A0A077ZE46_TRITR Loading...

Fn3 and Ig 3 and C2-set 2 and I-set and Ig 2 doma in containing protein

AlphaFold DB , UniProt , Accession A0A077ZE46, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,122 aa.

						>A0A077ZE46_TRITR|A0A077ZE46
MQIVQSAHCFFLPDVSPAKVEYFVKEPRSEPYYVTAGSQDLLLPCAVDATYASSQPNSVYWMRLVENTPYLVRTDAFYEIDSASCAGCFNLHIKSVDYARDNGKFYCQMATPDGSTHTSKEANVIVLVRPGQPELNEQSLVLTEGVVEELKCHSVGGNPPPQITWFHSNGTELTHLSATVNGTNKEQPTVSTLRFVASASDKEQKLVCKIWNVAMGDSVAPYSVETNPLVVLCKLFIMFSVVDRPKVTVRPGPVYSVEVGREAKLSCDANAYPPPTKFSWRRSAGLADSTWVERNISFIVDKDHAGSYTCTSENLQGIGEATVNLDVQYEPDINLLSEVIVKEGESLHLKCDVVSNPPPYIVSWITPDQEVHNSSILQLSSVTKAQAGTYTCIARNRLTVMDQKSTERVASKSTTVIVSHQPGVAIITVDEPVVIGATVTLNCSADSAGYPPARYRWKAPGQADYEYGARYTYTIPDVQLSHAGEYWCLPFNDIGNGQEGSYKLIVREPAHLGTVLRKEETIRGGHSGYSLSCTAHGNPLPNITWYFDNEPISSSHFIVSSTPEAQSCEIPERCSFKVSSSLKWTSAVQWNDKGFYTCSADNGAGRPSESTMFLKVQHKPVIINDPERPVVASDFGEIAQIVCKVTASPEPVFRWYRDGQELVDYGSKFDSNHVRNHSFDVYENALIIRDVEKGDMGAYSCKAANLFGEDVHIFKLLRKSKPDPPKELKVETQSHKSILLSWVPGFDGGHRQKFTVELTHDDHMLKTFQAPDAEIGKWRPKFGIEKALPVEFNVTGLAPSTLYSFRVKASNQLGETAWTQSLTAATEDAPTNPSIKPPVSATYNSMTQELEVNPVLDSGHYCLMVYLQKPSGLWERWDCAPTNGIIDSVPTAAALRVRNCYFQTLECSEPLEVAVNVATAIGWEVIAAICCTVLFFLLLFAMMCFYCRKHRLNMKKKQMVNGNVDLKLNGPDVKRIREISAPIYSDQLMNAANLGVDRNTASSKDSGVFTFSNYPYDGYTPEMNGHAYSEGATLPRPASYDDTDQWASSGCRISGNLNNSDGVICSDPVQLKPAAALAGLYNHHDLVDMNPAGGSLYASREGSVHSGYSTPSQKRVIREIIV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.8	Very low	35.4	Very low	235 Å²	235	161.7 Å²	161.7	100%	1.158	86%	0.855	S	S	*	*				0	131.6	0	-76.6	164.5	162.3	0	0	107.6
2	Q	34.2	Very low	35.3	Very low	165 Å²	165	160.9 Å²	160.9	77%	0.771	85%	0.85	S	S	*	*			cis	-162.7	165.1	-10.9	-160.2	172.1	-6.2	0	0	108.9
3	I	37	Very low	35.3	Very low	157 Å²	157	157.5 Å²	157.5	81%	0.805	84%	0.843	S	S	*	*			trans	75.9	129.8	173.8	-51.8	158.6	0	0	0	112.3
4	V	37.7	Very low	35.2	Very low	135 Å²	135	157.7 Å²	157.7	82%	0.818	84%	0.844	S	S	*	*			cis	-120.4	167.7	6.8	-164.2	0	0	0	0	111
5	Q	34.2	Very low	35.5	Very low	172 Å²	172	155.9 Å²	155.9	80%	0.804	84%	0.84	S	S	*	*			trans	-120.2	160.3	174.3	-77.8	179.8	-82.2	0	0	114.2
6	S	35	Very low	35.5	Very low	111 Å²	111	153.1 Å²	153.1	78%	0.776	84%	0.837	S	S	*	*			trans	58.9	130.2	139.9	64.7	0	0	0	0	122.7
7	A	38.5	Very low	35.7	Very low	101 Å²	101	151.2 Å²	151.2	84%	0.835	83%	0.833	S	S	*	*				-162.5	148.3	118.3	0	0	0	0	0	111.6
8	H	35.9	Very low	35.8	Very low	182 Å²	182	148.7 Å²	148.7	84%	0.843	84%	0.836	S	S	*	*			trans	-125.2	148.1	169.3	-88.1	-55.1	0	0	0	109.6
9	C	34.4	Very low	36.3	Very low	131 Å²	131	150.5 Å²	150.5	89%	0.885	83%	0.834	S	S	*	*			trans	-166.1	152.9	137.1	-98.8	0	0	0	0	111.4
10	F	33.6	Very low	37.1	Very low	185 Å²	185	147.3 Å²	147.3	81%	0.811	82%	0.818	S	S	*	*			trans	-97.8	166.1	174.2	-77.7	-113.1	0	0	0	110.7
11	F	35	Very low	38.3	Very low	205 Å²	205	148 Å²	148	90%	0.899	82%	0.815	S	S	*	*			trans	-157.8	173.3	131.6	-106.3	-64.6	0	0	0	112.6
12	L	34.6	Very low	40.1	Very low	152 Å²	152	139.4 Å²	139.4	80%	0.796	77%	0.77	S	S	*	*			trans	-96.7	169.7	-147.4	-76.5	164	0	0	0	116.1
13	P	35.2	Very low	42.3	Very low	116 Å²	116	132.6 Å²	132.6	75%	0.753	74%	0.738	S	S	*	*			trans	-96.5	-179.1	-176.8	40.1	-37.3	0	0	0	114.6
14	D	33.4	Very low	44.5	Very low	161 Å²	161	130 Å²	130	86%	0.861	73%	0.729	S	S	*	*			trans	-118.2	160.2	176.2	-166.1	8.5	0	0	0	111.6
15	V	40.3	Very low	46.8	Very low	130 Å²	130	128.9 Å²	128.9	79%	0.788	71%	0.714	S	S	*	*			trans	-132.5	127.3	-166.4	178.8	0	0	0	0	112.6
16	S	35.6	Very low	49.5	Very low	112 Å²	112	123.3 Å²	123.3	78%	0.783	69%	0.687	S	S	*	*			trans	-149.1	166.1	173.5	83.1	0	0	0	0	110.6
17	P	38.3	Very low	52	Low	120 Å²	120	118.2 Å²	118.2	78%	0.779	65%	0.652	S	S	*	*				-102.7	158	-110.4	-5.9	27.2	0	0	0	115.6	K19	P17-K19 PolarHBondContact O-N 2.72Å
18	A	38.5	Very low	54.4	Low	106 Å²	106	118.2 Å²	118.2	88%	0.876	63%	0.63	S	S	*	*			trans	-11.2	87.3	167.8	0	0	0	0	0	116.5
19	K	45.3	Very low	56.5	Low	183 Å²	183	114.6 Å²	114.6	80%	0.796	63%	0.625	S	S	*	*			trans	-69.2	143.7	157.2	-161.4	177.3	-173.6	-177.1	0	107.5	P17 E21	P17-K19 PolarHBondContact O-N 2.72Å; K19-E21 PolarHBondContact O-N 3.16Å
20	V	51.2	Low	59	Low	87 Å²	87	113.9 Å²	113.9	53%	0.527	61%	0.609	S	S	.	*			trans	-60.1	112.1	176	178.9	0	0	0	0	108.6	Y22	V20-Y22 HydrophobicContact CB-CE1 4.26Å; V20-Y22 HydrophobicContact CB-CE2 4.25Å; V20-Y22 HydrophobicContact CG1-CD1 4.04Å; V20-Y22 HydrophobicContact CG1-CE1 3.63Å; V20-Y22 HydrophobicContact CG1-CE2 4.4Å; V20-Y22 VanDerWaalsContact O-CD2 3.25Å; V20-Y22 WeakPolarHBondContact O-CD2 3.42Å; V20-Y22 WeakPolarHBondContact O-CE2 3.43Å; V20-Y22 PolarHBondContact O-N 3.45Å; V20-Y22 VanDerWaalsContact O-N 3.1Å
21	E	63	Low	61.6	Low	162 Å²	162	107.1 Å²	107.1	76%	0.757	58%	0.584	S	S	*	*			trans	-81	89.1	-179.4	-75.4	-169.5	139.6	0	0	109.9	K19 F23	K19-E21 PolarHBondContact O-N 3.16Å; E21-F23 PolarHBondContact O-N 3.28Å
22	Y	71.7	Confident	64.3	Low	55 Å²	55	99 Å²	99	22%	0.216	55%	0.547	C	S	.	.			trans	-63.1	-27.4	174.3	-55.6	-72.5	0	0	0	112.7	V20 V47 D48 Y51 M109 H117	V20-Y22 HydrophobicContact CB-CE1 4.26Å; V20-Y22 HydrophobicContact CB-CE2 4.25Å; V20-Y22 HydrophobicContact CG1-CD1 4.04Å; V20-Y22 HydrophobicContact CG1-CE1 3.63Å; V20-Y22 HydrophobicContact CG1-CE2 4.4Å; V20-Y22 VanDerWaalsContact O-CD2 3.25Å; V20-Y22 WeakPolarHBondContact O-CD2 3.42Å; V20-Y22 WeakPolarHBondContact O-CE2 3.43Å; V20-Y22 PolarHBondContact O-N 3.45Å; V20-Y22 VanDerWaalsContact O-N 3.1Å; Y22-V47 VanDerWaalsContact O-CA 3.28Å; Y22-V47 WeakPolarHBondContact O-CA 3.34Å; Y22-V47 WeakPolarHBondContact O-CG1 3.43Å; Y22-D48 PolarHBondContact O-N 2.76Å; Y22-D48 VanDerWaalsContact O-N 3.13Å; Y22-Y51 HydrophobicContact CD1-CE1 4.38Å; Y22-Y51 HydrophobicContact CD1-CE2 4.09Å; Y22-Y51 HydrophobicContact CE1-CE1 4.29Å; Y22-Y51 HydrophobicContact CE1-CE2 4.48Å; Y22-Y51 AromaticContact CE1-CZ 3.97Å; Y22-M109 HydrophobicContact CD1-CE 3.63Å; Y22-M109 HydrophobicContact CE1-CE 4.4Å; Y22-M109 HydrophobicContact CG-CE 3.81Å; Y22-H117 AromaticContact CD1-CD2 3.95Å; Y22-H117 HydrophobicContact CD2-CB 3.95Å; Y22-H117 AromaticContact CD2-CD2 3.24Å; Y22-H117 WeakPolarHBondContact CD2-CD2 3.36Å; Y22-H117 AromaticContact CD2-CG 3.57Å; Y22-H117 AromaticContact CD2-NE2 3.89Å; Y22-H117 AromaticContact CE1-CD2 3.84Å; Y22-H117 AromaticContact CE1-NE2 3.95Å; Y22-H117 HydrophobicContact CE2-CB 4.47Å; Y22-H117 AromaticContact CE2-CD2 3.1Å; Y22-H117 WeakPolarHBondContact CE2-CD2 3.47Å; Y22-H117 AromaticContact CE2-CE1 3.8Å; Y22-H117 AromaticContact CE2-CG 3.62Å; Y22-H117 AromaticContact CE2-NE2 3.22Å; Y22-H117 WeakPolarHBondContact CE2-NE2 3.41Å; Y22-H117 HydrophobicContact CG-CB 4.48Å; Y22-H117 AromaticContact CG-CD2 3.66Å; Y22-H117 AromaticContact CZ-CD2 3.42Å; Y22-H117 VanDerWaalsContact CZ-CD2 3.42Å; Y22-H117 AromaticContact CZ-NE2 3.24Å; Y22-H117 PolarHBondContact OH-NE2 2.96Å
23	F	80.9	Confident	66.8	Low	21 Å²	21	99 Å²	99	9%	0.092	54%	0.538	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	118	179.3	-63	-80.8	0	0	0	111.2	E21 K25 E26 A46 V47 C107 M109 H117	E21-F23 PolarHBondContact O-N 3.28Å; F23-K25 VanDerWaalsContact C-N 3.33Å; F23-E26 HydrophobicContact CB-CG 3.98Å; F23-A46 CarbonylContact C-O 3.39Å; F23-A46 VanDerWaalsContact CA-O 3.22Å; F23-A46 WeakPolarHBondContact CA-O 3.41Å; F23-V47 HydrophobicContact CD1-CG2 3.71Å; F23-V47 HydrophobicContact CE1-CG2 3.75Å; F23-C107 HydrophobicContact CE1-CB 4.14Å; F23-M109 HydrophobicContact CZ-CB 4.39Å; F23-H117 HydrophobicContact CE2-CB 4.36Å; F23-H117 WeakPolarHBondContact CZ-O 3.48Å
24	V	83.3	Confident	69.3	Low	103 Å²	103	94.4 Å²	94.4	62%	0.624	51%	0.507	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	-20.1	173.9	-175.9	0	0	0	0	111.3	A46 D48	V24-A46 HydrophobicContact CB-CB 4.43Å; V24-A46 PolarHBondContact N-O 2.73Å; V24-D48 HydrophobicContact CG2-CB 4.12Å
