²	171	106.3 Å²	106.3	65%	0.648	53%	0.532	S	S	*	.			trans	-59.7	135.4	-174.9	-71	80	0	0	0	114.2	T1041	W1039-T1041 HydrophobicContact CB-CG2 4.34Å; W1039-T1041 HydrophobicContact CD2-CG2 4.34Å; W1039-T1041 HydrophobicContact CE3-CG2 3.79Å
1040	R	35.3	Very low	47.8	Very low	216 Å²	216	111.1 Å²	111.1	82%	0.815	56%	0.557	S	S	*	*			trans	-92.1	91	142.5	-80.9	-173.9	178.8	-167.1	-3.2	107.7	R1042	R1040-R1042 PolarHBondContact O-N 2.79Å
1041	T	35.3	Very low	46.3	Very low	101 Å²	101	115.8 Å²	115.8	62%	0.62	58%	0.577	S	S	*	*			trans	-76.5	115.7	170.4	24	0	0	0	0	109.7	W1039 G1043	W1039-T1041 HydrophobicContact CB-CG2 4.34Å; W1039-T1041 HydrophobicContact CD2-CG2 4.34Å; W1039-T1041 HydrophobicContact CE3-CG2 3.79Å; T1041-G1043 VanDerWaalsContact C-N 3.3Å; T1041-G1043 PolarHBondContact O-N 2.55Å
1042	R	30.5	Very low	44.8	Very low	251 Å²	251	119.9 Å²	119.9	95%	0.947	59%	0.592	S	S	*	*			trans	-67.6	93.1	154.8	-83.6	-176.2	-179.1	172.7	1.5	107.7	R1040	R1040-R1042 PolarHBondContact O-N 2.79Å
1043	G	29.2	Very low	42.7	Very low	42 Å²	42	124.7 Å²	124.7	43%	0.433	62%	0.619	S	S	.	*			trans	-99.1	110.6	171.7	0	0	0	0	0	110.3	T1041 F1045	T1041-G1043 VanDerWaalsContact C-N 3.3Å; T1041-G1043 PolarHBondContact O-N 2.55Å; G1043-F1045 PolarHBondContact O-N 3.06Å
1044	K	27.2	Very low	40.5	Very low	194 Å²	194	132.3 Å²	132.3	84%	0.843	66%	0.656	S	S	*	*			trans	-74.8	111.5	156.7	-83.4	-176.1	173.5	-176.7	0	106.8
1045	F	28.5	Very low	38.6	Very low	119 Å²	119	137.7 Å²	137.7	52%	0.522	67%	0.671	S	S	.	*	P	Polyproline II helix	trans	-75.8	120.2	158.3	-87.5	-88.7	0	0	0	107.8	G671 G1043	G671-F1045 WeakPolarHBondContact O-CB 3.32Å; G671-F1045 VanDerWaalsContact O-CG 3.27Å; G671-F1045 WeakPolarHBondContact O-CG 3.41Å; G1043-F1045 PolarHBondContact O-N 3.06Å
1046	L	25.5	Very low	36.6	Very low	162 Å²	162	136.9 Å²	136.9	85%	0.848	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-98.2	118	168.7	-96.1	162.5	0	0	0	107.2
1047	D	24.8	Very low	34.2	Very low	139 Å²	139	145.7 Å²	145.7	74%	0.743	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-57.8	131.5	173.2	-164.2	-0.5	0	0	0	112	S1049	D1047-S1049 PolarHBondContact OD1-N 2.95Å
1048	Q	25	Very low	31.7	Very low	193 Å²	193	153 Å²	153	90%	0.902	75%	0.752	S	S	*	*			trans	-143.8	85.5	154.5	-77.9	-163.6	-2	0	0	108.3
1049	S	26.8	Very low	30	Very low	177 Å²	177	160.5 Å²	160.5	100%	1.238	78%	0.778	S	S	*	*				169.1	0	104.5	63	0	0	0	0	112.4	D1047	D1047-S1049 PolarHBondContact OD1-N 2.95Å

Retrieved 1,049 of 1,049 residues in 798.1 ms (Link to these results)

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