25	K	85.9	Confident	71.9	Confident	111 Å²	111	89.4 Å²	89.4	48%	0.483	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	140.2	179.7	-155	178.9	-177.5	-177.1	0	111.2	F23 P44 C45 A46	F23-K25 VanDerWaalsContact C-N 3.33Å; K25-P44 HydrophobicContact CD-CB 3.92Å; K25-P44 HydrophobicContact CG-CB 4.1Å; K25-C45 WeakPolarHBondContact O-CA 3.37Å; K25-A46 HydrophobicContact CB-CB 3.77Å; K25-A46 PolarHBondContact N-O 2.88Å; K25-A46 PolarHBondContact O-N 2.89Å; K25-A46 VanDerWaalsContact O-N 3.12Å
26	E	89.4	Confident	74	Confident	55 Å²	55	85.3 Å²	85.3	26%	0.257	46%	0.463	S	S	.	.			trans	-140.3	160.8	-175.3	-64.7	-168	99.8	0	0	111.5	F23 P44 S119 K120	F23-E26 HydrophobicContact CB-CG 3.98Å; E26-P44 CarbonylContact C-O 3.58Å; E26-S119 WeakPolarHBondContact OE1-CA 3.38Å; E26-S119 WeakPolarHBondContact OE1-CB 3.44Å; E26-K120 PolarHBondContact OE1-N 2.79Å; E26-K120 IonicContact OE2-NZ 2.78Å; E26-K120 PolarHBondContact OE2-NZ 3.19Å
27	P	88.9	Confident	76.1	Confident	4 Å²	4	82.2 Å²	82.2	3%	0.026	45%	0.448	C	S	.	.			trans	-74.5	163.9	173.1	32.1	-36.3	0	0	0	113.3	P44 W61 K120 A122	P27-P44 WeakPolarHBondContact CD-O 3.36Å; P27-W61 HydrophobicContact CG-CH2 4.37Å; P27-K120 WeakPolarHBondContact CG-O 3.41Å; P27-A122 HydrophobicContact CB-CB 3.7Å; P27-A122 HydrophobicContact CG-CB 3.97Å
28	R	87.5	Confident	78.3	Confident	102 Å²	102	78.2 Å²	78.2	39%	0.385	42%	0.424	S	S	.	.			trans	-83.7	156.3	178.5	82.4	-173.2	167.5	134.3	0.8	112.4	E30 P31 Y32	R28-E30 HydrophobicContact CG-CB 4.27Å; R28-E30 IonicContact CZ-OE2 3.17Å; R28-E30 IonicContact NH1-OE2 2.75Å; R28-E30 PolarHBondContact NH1-OE2 2.74Å; R28-P31 PolarHBondContact NH2-O 2.9Å; R28-Y32 HydrophobicContact CG-CD2 4.46Å; R28-Y32 HydrophobicContact CG-CE2 3.63Å; R28-Y32 PolarHBondContact N-OH 3.49Å
29	S	81.6	Confident	80.6	Confident	105 Å²	105	78.7 Å²	78.7	73%	0.734	41%	0.408	S	S	*	.	S	Bend	trans	-81.6	-19.8	178.9	47.2	0	0	0	0	115.1
30	E	85.7	Confident	82.4	Confident	117 Å²	117	74.5 Å²	74.5	55%	0.547	39%	0.394	S	S	.	.	S	Bend	trans	-72.1	146.3	174.3	-65.6	179.2	151.1	0	0	111.8	R28 Y32	R28-E30 HydrophobicContact CG-CB 4.27Å; R28-E30 IonicContact CZ-OE2 3.17Å; R28-E30 IonicContact NH1-OE2 2.75Å; R28-E30 PolarHBondContact NH1-OE2 2.74Å; E30-Y32 PolarHBondContact O-N 2.84Å
31	P	88.5	Confident	84.2	Confident	43 Å²	43	71.5 Å²	71.5	28%	0.279	38%	0.375	S	S	.	.			trans	-60.8	133.1	176.7	-21.5	32.3	0	0	0	113.5	R28 Y33 N123 I125	R28-P31 PolarHBondContact NH2-O 2.9Å; P31-Y33 HydrophobicContact CB-CD2 4.24Å; P31-Y33 HydrophobicContact CB-CE2 3.85Å; P31-Y33 HydrophobicContact CG-CE2 4.33Å; P31-Y33 PolarHBondContact O-N 2.95Å; P31-N123 CarbonylContact C-O 3.55Å; P31-N123 WeakPolarHBondContact CA-O 3.45Å; P31-I125 HydrophobicContact CB-CD1 3.59Å; P31-I125 HydrophobicContact CB-CG1 4.06Å; P31-I125 HydrophobicContact CG-CD1 4.14Å
32	Y	90.5	Very high	85.6	Confident	33 Å²	33	67.4 Å²	67.4	13%	0.129	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	87.9	167.5	-66.3	-103.5	0	0	0	108.8	R28 E30 V34 L41 L43 A122 N123 I125	R28-Y32 HydrophobicContact CG-CD2 4.46Å; R28-Y32 HydrophobicContact CG-CE2 3.63Å; R28-Y32 PolarHBondContact N-OH 3.49Å; E30-Y32 PolarHBondContact O-N 2.84Å; Y32-V34 PolarHBondContact O-N 3.23Å; Y32-L41 HydrophobicContact CD1-CD1 3.96Å; Y32-L43 HydrophobicContact CD1-CD2 4.45Å; Y32-L43 HydrophobicContact CD2-CD2 4.39Å; Y32-L43 HydrophobicContact CE1-CD2 4.13Å; Y32-L43 HydrophobicContact CE2-CD2 4.08Å; Y32-A122 HydrophobicContact CE2-CB 4.17Å; Y32-N123 PolarHBondContact N-O 3.12Å; Y32-I125 PolarHBondContact O-N 2.94Å
33	Y	88.9	Confident	86.5	Confident	152 Å²	152	64.8 Å²	64.8	60%	0.596	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.1	119.7	165.9	-66.5	-80.3	0	0	0	109.3	P31 I125 L127	P31-Y33 HydrophobicContact CB-CD2 4.24Å; P31-Y33 HydrophobicContact CB-CE2 3.85Å; P31-Y33 HydrophobicContact CG-CE2 4.33Å; P31-Y33 PolarHBondContact O-N 2.95Å; Y33-I125 WeakPolarHBondContact CA-O 3.43Å; Y33-I125 HydrophobicContact CD1-CB 4Å; Y33-I125 HydrophobicContact CD1-CD1 4.44Å; Y33-I125 HydrophobicContact CD1-CG2 3.87Å; Y33-I125 HydrophobicContact CE1-CB 4.17Å; Y33-I125 HydrophobicContact CE1-CD1 3.8Å; Y33-I125 HydrophobicContact CE1-CG2 3.9Å; Y33-L127 HydrophobicContact CD1-CD2 4.23Å; Y33-L127 HydrophobicContact CD1-CG 4.44Å
34	V	87.5	Confident	87	Confident	20 Å²	20	64.7 Å²	64.7	12%	0.121	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	143	-174.5	59.9	0	0	0	0	108.8	Y32 S38 L41 V96 V124 I125 V126 L127	Y32-V34 PolarHBondContact O-N 3.23Å; V34-S38 VanDerWaalsContact CG2-CB 3.45Å; V34-L41 HydrophobicContact CG1-CD2 4.19Å; V34-V96 HydrophobicContact CG1-CG1 3.92Å; V34-V96 HydrophobicContact CG2-CB 4.45Å; V34-V96 HydrophobicContact CG2-CG1 4.36Å; V34-V96 HydrophobicContact CG2-CG2 4.11Å; V34-V124 HydrophobicContact CG1-CG1 3.76Å; V34-I125 PolarHBondContact N-O 3.43Å; V34-I125 VanDerWaalsContact N-O 3.09Å; V34-V126 HydrophobicContact CG1-CG2 4.26Å; V34-V126 CarbonylContact O-C 3.49Å; V34-V126 WeakPolarHBondContact O-CA 2.97Å; V34-L127 PolarHBondContact O-N 3.47Å
35	T	86.7	Confident	87.3	Confident	56 Å²	56	59.8 Å²	59.8	34%	0.344	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	143.5	176.7	46.2	0	0	0	0	111.4	G37 S38 L127	T35-G37 PolarHBondContact O-N 2.69Å; T35-S38 VanDerWaalsContact O-CB 3.25Å; T35-S38 WeakPolarHBondContact O-CB 3.44Å; T35-S38 PolarHBondContact O-N 2.7Å; T35-S38 PolarHBondContact O-OG 3.39Å; T35-S38 PolarHBondContact OG1-OG 2.97Å; T35-L127 WeakPolarHBondContact CA-O 3.46Å; T35-L127 HydrophobicContact CG2-CB 4.16Å
36	A	84.1	Confident	87.3	Confident	45 Å²	45	54.8 Å²	54.8	37%	0.372	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	132.9	170	0	0	0	0	0	110.6	V126 L127 V128	A36-V126 HydrophobicContact CB-CG1 3.74Å; A36-L127 PolarHBondContact N-O 3.23Å; A36-V128 HydrophobicContact CB-CG2 4.32Å
37	G	81.6	Confident	87	Confident	46 Å²	46	52.3 Å²	52.3	47%	0.474	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	-3.1	-173.4	0	0	0	0	0	115.5	T35 Q39 V96	T35-G37 PolarHBondContact O-N 2.69Å; G37-Q39 PolarHBondContact O-N 3.25Å; G37-Q39 PolarHBondContact O-NE2 3.11Å; G37-V96 PolarHBondContact N-O 2.72Å
38	S	84.3	Confident	86.6	Confident	37 Å²	37	55 Å²	55	26%	0.259	30%	0.301	S	S	.	.			trans	-58.1	132	165.9	-70.4	0	0	0	0	110	V34 T35 V96	V34-S38 VanDerWaalsContact CG2-CB 3.45Å; T35-S38 VanDerWaalsContact O-CB 3.25Å; T35-S38 WeakPolarHBondContact O-CB 3.44Å; T35-S38 PolarHBondContact O-N 2.7Å; T35-S38 PolarHBondContact O-OG 3.39Å; T35-S38 PolarHBondContact OG1-OG 2.97Å; S38-V96 WeakPolarHBondContact O-CB 3.19Å; S38-V96 WeakPolarHBondContact O-CG2 3.44Å; S38-V96 PolarHBondContact O-N 3.5Å
39	Q	86	Confident	85.5	Confident	116 Å²	116	52.6 Å²	52.6	54%	0.542	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	157.6	177.1	-55.1	-57	-86	0	0	110.9	G37 L41 K94 S95	G37-Q39 PolarHBondContact O-N 3.25Å; G37-Q39 PolarHBondContact O-NE2 3.11Å; Q39-L41 PolarHBondContact O-N 2.89Å; Q39-K94 CarbonylContact C-O 3.58Å; Q39-K94 WeakPolarHBondContact CA-O 3.41Å; Q39-K94 PolarHBondContact OE1-O 3.49Å; Q39-S95 PolarHBondContact NE2-OG 3.13Å
40	D	82.5	Confident	84.9	Confident	95 Å²	95	52 Å²	52	51%	0.508	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	53.5	52.5	164	-61.8	-38	0	0	0	115.7	L42 H92 I93 K94	D40-L42 PolarHBondContact O-N 2.93Å; D40-H92 VanDerWaalsContact CB-CE1 3.43Å; D40-H92 WeakPolarHBondContact CB-CE1 3.49Å; D40-H92 IonicContact OD1-CE1 2.66Å; D40-H92 PolarHBondContact OD1-CE1 3.46Å; D40-H92 IonicContact OD1-ND1 2.89Å; D40-H92 PolarHBondContact OD1-ND1 2.85Å; D40-I93 PolarHBondContact N-O 2.83Å; D40-K94 PolarHBondContact N-O 3.03Å
41	L	90.2	Very high	84.1	Confident	23 Å²	23	50 Å²	50	12%	0.12	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	102.5	168.4	171.4	59.8	0	0	0	110	Y32 V34 Q39 L43 I93 V96 V124	Y32-L41 HydrophobicContact CD1-CD1 3.96Å; V34-L41 HydrophobicContact CG1-CD2 4.19Å; Q39-L41 PolarHBondContact O-N 2.89Å; L41-L43 HydrophobicContact CD1-CD2 4.48Å; L41-I93 HydrophobicContact CB-CB 4.18Å; L41-I93 HydrophobicContact CD2-CD1 4.33Å; L41-I93 PolarHBondContact N-O 2.87Å; L41-I93 PolarHBondContact O-N 3.39Å; L41-V96 HydrophobicContact CB-CG2 3.69Å; L41-V96 HydrophobicContact CD2-CG2 3.97Å; L41-V96 HydrophobicContact CG-CG2 4.49Å; L41-V124 HydrophobicContact CD2-CG1 3.83Å; L41-V124 HydrophobicContact CD2-CG2 4.21Å
42	L	91	Very high	82.8	Confident	77 Å²	77	49.9 Å²	49.9	40%	0.403	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	117.4	176.1	-177.1	74.3	0	0	0	112.1	D40 N90	D40-L42 PolarHBondContact O-N 2.93Å; L42-N90 HydrophobicContact CD1-CB 3.64Å
43	L	92.2	Very high	81.3	Confident	0 Å²	0	53 Å²	53	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	110.9	165.3	-59.9	-177.7	0	0	0	109	Y32 L41 W61 L91 I93 F105 A122 V124	Y32-L43 HydrophobicContact CD1-CD2 4.45Å; Y32-L43 HydrophobicContact CD2-CD2 4.39Å; Y32-L43 HydrophobicContact CE1-CD2 4.13Å; Y32-L43 HydrophobicContact CE2-CD2 4.08Å; L41-L43 HydrophobicContact CD1-CD2 4.48Å; L43-W61 HydrophobicContact CB-CH2 3.7Å; L43-W61 HydrophobicContact CB-CZ2 4.22Å; L43-W61 HydrophobicContact CB-CZ3 4.22Å; L43-W61 HydrophobicContact CD1-CZ3 4.44Å; L43-W61 VanDerWaalsContact O-CZ2 3.28Å; L43-W61 WeakPolarHBondContact O-CZ2 3.4Å; L43-L91 HydrophobicContact CB-CB 4.29Å; L43-L91 HydrophobicContact CD1-CD2 4.38Å; L43-L91 PolarHBondContact N-O 2.82Å; L43-L91 PolarHBondContact O-N 2.92Å; L43-I93 HydrophobicContact CD1-CD1 4.02Å; L43-F105 HydrophobicContact CD1-CB 3.96Å; L43-F105 HydrophobicContact CD1-CD2 4.15Å; L43-F105 HydrophobicContact CD1-CG 4.08Å; L43-A122 HydrophobicContact CD1-CB 4.1Å; L43-A122 HydrophobicContact CD2-CB 3.98Å; L43-V124 HydrophobicContact CD1-CG2 4.4Å
44	P	90.7	Very high	79.7	Confident	18 Å²	18	48.2 Å²	48.2	12%	0.117	30%	0.301	C	S	.	.			trans	-77.6	138.8	-170.7	29.8	-35.1	0	0	0	113	K25 E26 P27 N90	K25-P44 HydrophobicContact CD-CB 3.92Å; K25-P44 HydrophobicContact CG-CB 4.1Å; E26-P44 CarbonylContact C-O 3.58Å; P27-P44 WeakPolarHBondContact CD-O 3.36Å; P44-N90 VanDerWaalsContact CA-OD1 3.3Å; P44-N90 WeakPolarHBondContact CA-OD1 3.42Å
45	C	90.1	Very high	78.3	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	34%	0.338	C	S	.	.			trans	-146.9	132.1	166	175.8	0	0	0	0	109.3	K25 W61 F89 N90 C107	K25-C45 WeakPolarHBondContact O-CA 3.37Å; C45-W61 HydrophobicContact CB-CH2 4.37Å; C45-W61 HydrophobicContact CB-CZ2 3.41Å; C45-W61 VanDerWaalsContact CB-CZ2 3.41Å; C45-F89 CarbonylContact O-C 3.55Å; C45-F89 PolarHBondContact O-N 3.08Å; C45-N90 PolarHBondContact N-OD1 2.9Å; C45-N90 PolarHBondContact O-N 2.81Å; C45-N90 PolarHBondContact O-OD1 3.4Å; C45-C107 HydrophobicContact CB-CB 3.58Å; C45-C107 WeakPolarHBondContact CB-SG 3.23Å; C45-C107 WeakPolarHBondContact SG-CB 3.44Å; C45-C107 CovalentContact SG-SG 2.04Å; C45-C107 PolarHBondContact SG-SG 2.95Å
46	A	85.5	Confident	76.6	Confident	6 Å²	6	58.5 Å²	58.5	5%	0.05	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	145.2	170.1	0	0	0	0	0	110	F23 V24 K25 G87	F23-A46 CarbonylContact C-O 3.39Å; F23-A46 VanDerWaalsContact CA-O 3.22Å; F23-A46 WeakPolarHBondContact CA-O 3.41Å; V24-A46 HydrophobicContact CB-CB 4.43Å; V24-A46 PolarHBondContact N-O 2.73Å; K25-A46 HydrophobicContact CB-CB 3.77Å; K25-A46 PolarHBondContact N-O 2.88Å; K25-A46 PolarHBondContact O-N 2.89Å; K25-A46 VanDerWaalsContact O-N 3.12Å; A46-G87 CarbonylContact C-O 3.57Å; A46-G87 WeakPolarHBondContact CA-O 3.32Å
47	V	83.9	Confident	75.6	Confident	3 Å²	3	58.2 Å²	58.2	2%	0.018	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	147	-175	175.2	0	0	0	0	108.8	Y22 F23 A49 V59 G87 F89 M109	Y22-V47 VanDerWaalsContact O-CA 3.28Å; Y22-V47 WeakPolarHBondContact O-CA 3.34Å; Y22-V47 WeakPolarHBondContact O-CG1 3.43Å; F23-V47 HydrophobicContact CD1-CG2 3.71Å; F23-V47 HydrophobicContact CE1-CG2 3.75Å; V47-A49 PolarHBondContact O-N 2.82Å; V47-V59 HydrophobicContact CG1-CG2 4.49Å; V47-V59 HydrophobicContact CG2-CG1 4.01Å; V47-V59 HydrophobicContact CG2-CG2 4.01Å; V47-G87 PolarHBondContact N-O 2.95Å; V47-G87 WeakPolarHBondContact O-CA 3.36Å; V47-F89 HydrophobicContact CB-CD2 4.44Å; V47-F89 HydrophobicContact CB-CE2 4.41Å; V47-F89 HydrophobicContact CG2-CD2 4.23Å; V47-M109 HydrophobicContact CG1-SD 3.61Å
48	D	78.5	Confident	75.3	Confident	62 Å²	62	58.9 Å²	58.9	33%	0.332	34%	0.342	S	S	.	.			trans	-59.5	137.6	-178.4	-179.7	-74.2	0	0	0	112.3	Y22 V24 T50 Y51 A52	Y22-D48 PolarHBondContact O-N 2.76Å; Y22-D48 VanDerWaalsContact O-N 3.13Å; V24-D48 HydrophobicContact CG2-CB 4.12Å; D48-T50 PolarHBondContact O-N 3.09Å; D48-T50 VanDerWaalsContact O-N 3.15Å; D48-T50 VanDerWaalsContact OD1-CB 3.31Å; D48-T50 WeakPolarHBondContact OD1-CB 3.45Å; D48-T50 WeakPolarHBondContact OD1-CG2 3.16Å; D48-T50 PolarHBondContact OD1-N 2.66Å; D48-T50 PolarHBondContact OD1-OG1 3.37Å; D48-Y51 HydrophobicContact CB-CD2 4.1Å; D48-Y51 PolarHBondContact O-N 2.97Å; D48-A52 PolarHBondContact O-N 3.39Å; D48-A52 VanDerWaalsContact O-N 3.08Å
49	A	65.9	Low	75.3	Confident	50 Å²	50	58.2 Å²	58.2	41%	0.413	34%	0.336	S	S	.	.	H	α-helix	trans	-62.6	-22.8	-171.4	0	0	0	0	0	114.4	V47 Y51 A52 S53	V47-A49 PolarHBondContact O-N 2.82Å; A49-Y51 VanDerWaalsContact C-N 3.3Å; A49-Y51 PolarHBondContact O-N 2.82Å; A49-A52 PolarHBondContact O-N 2.89Å; A49-S53 WeakPolarHBondContact O-CB 3.37Å; A49-S53 PolarHBondContact O-N 3Å; A49-S53 PolarHBondContact O-OG 2.93Å
50	T	69.2	Low	75.4	Confident	93 Å²	93	55.2 Å²	55.2	57%	0.571	32%	0.32	S	S	*	.	H	α-helix	trans	-64.7	-35.3	173.8	59.7	0	0	0	0	112	D48 S54	D48-T50 PolarHBondContact O-N 3.09Å; D48-T50 VanDerWaalsContact O-N 3.15Å; D48-T50 VanDerWaalsContact OD1-CB 3.31Å; D48-T50 WeakPolarHBondContact OD1-CB 3.45Å; D48-T50 WeakPolarHBondContact OD1-CG2 3.16Å; D48-T50 PolarHBondContact OD1-N 2.66Å; D48-T50 PolarHBondContact OD1-OG1 3.37Å; T50-S54 PolarHBondContact O-OG 2.78Å
51	Y	68.4	Low	75.9	Confident	75 Å²	75	50.7 Å²	50.7	29%	0.294	30%	0.296	S	S	.	.	H	α-helix	trans	-84.1	-32.8	173.3	-57.3	-84.1	0	0	0	111.8	Y22 D48 A49 S54 N57 M109	Y22-Y51 HydrophobicContact CD1-CE1 4.38Å; Y22-Y51 HydrophobicContact CD1-CE2 4.09Å; Y22-Y51 HydrophobicContact CE1-CE1 4.29Å; Y22-Y51 HydrophobicContact CE1-CE2 4.48Å; Y22-Y51 AromaticContact CE1-CZ 3.97Å; D48-Y51 HydrophobicContact CB-CD2 4.1Å; D48-Y51 PolarHBondContact O-N 2.97Å; A49-Y51 VanDerWaalsContact C-N 3.3Å; A49-Y51 PolarHBondContact O-N 2.82Å; Y51-S54 PolarHBondContact O-OG 2.69Å; Y51-N57 VanDerWaalsContact O-CB 3.3Å; Y51-N57 WeakPolarHBondContact O-CB 3.11Å; Y51-N57 PolarHBondContact O-ND2 2.8Å; Y51-M109 HydrophobicContact CD1-CE 4.44Å; Y51-M109 HydrophobicContact CG-SD 4.41Å
52	A	61.4	Low	76	Confident	40 Å²	40	50.4 Å²	50.4	33%	0.331	30%	0.295	S	S	.	.	H	α-helix	trans	-72.4	-31.7	-178.7	0	0	0	0	0	114.8	D48 A49	D48-A52 PolarHBondContact O-N 3.39Å; D48-A52 VanDerWaalsContact O-N 3.08Å; A49-A52 PolarHBondContact O-N 2.89Å
53	S	59.3	Low	76	Confident	99 Å²	99	49.2 Å²	49.2	69%	0.692	29%	0.285	S	S	*	.	S	Bend	trans	-85.2	-15.7	-176.2	57	0	0	0	0	114.6	A49 Q55	A49-S53 WeakPolarHBondContact O-CB 3.37Å; A49-S53 PolarHBondContact O-N 3Å; A49-S53 PolarHBondContact O-OG 2.93Å; S53-Q55 PolarHBondContact O-N 2.98Å
54	S	55.3	Low	75.9	Confident	52 Å²	52	50.6 Å²	50.6	36%	0.364	29%	0.292	S	S	.	.	S	Bend	trans	-88.9	92.3	-179.8	38.2	0	0	0	0	111	T50 Y51 N57	T50-S54 PolarHBondContact O-OG 2.78Å; Y51-S54 PolarHBondContact O-OG 2.69Å; S54-N57 PolarHBondContact O-N 2.78Å; S54-N57 PolarHBondContact OG-ND2 3.11Å
55	Q	56.6	Low	75.5	Confident	192 Å²	192	52.1 Å²	52.1	90%	0.897	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	124.5	164.5	-70	-173.1	-7.3	0	0	108.4	S53	S53-Q55 PolarHBondContact O-N 2.98Å
56	P	52.4	Low	75	Confident	99 Å²	99	60.9 Å²	60.9	64%	0.643	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	cis	-121	55.7	17.9	41.8	-28	0	0	0	114.9	P112	P56-P112 HydrophobicContact CG-CG 4.1Å
57	N	61.6	Low	74.7	Confident	40 Å²	40	67.3 Å²	67.3	21%	0.214	38%	0.375	C	S	.	.			trans	-62.2	149.2	160.4	-77.3	-38	0	0	0	110.4	Y51 S54 P112	Y51-N57 VanDerWaalsContact O-CB 3.3Å; Y51-N57 WeakPolarHBondContact O-CB 3.11Å; Y51-N57 PolarHBondContact O-ND2 2.8Å; S54-N57 PolarHBondContact O-N 2.78Å; S54-N57 PolarHBondContact OG-ND2 3.11Å; N57-P112 WeakPolarHBondContact OD1-CD 3.26Å
58	S	75.7	Confident	74.7	Confident	60 Å²	60	70.5 Å²	70.5	42%	0.42	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	132.6	-178.5	57.6	0	0	0	0	112.5	M109 A110	S58-M109 CarbonylContact O-C 3.47Å; S58-M109 WeakPolarHBondContact O-CA 3.25Å; S58-A110 PolarHBondContact N-O 2.91Å; S58-A110 PolarHBondContact O-N 3.31Å; S58-A110 PolarHBondContact OG-O 2.63Å
59	V	84.5	Confident	75.3	Confident	22 Å²	22	70.4 Å²	70.4	13%	0.133	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	137.9	-178.6	-174.5	0	0	0	0	109.1	V47 F89 Q108 M109	V47-V59 HydrophobicContact CG1-CG2 4.49Å; V47-V59 HydrophobicContact CG2-CG1 4.01Å; V47-V59 HydrophobicContact CG2-CG2 4.01Å; V59-F89 HydrophobicContact CB-CD1 3.9Å; V59-F89 HydrophobicContact CB-CD2 3.72Å; V59-F89 HydrophobicContact CB-CE1 3.88Å; V59-F89 HydrophobicContact CB-CE2 3.71Å; V59-F89 HydrophobicContact CB-CG 3.83Å; V59-F89 HydrophobicContact CB-CZ 3.79Å; V59-F89 HydrophobicContact CG1-CB 3.99Å; V59-F89 HydrophobicContact CG1-CD1 4.16Å; V59-F89 HydrophobicContact CG1-CD2 3.6Å; V59-F89 HydrophobicContact CG1-CE2 4.11Å; V59-F89 HydrophobicContact CG1-CG 3.65Å; V59-F89 HydrophobicContact CG2-CD2 3.98Å; V59-F89 HydrophobicContact CG2-CE1 4.47Å; V59-F89 HydrophobicContact CG2-CE2 3.6Å; V59-F89 HydrophobicContact CG2-CZ 3.87Å; V59-Q108 CarbonylContact C-O 3.58Å; V59-Q108 WeakPolarHBondContact CA-O 3.46Å; V59-M109 HydrophobicContact CG2-CB 4.1Å; V59-M109 HydrophobicContact CG2-CG 3.94Å
60	Y	87.8	Confident	76.3	Confident	53 Å²	53	74.6 Å²	74.6	21%	0.208	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	161	-173.8	45.8	-92.5	0	0	0	111.6	M62 L71 Q108 A110	Y60-M62 HydrophobicContact CD2-CG 4.19Å; Y60-M62 HydrophobicContact CD2-SD 3.62Å; Y60-M62 HydrophobicContact CE2-CG 4.32Å; Y60-M62 HydrophobicContact CE2-SD 3.75Å; Y60-L71 HydrophobicContact CD2-CD1 3.53Å; Y60-L71 HydrophobicContact CE2-CD1 4.39Å; Y60-L71 HydrophobicContact CG-CD1 3.73Å; Y60-Q108 HydrophobicContact CD2-CB 4.05Å; Y60-Q108 HydrophobicContact CE2-CB 3.73Å; Y60-Q108 HydrophobicContact CE2-CG 3.7Å; Y60-Q108 PolarHBondContact N-O 2.76Å; Y60-Q108 PolarHBondContact O-N 2.74Å; Y60-Q108 VanDerWaalsContact O-O 3.14Å; Y60-Q108 PolarHBondContact OH-NE2 3.01Å; Y60-A110 HydrophobicContact CE1-CB 3.99Å
61	W	93	Very high	77.4	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	152.7	174.7	-83	82.3	0	0	0	112.3	P27 L43 C45 V72 F89 L91 F105 Y106 C107	P27-W61 HydrophobicContact CG-CH2 4.37Å; L43-W61 HydrophobicContact CB-CH2 3.7Å; L43-W61 HydrophobicContact CB-CZ2 4.22Å; L43-W61 HydrophobicContact CB-CZ3 4.22Å; L43-W61 HydrophobicContact CD1-CZ3 4.44Å; L43-W61 VanDerWaalsContact O-CZ2 3.28Å; L43-W61 WeakPolarHBondContact O-CZ2 3.4Å; C45-W61 HydrophobicContact CB-CH2 4.37Å; C45-W61 HydrophobicContact CB-CZ2 3.41Å; C45-W61 VanDerWaalsContact CB-CZ2 3.41Å; W61-V72 HydrophobicContact CB-CB 3.74Å; W61-V72 HydrophobicContact CB-CG1 4.32Å; W61-V72 HydrophobicContact CB-CG2 4Å; W61-V72 WeakPolarHBondContact O-CB 3.48Å; W61-V72 PolarHBondContact O-N 2.84Å; W61-F89 PolarHBondContact NE1-O 2.97Å; W61-L91 HydrophobicContact CB-CD2 4.2Å; W61-L91 HydrophobicContact CD2-CB 3.59Å; W61-L91 HydrophobicContact CD2-CD2 3.85Å; W61-L91 HydrophobicContact CD2-CG 4.35Å; W61-L91 VanDerWaalsContact CE2-CB 3.4Å; W61-L91 HydrophobicContact CE3-CB 4.18Å; W61-L91 HydrophobicContact CE3-CD2 3.84Å; W61-L91 HydrophobicContact CG-CB 3.84Å; W61-L91 HydrophobicContact CG-CD2 4.03Å; W61-L91 HydrophobicContact CG-CG 4.44Å; W61-L91 HydrophobicContact CH2-CB 4.41Å; W61-L91 HydrophobicContact CZ2-CB 3.83Å; W61-L91 HydrophobicContact CZ3-CD2 4.5Å; W61-F105 HydrophobicContact CE3-CB 4.09Å; W61-F105 HydrophobicContact CZ3-CB 3.99Å; W61-Y106 VanDerWaalsContact CE3-O 3.24Å; W61-C107 HydrophobicContact CD2-CB 4.07Å; W61-C107 HydrophobicContact CE3-CB 4.37Å; W61-C107 HydrophobicContact CH2-CB 4.32Å; W61-C107 HydrophobicContact CZ2-CB 4.02Å; W61-C107 HydrophobicContact CZ3-CB 4.48Å
62	M	92.8	Very high	78.4	Confident	18 Å²	18	70.8 Å²	70.8	9%	0.089	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	134.9	178.8	-56.7	-61.9	-68.5	0	0	109.5	Y60 P69 Y70 L71 F105 Y106 Q108	Y60-M62 HydrophobicContact CD2-CG 4.19Å; Y60-M62 HydrophobicContact CD2-SD 3.62Å; Y60-M62 HydrophobicContact CE2-CG 4.32Å; Y60-M62 HydrophobicContact CE2-SD 3.75Å; M62-P69 HydrophobicContact CE-CB 3.76Å; M62-P69 HydrophobicContact CE-CG 4.39Å; M62-P69 WeakPolarHBondContact CE-O 3.3Å; M62-Y70 CarbonylContact C-O 3.58Å; M62-Y70 VanDerWaalsContact CA-O 3.29Å; M62-Y70 WeakPolarHBondContact CA-O 3.23Å; M62-L71 HydrophobicContact SD-CB 4.19Å; M62-L71 HydrophobicContact SD-CD1 3.94Å; M62-F105 CarbonylContact O-C 3.48Å; M62-F105 WeakPolarHBondContact O-CA 3.4Å; M62-Y106 HydrophobicContact CB-CD1 3.97Å; M62-Y106 HydrophobicContact CB-CD2 4.17Å; M62-Y106 HydrophobicContact CB-CE1 3.5Å; M62-Y106 VanDerWaalsContact CB-CE1 3.5Å; M62-Y106 HydrophobicContact CB-CE2 3.73Å; M62-Y106 HydrophobicContact CB-CG 4.28Å; M62-Y106 HydrophobicContact CG-CD2 4.42Å; M62-Y106 HydrophobicContact CG-CE1 4.31Å; M62-Y106 HydrophobicContact CG-CE2 3.72Å; M62-Y106 PolarHBondContact N-O 2.85Å; M62-Y106 PolarHBondContact O-N 3.44Å; M62-Q108 HydrophobicContact CG-CB 4.17Å
63	R	91.7	Very high	79.6	Confident	51 Å²	51	77.4 Å²	77.4	19%	0.192	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	130.4	169.1	-174	-173.5	177	-152.2	7.2	109.1	V65 Y70 V72 A99 R100 N102 K104 F105	R63-V65 HydrophobicContact CG-CG2 4.11Å; R63-Y70 PolarHBondContact N-O 2.75Å; R63-Y70 PolarHBondContact O-N 3.47Å; R63-V72 HydrophobicContact CB-CG2 4.13Å; R63-A99 PolarHBondContact NH2-O 2.81Å; R63-R100 PolarHBondContact NE-O 2.85Å; R63-R100 VanDerWaalsContact NE-O 3.11Å; R63-R100 PolarHBondContact NH1-O 2.98Å; R63-R100 VanDerWaalsContact NH1-O 3.14Å; R63-R100 PolarHBondContact NH2-O 2.87Å; R63-R100 VanDerWaalsContact NH2-O 3.16Å; R63-N102 PolarHBondContact NH2-O 2.78Å; R63-K104 WeakPolarHBondContact CA-O 3.49Å; R63-K104 WeakPolarHBondContact CG-O 3.36Å; R63-F105 HydrophobicContact CB-CD1 3.87Å; R63-F105 HydrophobicContact CB-CE1 3.74Å; R63-F105 HydrophobicContact CB-CZ 4.4Å; R63-F105 HydrophobicContact CG-CD1 4.06Å; R63-F105 HydrophobicContact CG-CE1 3.72Å; R63-F105 HydrophobicContact CG-CE2 4.31Å; R63-F105 HydrophobicContact CG-CZ 3.86Å
64	L	89.6	Confident	81.1	Confident	29 Å²	29	77.2 Å²	77.2	15%	0.152	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	116.3	172.2	-78.7	159	0	0	0	109.7	P69 K104 Y106 E121	L64-P69 HydrophobicContact CD2-CB 4.34Å; L64-K104 HydrophobicContact CB-CB 3.87Å; L64-K104 HydrophobicContact CD1-CB 4.13Å; L64-K104 HydrophobicContact CD1-CD 4.23Å; L64-K104 PolarHBondContact N-O 2.88Å; L64-Y106 HydrophobicContact CD1-CD1 3.91Å; L64-Y106 HydrophobicContact CD1-CE1 4.1Å; L64-Y106 HydrophobicContact CD2-CE1 4.29Å; L64-Y106 HydrophobicContact CG-CD1 4.07Å; L64-Y106 HydrophobicContact CG-CE1 3.89Å; L64-E121 HydrophobicContact CD1-CG 4.27Å; L64-E121 VanDerWaalsContact CD1-OE1 3.3Å; L64-E121 WeakPolarHBondContact CD1-OE1 3.42Å
65	V	83.1	Confident	82.7	Confident	50 Å²	50	78.4 Å²	78.4	30%	0.303	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	116.5	171.6	-177.1	0	0	0	0	106.8	R63 N67 T68 Y70	R63-V65 HydrophobicContact CG-CG2 4.11Å; V65-N67 VanDerWaalsContact C-N 3.28Å; V65-N67 PolarHBondContact O-N 3.06Å; V65-T68 PolarHBondContact N-O 2.77Å; V65-T68 WeakPolarHBondContact O-CA 3.4Å; V65-T68 WeakPolarHBondContact O-CB 3.41Å; V65-T68 PolarHBondContact O-N 3.5Å; V65-Y70 HydrophobicContact CB-CD2 3.94Å; V65-Y70 HydrophobicContact CB-CE2 3.89Å; V65-Y70 HydrophobicContact CG2-CD2 4.08Å; V65-Y70 HydrophobicContact CG2-CE2 4.46Å
66	E	79.2	Confident	84.3	Confident	184 Å²	184	72.9 Å²	72.9	86%	0.86	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	45.3	-176.7	-58.1	-173.7	167.5	0	0	113.2	T68	E66-T68 PolarHBondContact O-N 3Å
67	N	78.4	Confident	86.1	Confident	141 Å²	141	72.6 Å²	72.6	75%	0.754	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	2.4	-172.3	-63.5	-17.6	0	0	0	116	V65	V65-N67 VanDerWaalsContact C-N 3.28Å; V65-N67 PolarHBondContact O-N 3.06Å
68	T	85.2	Confident	87.6	Confident	70 Å²	70	71.5 Å²	71.5	43%	0.429	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	124.8	171.6	-58	0	0	0	0	109.2	V65 E66 Y70	V65-T68 PolarHBondContact N-O 2.77Å; V65-T68 WeakPolarHBondContact O-CA 3.4Å; V65-T68 WeakPolarHBondContact O-CB 3.41Å; V65-T68 PolarHBondContact O-N 3.5Å; E66-T68 PolarHBondContact O-N 3Å; T68-Y70 HydrophobicContact CG2-CD2 4.27Å; T68-Y70 HydrophobicContact CG2-CE2 3.63Å; T68-Y70 WeakPolarHBondContact O-CD2 3.43Å
69	P	89.4	Confident	88.3	Confident	61 Å²	61	73.1 Å²	73.1	40%	0.396	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	119.8	-178.3	33.9	-33.6	0	0	0	111.4	M62 L64 Y106	M62-P69 HydrophobicContact CE-CB 3.76Å; M62-P69 HydrophobicContact CE-CG 4.39Å; M62-P69 WeakPolarHBondContact CE-O 3.3Å; L64-P69 HydrophobicContact CD2-CB 4.34Å; P69-Y106 HydrophobicContact CB-CE1 4.14Å; P69-Y106 VanDerWaalsContact CB-OH 3.3Å; P69-Y106 WeakPolarHBondContact CB-OH 3.48Å
70	Y	88.7	Confident	88.5	Confident	137 Å²	137	73.5 Å²	73.5	54%	0.537	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	130.4	178.3	-71.2	-93.5	0	0	0	111.3	M62 R63 V65 T68 V72	M62-Y70 CarbonylContact C-O 3.58Å; M62-Y70 VanDerWaalsContact CA-O 3.29Å; M62-Y70 WeakPolarHBondContact CA-O 3.23Å; R63-Y70 PolarHBondContact N-O 2.75Å; R63-Y70 PolarHBondContact O-N 3.47Å; V65-Y70 HydrophobicContact CB-CD2 3.94Å; V65-Y70 HydrophobicContact CB-CE2 3.89Å; V65-Y70 HydrophobicContact CG2-CD2 4.08Å; V65-Y70 HydrophobicContact CG2-CE2 4.46Å; T68-Y70 HydrophobicContact CG2-CD2 4.27Å; T68-Y70 HydrophobicContact CG2-CE2 3.63Å; T68-Y70 WeakPolarHBondContact O-CD2 3.43Å; Y70-V72 PolarHBondContact O-N 2.86Å
71	L	91.1	Very high	88.4	Confident	79 Å²	79	72.1 Å²	72.1	41%	0.414	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	116.8	175.8	-179.7	70.1	0	0	0	111.2	Y60 M62 R73	Y60-L71 HydrophobicContact CD2-CD1 3.53Å; Y60-L71 HydrophobicContact CE2-CD1 4.39Å; Y60-L71 HydrophobicContact CG-CD1 3.73Å; M62-L71 HydrophobicContact SD-CB 4.19Å; M62-L71 HydrophobicContact SD-CD1 3.94Å; L71-R73 HydrophobicContact CD2-CG 4.34Å; L71-R73 HydrophobicContact CG-CG 4.39Å; L71-R73 PolarHBondContact O-N 3.37Å
72	V	90.1	Very high	87.8	Confident	10 Å²	10	75.7 Å²	75.7	6%	0.061	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	121.1	169.2	-179.4	0	0	0	0	107.9	W61 R63 Y70 Y78 L91 F105	W61-V72 HydrophobicContact CB-CB 3.74Å; W61-V72 HydrophobicContact CB-CG1 4.32Å; W61-V72 HydrophobicContact CB-CG2 4Å; W61-V72 WeakPolarHBondContact O-CB 3.48Å; W61-V72 PolarHBondContact O-N 2.84Å; R63-V72 HydrophobicContact CB-CG2 4.13Å; Y70-V72 PolarHBondContact O-N 2.86Å; V72-Y78 HydrophobicContact CG1-CD1 4.21Å; V72-Y78 HydrophobicContact CG1-CD2 3.74Å; V72-Y78 HydrophobicContact CG1-CE2 4.19Å; V72-Y78 HydrophobicContact CG1-CG 3.71Å; V72-L91 HydrophobicContact CG1-CD1 3.92Å; V72-L91 HydrophobicContact CG1-CD2 4.28Å; V72-F105 HydrophobicContact CG2-CD1 4.14Å; V72-F105 HydrophobicContact CG2-CE1 4.19Å
73	R	87	Confident	87.1	Confident	178 Å²	178	79.4 Å²	79.4	67%	0.672	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-103.7	147	176.1	-62.5	178	-176.1	-100.3	-0.7	108.8	L71 D75	L71-R73 HydrophobicContact CD2-CG 4.34Å; L71-R73 HydrophobicContact CG-CG 4.39Å; L71-R73 PolarHBondContact O-N 3.37Å; R73-D75 PolarHBondContact O-N 2.83Å
74	T	89.3	Confident	86.5	Confident	95 Å²	95	81.2 Å²	81.2	58%	0.583	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-64.8	122.1	170.4	50.2	0	0	0	0	109.9	Y78 I80	T74-Y78 CarbonylContact C-O 3.59Å; T74-Y78 WeakPolarHBondContact CA-O 3.44Å; T74-I80 HydrophobicContact CG2-CB 3.96Å; T74-I80 HydrophobicContact CG2-CD1 4.19Å; T74-I80 HydrophobicContact CG2-CG1 3.88Å
75	D	89.4	Confident	85.9	Confident	77 Å²	77	82.3 Å²	82.3	41%	0.412	45%	0.454	S	S	.	.	S	Bend	trans	-147.4	-155.9	-176.5	69.1	15.4	0	0	0	111.7	R73 F77 Y78	R73-D75 PolarHBondContact O-N 2.83Å; D75-F77 PolarHBondContact O-N 3.05Å; D75-F77 WeakPolarHBondContact OD1-CA 3.42Å; D75-F77 WeakPolarHBondContact OD1-CB 3.47Å; D75-F77 PolarHBondContact OD1-N 3.45Å; D75-Y78 PolarHBondContact N-O 3.35Å; D75-Y78 PolarHBondContact OD1-N 3.07Å
76	A	89.5	Confident	85.5	Confident	77 Å²	77	84.1 Å²	84.1	64%	0.636	47%	0.474	S	S	*	.	S	Bend	trans	-69.9	-14.6	178.4	0	0	0	0	0	114
77	F	91	Very high	85.5	Confident	93 Å²	93	75.8 Å²	75.8	41%	0.408	44%	0.438	S	S	.	.	S	Bend	trans	-119.3	-35.9	-172.1	-47.4	-64.3	0	0	0	112.8	D75 K94 R100	D75-F77 PolarHBondContact O-N 3.05Å; D75-F77 WeakPolarHBondContact OD1-CA 3.42Å; D75-F77 WeakPolarHBondContact OD1-CB 3.47Å; D75-F77 PolarHBondContact OD1-N 3.45Å; F77-K94 WeakPolarHBondContact O-CG 3.29Å; F77-K94 PolarHBondContact O-N 3.05Å; F77-R100 VanDerWaalsContact CB-CZ 3.45Å
78	Y	92.3	Very high	85.9	Confident	17 Å²	17	69.5 Å²	69.5	7%	0.067	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	130	179.9	-62.9	-56.2	0	0	0	111.1	V72 T74 D75 L91 H92 I93 R100 D101 F105	V72-Y78 HydrophobicContact CG1-CD1 4.21Å; V72-Y78 HydrophobicContact CG1-CD2 3.74Å; V72-Y78 HydrophobicContact CG1-CE2 4.19Å; V72-Y78 HydrophobicContact CG1-CG 3.71Å; T74-Y78 CarbonylContact C-O 3.59Å; T74-Y78 WeakPolarHBondContact CA-O 3.44Å; D75-Y78 PolarHBondContact N-O 3.35Å; D75-Y78 PolarHBondContact OD1-N 3.07Å; Y78-L91 HydrophobicContact CD1-CD1 3.75Å; Y78-L91 HydrophobicContact CD1-CG 4.44Å; Y78-L91 HydrophobicContact CG-CD1 4.15Å; Y78-H92 WeakPolarHBondContact CA-O 3.26Å; Y78-I93 HydrophobicContact CD1-CG1 4.03Å; Y78-I93 HydrophobicContact CE1-CD1 4.15Å; Y78-I93 HydrophobicContact CE1-CG1 3.92Å; Y78-I93 HydrophobicContact CE1-CG2 4.34Å; Y78-R100 HydrophobicContact CE2-CG 4.16Å; Y78-R100 PolarHBondContact OH-O 2.81Å; Y78-D101 PolarHBondContact OH-OD1 3Å; Y78-D101 VanDerWaalsContact OH-OD1 3.13Å; Y78-F105 HydrophobicContact CE1-CE1 4.02Å; Y78-F105 HydrophobicContact CE1-CZ 4.23Å; Y78-F105 AromaticContact CZ-CE1 3.96Å; Y78-F105 WeakPolarHBondContact OH-CE1 3.07Å; Y78-F105 VanDerWaalsContact OH-CZ 3.32Å; Y78-F105 WeakPolarHBondContact OH-CZ 3.24Å
79	E	90.2	Very high	86	Confident	93 Å²	93	68 Å²	68	44%	0.435	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	137.3	168.1	-179.4	164.7	150.5	0	0	109.7	H92 K94	E79-H92 HydrophobicContact CB-CB 4.31Å; E79-H92 PolarHBondContact N-O 2.7Å; E79-H92 PolarHBondContact O-N 2.88Å; E79-K94 WeakPolarHBondContact OE2-CE 3.32Å; E79-K94 IonicContact OE2-NZ 3.84Å; E79-K94 PolarHBondContact OE2-NZ 2.67Å
80	I	89.6	Confident	86.1	Confident	31 Å²	31	65.3 Å²	65.3	16%	0.159	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	95.8	175	-60.4	177.6	0	0	0	106	T74 S82 F89 N90	T74-I80 HydrophobicContact CG2-CB 3.96Å; T74-I80 HydrophobicContact CG2-CD1 4.19Å; T74-I80 HydrophobicContact CG2-CG1 3.88Å; I80-S82 PolarHBondContact O-N 2.85Å; I80-S82 VanDerWaalsContact O-N 3.14Å; I80-F89 HydrophobicContact CG2-CB 3.92Å; I80-F89 HydrophobicContact CG2-CD1 4.1Å; I80-N90 CarbonylContact C-O 3.52Å; I80-N90 WeakPolarHBondContact CA-O 3.39Å
81	D	84.9	Confident	86.2	Confident	24 Å²	24	58.8 Å²	58.8	13%	0.128	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	105.6	177.7	157.7	42.7	0	0	0	110.2	A83 S84 C88 F89 N90	D81-A83 PolarHBondContact OD1-N 2.94Å; D81-S84 PolarHBondContact OD1-N 2.81Å; D81-S84 PolarHBondContact OD1-OG 2.8Å; D81-S84 WeakPolarHBondContact OD2-CB 3.17Å; D81-S84 PolarHBondContact OD2-OG 2.84Å; D81-C88 CarbonylContact O-C 3.39Å; D81-F89 CarbonylContact O-C 3.54Å; D81-F89 VanDerWaalsContact O-CA 3.27Å; D81-F89 WeakPolarHBondContact O-CA 3.37Å; D81-F89 PolarHBondContact O-N 3.46Å; D81-N90 HydrophobicContact CB-CB 4.25Å; D81-N90 PolarHBondContact N-O 3.07Å; D81-N90 PolarHBondContact O-N 2.9Å; D81-N90 PolarHBondContact OD2-ND2 2.9Å
82	S	81.9	Confident	86.3	Confident	75 Å²	75	57.5 Å²	57.5	52%	0.524	34%	0.341	S	S	.	.			trans	-109.4	11.4	167.4	57.5	0	0	0	0	113.4	I80 C88	I80-S82 PolarHBondContact O-N 2.85Å; I80-S82 VanDerWaalsContact O-N 3.14Å; S82-C88 WeakPolarHBondContact CA-O 3.15Å; S82-C88 WeakPolarHBondContact CB-O 3.45Å
83	A	78.6	Confident	86.4	Confident	96 Å²	96	57 Å²	57	79%	0.793	34%	0.338	S	S	*	.	S	Bend	trans	-93	-31.5	179.3	0	0	0	0	0	112.5	D81 C85	D81-A83 PolarHBondContact OD1-N 2.94Å; A83-C85 VanDerWaalsContact C-N 3.25Å; A83-C85 PolarHBondContact O-N 2.03Å
84	S	77.9	Confident	86.5	Confident	88 Å²	88	51.5 Å²	51.5	62%	0.615	32%	0.319	S	S	*	.	S	Bend	trans	-61.8	-27.1	-177.7	-68.5	0	0	0	0	114.5	D81	D81-S84 PolarHBondContact OD1-N 2.81Å; D81-S84 PolarHBondContact OD1-OG 2.8Å; D81-S84 WeakPolarHBondContact OD2-CB 3.17Å; D81-S84 PolarHBondContact OD2-OG 2.84Å
85	C	78	Confident	86.6	Confident	52 Å²	52	49.1 Å²	49.1	35%	0.351	31%	0.306	S	S	.	.	S	Bend	trans	-160.8	156.5	173	75.4	0	0	0	0	112.1	A83 G87 C88	A83-C85 VanDerWaalsContact C-N 3.25Å; A83-C85 PolarHBondContact O-N 2.03Å; C85-G87 PolarHBondContact O-N 2.65Å; C85-G87 VanDerWaalsContact O-N 3.1Å; C85-C88 HydrophobicContact CB-CB 4.07Å; C85-C88 WeakPolarHBondContact CB-SG 3.26Å; C85-C88 PolarHBondContact N-SG 2.7Å; C85-C88 VanDerWaalsContact N-SG 3.39Å; C85-C88 WeakPolarHBondContact O-CB 3.45Å; C85-C88 PolarHBondContact O-N 2.83Å; C85-C88 VanDerWaalsContact SG-CA 3.5Å; C85-C88 WeakPolarHBondContact SG-CB 3.39Å; C85-C88 PolarHBondContact SG-N 2.78Å; C85-C88 CovalentContact SG-SG 2.04Å; C85-C88 PolarHBondContact SG-SG 2.89Å
86	A	73	Confident	86.6	Confident	88 Å²	88	45.6 Å²	45.6	73%	0.727	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	112.7	168.9	0	0	0	0	0	109.6
87	G	80.1	Confident	86.7	Confident	9 Å²	9	44.9 Å²	44.9	9%	0.093	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.4	1.8	-172.7	0	0	0	0	0	115.2	A46 V47 C85 F89	A46-G87 CarbonylContact C-O 3.57Å; A46-G87 WeakPolarHBondContact CA-O 3.32Å; V47-G87 PolarHBondContact N-O 2.95Å; V47-G87 WeakPolarHBondContact O-CA 3.36Å; C85-G87 PolarHBondContact O-N 2.65Å; C85-G87 VanDerWaalsContact O-N 3.1Å; G87-F89 VanDerWaalsContact O-CD2 3.28Å; G87-F89 WeakPolarHBondContact O-CD2 3.34Å
88	C	85.9	Confident	86.6	Confident	9 Å²	9	43.4 Å²	43.4	6%	0.061	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-67.2	145.7	167.3	-83.7	0	0	0	0	110.7	D81 S82 C85	D81-C88 CarbonylContact O-C 3.39Å; S82-C88 WeakPolarHBondContact CA-O 3.15Å; S82-C88 WeakPolarHBondContact CB-O 3.45Å; C85-C88 HydrophobicContact CB-CB 4.07Å; C85-C88 WeakPolarHBondContact CB-SG 3.26Å; C85-C88 PolarHBondContact N-SG 2.7Å; C85-C88 VanDerWaalsContact N-SG 3.39Å; C85-C88 WeakPolarHBondContact O-CB 3.45Å; C85-C88 PolarHBondContact O-N 2.83Å; C85-C88 VanDerWaalsContact SG-CA 3.5Å; C85-C88 WeakPolarHBondContact SG-CB 3.39Å; C85-C88 PolarHBondContact SG-N 2.78Å; C85-C88 CovalentContact SG-SG 2.04Å; C85-C88 PolarHBondContact SG-SG 2.89Å
89	F	88.2	Confident	86.3	Confident	39 Å²	39	46.1 Å²	46.1	17%	0.171	29%	0.291	C	S	.	.			trans	-148.5	47.3	170.5	-65.5	-84.5	0	0	0	108.6	C45 V47 V59 W61 I80 D81 G87	C45-F89 CarbonylContact O-C 3.55Å; C45-F89 PolarHBondContact O-N 3.08Å; V47-F89 HydrophobicContact CB-CD2 4.44Å; V47-F89 HydrophobicContact CB-CE2 4.41Å; V47-F89 HydrophobicContact CG2-CD2 4.23Å; V59-F89 HydrophobicContact CB-CD1 3.9Å; V59-F89 HydrophobicContact CB-CD2 3.72Å; V59-F89 HydrophobicContact CB-CE1 3.88Å; V59-F89 HydrophobicContact CB-CE2 3.71Å; V59-F89 HydrophobicContact CB-CG 3.83Å; V59-F89 HydrophobicContact CB-CZ 3.79Å; V59-F89 HydrophobicContact CG1-CB 3.99Å; V59-F89 HydrophobicContact CG1-CD1 4.16Å; V59-F89 HydrophobicContact CG1-CD2 3.6Å; V59-F89 HydrophobicContact CG1-CE2 4.11Å; V59-F89 HydrophobicContact CG1-CG 3.65Å; V59-F89 HydrophobicContact CG2-CD2 3.98Å; V59-F89 HydrophobicContact CG2-CE1 4.47Å; V59-F89 HydrophobicContact CG2-CE2 3.6Å; V59-F89 HydrophobicContact CG2-CZ 3.87Å; W61-F89 PolarHBondContact NE1-O 2.97Å; I80-F89 HydrophobicContact CG2-CB 3.92Å; I80-F89 HydrophobicContact CG2-CD1 4.1Å; D81-F89 CarbonylContact O-C 3.54Å; D81-F89 VanDerWaalsContact O-CA 3.27Å; D81-F89 WeakPolarHBondContact O-CA 3.37Å; D81-F89 PolarHBondContact O-N 3.46Å; G87-F89 VanDerWaalsContact O-CD2 3.28Å; G87-F89 WeakPolarHBondContact O-CD2 3.34Å
90	N	91	Very high	86.3	Confident	5 Å²	5	43.8 Å²	43.8	3%	0.027	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	135.9	-173.9	-51.4	-69.3	0	0	0	110.7	L42 P44 C45 I80 D81 H92	L42-N90 HydrophobicContact CD1-CB 3.64Å; P44-N90 VanDerWaalsContact CA-OD1 3.3Å; P44-N90 WeakPolarHBondContact CA-OD1 3.42Å; C45-N90 PolarHBondContact N-OD1 2.9Å; C45-N90 PolarHBondContact O-N 2.81Å; C45-N90 PolarHBondContact O-OD1 3.4Å; I80-N90 CarbonylContact C-O 3.52Å; I80-N90 WeakPolarHBondContact CA-O 3.39Å; D81-N90 HydrophobicContact CB-CB 4.25Å; D81-N90 PolarHBondContact N-O 3.07Å; D81-N90 PolarHBondContact O-N 2.9Å; D81-N90 PolarHBondContact OD2-ND2 2.9Å; N90-H92 PolarHBondContact O-N 2.9Å
91	L	92.3	Very high	86.4	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	113.2	174.1	175	59	0	0	0	109.8	L43 W61 V72 Y78 I93 F105	L43-L91 HydrophobicContact CB-CB 4.29Å; L43-L91 HydrophobicContact CD1-CD2 4.38Å; L43-L91 PolarHBondContact N-O 2.82Å; L43-L91 PolarHBondContact O-N 2.92Å; W61-L91 HydrophobicContact CB-CD2 4.2Å; W61-L91 HydrophobicContact CD2-CB 3.59Å; W61-L91 HydrophobicContact CD2-CD2 3.85Å; W61-L91 HydrophobicContact CD2-CG 4.35Å; W61-L91 VanDerWaalsContact CE2-CB 3.4Å; W61-L91 HydrophobicContact CE3-CB 4.18Å; W61-L91 HydrophobicContact CE3-CD2 3.84Å; W61-L91 HydrophobicContact CG-CB 3.84Å; W61-L91 HydrophobicContact CG-CD2 4.03Å; W61-L91 HydrophobicContact CG-CG 4.44Å; W61-L91 HydrophobicContact CH2-CB 4.41Å; W61-L91 HydrophobicContact CZ2-CB 3.83Å; W61-L91 HydrophobicContact CZ3-CD2 4.5Å; V72-L91 HydrophobicContact CG1-CD1 3.92Å; V72-L91 HydrophobicContact CG1-CD2 4.28Å; Y78-L91 HydrophobicContact CD1-CD1 3.75Å; Y78-L91 HydrophobicContact CD1-CG 4.44Å; Y78-L91 HydrophobicContact CG-CD1 4.15Å; L91-I93 HydrophobicContact CG-CG1 4.22Å; L91-F105 HydrophobicContact CD2-CD1 3.78Å; L91-F105 HydrophobicContact CD2-CE1 4.18Å; L91-F105 HydrophobicContact CD2-CG 4.49Å
92	H	92	Very high	86.6	Confident	51 Å²	51	43.4 Å²	43.4	24%	0.236	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	113.5	172.6	-141.1	-134	0	0	0	109.6	D40 Y78 E79 N90 K94	D40-H92 VanDerWaalsContact CB-CE1 3.43Å; D40-H92 WeakPolarHBondContact CB-CE1 3.49Å; D40-H92 IonicContact OD1-CE1 2.66Å; D40-H92 PolarHBondContact OD1-CE1 3.46Å; D40-H92 IonicContact OD1-ND1 2.89Å; D40-H92 PolarHBondContact OD1-ND1 2.85Å; Y78-H92 WeakPolarHBondContact CA-O 3.26Å; E79-H92 HydrophobicContact CB-CB 4.31Å; E79-H92 PolarHBondContact N-O 2.7Å; E79-H92 PolarHBondContact O-N 2.88Å; N90-H92 PolarHBondContact O-N 2.9Å; H92-K94 PolarHBondContact O-N 2.79Å
93	I	92.2	Very high	86.9	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	96.1	172.6	-52.5	-175.2	0	0	0	107.1	D40 L41 L43 Y78 L91 S95 V96 D101 F105	D40-I93 PolarHBondContact N-O 2.83Å; L41-I93 HydrophobicContact CB-CB 4.18Å; L41-I93 HydrophobicContact CD2-CD1 4.33Å; L41-I93 PolarHBondContact N-O 2.87Å; L41-I93 PolarHBondContact O-N 3.39Å; L43-I93 HydrophobicContact CD1-CD1 4.02Å; Y78-I93 HydrophobicContact CD1-CG1 4.03Å; Y78-I93 HydrophobicContact CE1-CD1 4.15Å; Y78-I93 HydrophobicContact CE1-CG1 3.92Å; Y78-I93 HydrophobicContact CE1-CG2 4.34Å; L91-I93 HydrophobicContact CG-CG1 4.22Å; I93-S95 VanDerWaalsContact C-N 3.34Å; I93-S95 PolarHBondContact O-N 3.35Å; I93-V96 HydrophobicContact CG2-CG2 4.07Å; I93-D101 HydrophobicContact CD1-CB 4.33Å; I93-D101 HydrophobicContact CG2-CB 4.3Å; I93-D101 VanDerWaalsContact CG2-CG 3.47Å; I93-D101 WeakPolarHBondContact CG2-OD2 3.44Å; I93-F105 HydrophobicContact CD1-CE2 4.38Å; I93-F105 HydrophobicContact CD1-CZ 4.3Å
94	K	89.8	Confident	87.6	Confident	62 Å²	62	39.8 Å²	39.8	27%	0.27	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	-37.7	-165.7	-63.3	-179.5	-178.5	-176.1	0	113.8	Q39 D40 F77 E79 H92	Q39-K94 CarbonylContact C-O 3.58Å; Q39-K94 WeakPolarHBondContact CA-O 3.41Å; Q39-K94 PolarHBondContact OE1-O 3.49Å; D40-K94 PolarHBondContact N-O 3.03Å; F77-K94 WeakPolarHBondContact O-CG 3.29Å; F77-K94 PolarHBondContact O-N 3.05Å; E79-K94 WeakPolarHBondContact OE2-CE 3.32Å; E79-K94 IonicContact OE2-NZ 3.84Å; E79-K94 PolarHBondContact OE2-NZ 2.67Å; H92-K94 PolarHBondContact O-N 2.79Å
95	S	91	Very high	88.3	Confident	45 Å²	45	35.6 Å²	35.6	32%	0.315	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	104	-178.6	-179.2	0	0	0	0	109.1	Q39 I93 D97 R100	Q39-S95 PolarHBondContact NE2-OG 3.13Å; I93-S95 VanDerWaalsContact C-N 3.34Å; I93-S95 PolarHBondContact O-N 3.35Å; S95-D97 PolarHBondContact O-N 3.34Å; S95-R100 PolarHBondContact O-NH2 3.36Å
96	V	90.4	Very high	89	Confident	4 Å²	4	34.4 Å²	34.4	2%	0.024	20%	0.198	C	C	.	.			trans	-66.1	123.4	-167.2	174.8	0	0	0	0	112.1	V34 G37 S38 L41 I93 D101 V126	V34-V96 HydrophobicContact CG1-CG1 3.92Å; V34-V96 HydrophobicContact CG2-CB 4.45Å; V34-V96 HydrophobicContact CG2-CG1 4.36Å; V34-V96 HydrophobicContact CG2-CG2 4.11Å; G37-V96 PolarHBondContact N-O 2.72Å; S38-V96 WeakPolarHBondContact O-CB 3.19Å; S38-V96 WeakPolarHBondContact O-CG2 3.44Å; S38-V96 PolarHBondContact O-N 3.5Å; L41-V96 HydrophobicContact CB-CG2 3.69Å; L41-V96 HydrophobicContact CD2-CG2 3.97Å; L41-V96 HydrophobicContact CG-CG2 4.49Å; I93-V96 HydrophobicContact CG2-CG2 4.07Å; V96-D101 VanDerWaalsContact CA-OD2 3.25Å; V96-D101 WeakPolarHBondContact CA-OD2 2.97Å; V96-D101 HydrophobicContact CG1-CB 4.4Å; V96-V126 HydrophobicContact CG1-CG1 4.06Å; V96-V126 HydrophobicContact CG1-CG2 3.69Å
97	D	90.8	Very high	89.8	Confident	62 Å²	62	30.2 Å²	30.2	33%	0.332	16%	0.163	S	C	.	.			trans	-112.9	145.7	173.2	171.6	55.9	0	0	0	112.3	S95 A99 R100 D101	S95-D97 PolarHBondContact O-N 3.34Å; D97-A99 WeakPolarHBondContact OD2-CA 3.44Å; D97-A99 WeakPolarHBondContact OD2-CB 3.39Å; D97-A99 PolarHBondContact OD2-N 2.86Å; D97-R100 HydrophobicContact CB-CB 4.2Å; D97-R100 WeakPolarHBondContact OD2-CB 3.34Å; D97-R100 PolarHBondContact OD2-N 2.81Å; D97-D101 PolarHBondContact N-OD2 2.97Å; D97-D101 WeakPolarHBondContact O-CA 3.41Å; D97-D101 VanDerWaalsContact O-CB 3.31Å; D97-D101 WeakPolarHBondContact O-CB 3.35Å; D97-D101 PolarHBondContact O-N 2.92Å
98	Y	87.8	Confident	90.3	Very high	62 Å²	62	31 Å²	31	24%	0.243	16%	0.164	C	C	.	.	H	α-helix	trans	-67.4	-42.2	179.7	175.8	-88.4	0	0	0	113.5	N102 V126 V128 N158 K185	Y98-N102 WeakPolarHBondContact O-CB 2.97Å; Y98-N102 PolarHBondContact O-N 2.85Å; Y98-V126 HydrophobicContact CD2-CB 4.11Å; Y98-V126 HydrophobicContact CD2-CG1 4.39Å; Y98-V128 HydrophobicContact CD2-CG2 3.62Å; Y98-V128 HydrophobicContact CE2-CG2 4.36Å; Y98-V128 HydrophobicContact CG-CG2 4.17Å; Y98-N158 HydrophobicContact CE2-CB 4.36Å; Y98-K185 HydrophobicContact CD1-CD 3.81Å; Y98-K185 HydrophobicContact CE1-CD 3.6Å; Y98-K185 HydrophobicContact CE2-CD 4.4Å; Y98-K185 HydrophobicContact CG-CD 4.3Å
99	A	86.5	Confident	90.2	Very high	73 Å²	73	30.6 Å²	30.6	60%	0.603	16%	0.162	S	C	*	.	H	α-helix	trans	-78.3	-37.9	-176.4	0	0	0	0	0	111.7	R63 D97	R63-A99 PolarHBondContact NH2-O 2.81Å; D97-A99 WeakPolarHBondContact OD2-CA 3.44Å; D97-A99 WeakPolarHBondContact OD2-CB 3.39Å; D97-A99 PolarHBondContact OD2-N 2.86Å
100	R	89.9	Confident	90	Very high	44 Å²	44	29.5 Å²	29.5	17%	0.166	16%	0.16	C	C	.	.	H	α-helix	trans	-82.7	-35.8	-176.8	-166.7	-166.9	60.2	-120.3	-8.8	113.8	R63 F77 Y78 S95 D97	R63-R100 PolarHBondContact NE-O 2.85Å; R63-R100 VanDerWaalsContact NE-O 3.11Å; R63-R100 PolarHBondContact NH1-O 2.98Å; R63-R100 VanDerWaalsContact NH1-O 3.14Å; R63-R100 PolarHBondContact NH2-O 2.87Å; R63-R100 VanDerWaalsContact NH2-O 3.16Å; F77-R100 VanDerWaalsContact CB-CZ 3.45Å; Y78-R100 HydrophobicContact CE2-CG 4.16Å; Y78-R100 PolarHBondContact OH-O 2.81Å; S95-R100 PolarHBondContact O-NH2 3.36Å; D97-R100 HydrophobicContact CB-CB 4.2Å; D97-R100 WeakPolarHBondContact OD2-CB 3.34Å; D97-R100 PolarHBondContact OD2-N 2.81Å
101	D	91.8	Very high	89.2	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-116.7	-14	-169.4	-44.3	-36.1	0	0	0	114.8	Y78 I93 V96 D97 G103 F105 V124	Y78-D101 PolarHBondContact OH-OD1 3Å; Y78-D101 VanDerWaalsContact OH-OD1 3.13Å; I93-D101 HydrophobicContact CD1-CB 4.33Å; I93-D101 HydrophobicContact CG2-CB 4.3Å; I93-D101 VanDerWaalsContact CG2-CG 3.47Å; I93-D101 WeakPolarHBondContact CG2-OD2 3.44Å; V96-D101 VanDerWaalsContact CA-OD2 3.25Å; V96-D101 WeakPolarHBondContact CA-OD2 2.97Å; V96-D101 HydrophobicContact CG1-CB 4.4Å; D97-D101 PolarHBondContact N-OD2 2.97Å; D97-D101 WeakPolarHBondContact O-CA 3.41Å; D97-D101 VanDerWaalsContact O-CB 3.31Å; D97-D101 WeakPolarHBondContact O-CB 3.35Å; D97-D101 PolarHBondContact O-N 2.92Å; D101-G103 PolarHBondContact O-N 2.85Å; D101-F105 WeakPolarHBondContact O-CE2 3.34Å; D101-V124 WeakPolarHBondContact O-CB 3.46Å
102	N	89.7	Confident	88.2	Confident	48 Å²	48	34.9 Å²	34.9	26%	0.257	19%	0.194	S	C	.	.	S	Bend	trans	-66.5	128.5	170.4	-166.7	88.6	0	0	0	109.3	R63 Y98 V124 V126	R63-N102 PolarHBondContact NH2-O 2.78Å; Y98-N102 WeakPolarHBondContact O-CB 2.97Å; Y98-N102 PolarHBondContact O-N 2.85Å; N102-V124 PolarHBondContact OD1-O 3.46Å; N102-V126 HydrophobicContact CB-CB 4.2Å; N102-V126 HydrophobicContact CB-CG2 3.88Å; N102-V126 PolarHBondContact OD1-N 3.5Å
103	G	88.5	Confident	87.5	Confident	19 Å²	19	38.6 Å²	38.6	20%	0.196	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	127.2	-153.3	-176.3	0	0	0	0	0	114	D101 V124	D101-G103 PolarHBondContact O-N 2.85Å; G103-V124 PolarHBondContact N-O 2.83Å; G103-V124 PolarHBondContact O-N 2.76Å
104	K	92.2	Very high	86.7	Confident	76 Å²	76	41.6 Å²	41.6	33%	0.33	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	140.5	-169	-76.3	-179.3	172.1	-162.7	0	113.4	R63 L64 E121 A122	R63-K104 WeakPolarHBondContact CA-O 3.49Å; R63-K104 WeakPolarHBondContact CG-O 3.36Å; L64-K104 HydrophobicContact CB-CB 3.87Å; L64-K104 HydrophobicContact CD1-CB 4.13Å; L64-K104 HydrophobicContact CD1-CD 4.23Å; L64-K104 PolarHBondContact N-O 2.88Å; K104-E121 WeakPolarHBondContact CD-OE2 3.19Å; K104-E121 WeakPolarHBondContact CE-OE2 3.43Å; K104-E121 IonicContact NZ-OE1 3.87Å; K104-E121 PolarHBondContact NZ-OE1 2.97Å; K104-E121 IonicContact NZ-OE2 3.92Å; K104-E121 PolarHBondContact NZ-OE2 2.99Å; K104-A122 CarbonylContact C-O 3.54Å; K104-A122 VanDerWaalsContact CA-O 3.26Å; K104-A122 WeakPolarHBondContact CA-O 3.43Å
105	F	93.2	Very high	86.1	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	149.5	176.4	-66.6	-97.9	0	0	0	112.1	L43 W61 M62 R63 V72 Y78 L91 I93 D101 E121 A122 V124	L43-F105 HydrophobicContact CD1-CB 3.96Å; L43-F105 HydrophobicContact CD1-CD2 4.15Å; L43-F105 HydrophobicContact CD1-CG 4.08Å; W61-F105 HydrophobicContact CE3-CB 4.09Å; W61-F105 HydrophobicContact CZ3-CB 3.99Å; M62-F105 CarbonylContact O-C 3.48Å; M62-F105 WeakPolarHBondContact O-CA 3.4Å; R63-F105 HydrophobicContact CB-CD1 3.87Å; R63-F105 HydrophobicContact CB-CE1 3.74Å; R63-F105 HydrophobicContact CB-CZ 4.4Å; R63-F105 HydrophobicContact CG-CD1 4.06Å; R63-F105 HydrophobicContact CG-CE1 3.72Å; R63-F105 HydrophobicContact CG-CE2 4.31Å; R63-F105 HydrophobicContact CG-CZ 3.86Å; V72-F105 HydrophobicContact CG2-CD1 4.14Å; V72-F105 HydrophobicContact CG2-CE1 4.19Å; Y78-F105 HydrophobicContact CE1-CE1 4.02Å; Y78-F105 HydrophobicContact CE1-CZ 4.23Å; Y78-F105 AromaticContact CZ-CE1 3.96Å; Y78-F105 WeakPolarHBondContact OH-CE1 3.07Å; Y78-F105 VanDerWaalsContact OH-CZ 3.32Å; Y78-F105 WeakPolarHBondContact OH-CZ 3.24Å; L91-F105 HydrophobicContact CD2-CD1 3.78Å; L91-F105 HydrophobicContact CD2-CE1 4.18Å; L91-F105 HydrophobicContact CD2-CG 4.49Å; I93-F105 HydrophobicContact CD1-CE2 4.38Å; I93-F105 HydrophobicContact CD1-CZ 4.3Å; D101-F105 WeakPolarHBondContact O-CE2 3.34Å; F105-E121 CarbonylContact O-C 3.58Å; F105-E121 WeakPolarHBondContact O-CA 3.4Å; F105-A122 PolarHBondContact N-O 2.73Å; F105-A122 PolarHBondContact O-N 3.49Å; F105-V124 HydrophobicContact CD2-CG2 4.34Å
106	Y	92.9	Very high	85.7	Confident	27 Å²	27	41.8 Å²	41.8	11%	0.106	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	156.8	171.1	71.1	-90.4	0	0	0	111.8	W61 M62 L64 P69 Q108 T118	W61-Y106 VanDerWaalsContact CE3-O 3.24Å; M62-Y106 HydrophobicContact CB-CD1 3.97Å; M62-Y106 HydrophobicContact CB-CD2 4.17Å; M62-Y106 HydrophobicContact CB-CE1 3.5Å; M62-Y106 VanDerWaalsContact CB-CE1 3.5Å; M62-Y106 HydrophobicContact CB-CE2 3.73Å; M62-Y106 HydrophobicContact CB-CG 4.28Å; M62-Y106 HydrophobicContact CG-CD2 4.42Å; M62-Y106 HydrophobicContact CG-CE1 4.31Å; M62-Y106 HydrophobicContact CG-CE2 3.72Å; M62-Y106 PolarHBondContact N-O 2.85Å; M62-Y106 PolarHBondContact O-N 3.44Å; L64-Y106 HydrophobicContact CD1-CD1 3.91Å; L64-Y106 HydrophobicContact CD1-CE1 4.1Å; L64-Y106 HydrophobicContact CD2-CE1 4.29Å; L64-Y106 HydrophobicContact CG-CD1 4.07Å; L64-Y106 HydrophobicContact CG-CE1 3.89Å; P69-Y106 HydrophobicContact CB-CE1 4.14Å; P69-Y106 VanDerWaalsContact CB-OH 3.3Å; P69-Y106 WeakPolarHBondContact CB-OH 3.48Å; Y106-Q108 HydrophobicContact CD2-CB 4.49Å; Y106-Q108 HydrophobicContact CE2-CB 4.09Å; Y106-Q108 PolarHBondContact OH-OE1 2.76Å; Y106-T118 HydrophobicContact CD2-CG2 3.96Å; Y106-T118 HydrophobicContact CE2-CG2 3.55Å
107	C	90.1	Very high	85.4	Confident	0 Å²	0	44 Å²	44	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	144.9	177.6	-163.3	0	0	0	0	110.2	F23 C45 W61 T118 S119	F23-C107 HydrophobicContact CE1-CB 4.14Å; C45-C107 HydrophobicContact CB-CB 3.58Å; C45-C107 WeakPolarHBondContact CB-SG 3.23Å; C45-C107 WeakPolarHBondContact SG-CB 3.44Å; C45-C107 CovalentContact SG-SG 2.04Å; C45-C107 PolarHBondContact SG-SG 2.95Å; W61-C107 HydrophobicContact CD2-CB 4.07Å; W61-C107 HydrophobicContact CE3-CB 4.37Å; W61-C107 HydrophobicContact CH2-CB 4.32Å; W61-C107 HydrophobicContact CZ2-CB 4.02Å; W61-C107 HydrophobicContact CZ3-CB 4.48Å; C107-T118 CarbonylContact O-C 3.59Å; C107-T118 VanDerWaalsContact O-CA 3.3Å; C107-T118 WeakPolarHBondContact O-CA 3.3Å; C107-S119 PolarHBondContact N-OG 2.88Å; C107-S119 PolarHBondContact O-N 2.92Å
108	Q	89.6	Confident	85.3	Confident	25 Å²	25	44.7 Å²	44.7	12%	0.117	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	133.5	-176.6	-176.7	168.5	-44.5	0	0	111.7	V59 Y60 M62 Y106 H117 T118	V59-Q108 CarbonylContact C-O 3.58Å; V59-Q108 WeakPolarHBondContact CA-O 3.46Å; Y60-Q108 HydrophobicContact CD2-CB 4.05Å; Y60-Q108 HydrophobicContact CE2-CB 3.73Å; Y60-Q108 HydrophobicContact CE2-CG 3.7Å; Y60-Q108 PolarHBondContact N-O 2.76Å; Y60-Q108 PolarHBondContact O-N 2.74Å; Y60-Q108 VanDerWaalsContact O-O 3.14Å; Y60-Q108 PolarHBondContact OH-NE2 3.01Å; M62-Q108 HydrophobicContact CG-CB 4.17Å; Y106-Q108 HydrophobicContact CD2-CB 4.49Å; Y106-Q108 HydrophobicContact CE2-CB 4.09Å; Y106-Q108 PolarHBondContact OH-OE1 2.76Å; Q108-H117 CarbonylContact C-O 3.5Å; Q108-H117 VanDerWaalsContact CA-O 3.3Å; Q108-H117 WeakPolarHBondContact CA-O 3.19Å; Q108-T118 HydrophobicContact CB-CG2 4.24Å; Q108-T118 HydrophobicContact CG-CG2 3.96Å
109	M	85	Confident	85.3	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	143	170.8	-179.7	175.7	75.9	0	0	109.9	Y22 F23 V47 Y51 S58 V59 T111 T116 H117	Y22-M109 HydrophobicContact CD1-CE 3.63Å; Y22-M109 HydrophobicContact CE1-CE 4.4Å; Y22-M109 HydrophobicContact CG-CE 3.81Å; F23-M109 HydrophobicContact CZ-CB 4.39Å; V47-M109 HydrophobicContact CG1-SD 3.61Å; Y51-M109 HydrophobicContact CD1-CE 4.44Å; Y51-M109 HydrophobicContact CG-SD 4.41Å; S58-M109 CarbonylContact O-C 3.47Å; S58-M109 WeakPolarHBondContact O-CA 3.25Å; V59-M109 HydrophobicContact CG2-CB 4.1Å; V59-M109 HydrophobicContact CG2-CG 3.94Å; M109-T111 HydrophobicContact CE-CG2 4.18Å; M109-T116 CarbonylContact O-C 3.59Å; M109-T116 VanDerWaalsContact O-CA 3.25Å; M109-T116 WeakPolarHBondContact O-CA 3.48Å; M109-H117 PolarHBondContact N-O 2.98Å; M109-H117 PolarHBondContact O-N 2.79Å
110	A	84.2	Confident	85.4	Confident	16 Å²	16	44.3 Å²	44.3	13%	0.132	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	134.5	170	0	0	0	0	0	111.4	S58 Y60 S115 T116	S58-A110 PolarHBondContact N-O 2.91Å; S58-A110 PolarHBondContact O-N 3.31Å; S58-A110 PolarHBondContact OG-O 2.63Å; Y60-A110 HydrophobicContact CE1-CB 3.99Å; A110-S115 WeakPolarHBondContact CA-O 3.27Å; A110-T116 HydrophobicContact CB-CG2 3.97Å
111	T	73.9	Confident	85.5	Confident	25 Å²	25	46.3 Å²	46.3	15%	0.153	27%	0.269	C	S	.	.			trans	-102.9	155.8	-177.2	46.5	0	0	0	0	112.1	M109 D113 G114 S115	M109-T111 HydrophobicContact CE-CG2 4.18Å; T111-D113 VanDerWaalsContact CB-OD1 3.28Å; T111-D113 WeakPolarHBondContact CB-OD1 3.49Å; T111-D113 PolarHBondContact O-N 2.95Å; T111-D113 PolarHBondContact OG1-OD1 2.83Å; T111-G114 PolarHBondContact O-N 2.93Å; T111-S115 PolarHBondContact N-O 3.29Å; T111-S115 WeakPolarHBondContact OG1-CB 3.23Å; T111-S115 PolarHBondContact OG1-O 2.85Å; T111-S115 PolarHBondContact OG1-OG 2.92Å
112	P	71.6	Confident	85.4	Confident	92 Å²	92	46.3 Å²	46.3	60%	0.597	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-15.5	-178.2	-30.1	34.9	0	0	0	117.2	P56 N57 G114	P56-P112 HydrophobicContact CG-CG 4.1Å; N57-P112 WeakPolarHBondContact OD1-CD 3.26Å; P112-G114 VanDerWaalsContact C-N 3.33Å
113	D	77.5	Confident	85.6	Confident	129 Å²	129	46.6 Å²	46.6	69%	0.69	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-6	173.1	65.2	-11.5	0	0	0	113.5	T111 S115	T111-D113 VanDerWaalsContact CB-OD1 3.28Å; T111-D113 WeakPolarHBondContact CB-OD1 3.49Å; T111-D113 PolarHBondContact O-N 2.95Å; T111-D113 PolarHBondContact OG1-OD1 2.83Å; D113-S115 WeakPolarHBondContact OD1-CB 3.49Å; D113-S115 PolarHBondContact OD1-N 2.89Å
114	G	74.1	Confident	85.7	Confident	63 Å²	63	45.7 Å²	45.7	65%	0.649	26%	0.261	S	S	*	.	S	Bend	trans	92.2	3.3	-177.8	0	0	0	0	0	115.1	T111 P112	T111-G114 PolarHBondContact O-N 2.93Å; P112-G114 VanDerWaalsContact C-N 3.33Å
115	S	78.1	Confident	85.6	Confident	37 Å²	37	44 Å²	44	26%	0.259	26%	0.255	S	S	.	.			trans	-73	153	175.2	107.6	0	0	0	0	112	A110 T111 D113	A110-S115 WeakPolarHBondContact CA-O 3.27Å; T111-S115 PolarHBondContact N-O 3.29Å; T111-S115 WeakPolarHBondContact OG1-CB 3.23Å; T111-S115 PolarHBondContact OG1-O 2.85Å; T111-S115 PolarHBondContact OG1-OG 2.92Å; D113-S115 WeakPolarHBondContact OD1-CB 3.49Å; D113-S115 PolarHBondContact OD1-N 2.89Å
116	T	82.4	Confident	85.5	Confident	75 Å²	75	44 Å²	44	46%	0.46	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	144.2	178.6	60.7	0	0	0	0	113.3	M109 A110	M109-T116 CarbonylContact O-C 3.59Å; M109-T116 VanDerWaalsContact O-CA 3.25Å; M109-T116 WeakPolarHBondContact O-CA 3.48Å; A110-T116 HydrophobicContact CB-CG2 3.97Å
117	H	84	Confident	85.2	Confident	49 Å²	49	44.3 Å²	44.3	23%	0.227	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	141.6	-177.8	-59.3	-35.7	0	0	0	110.7	Y22 F23 Q108 M109	Y22-H117 AromaticContact CD1-CD2 3.95Å; Y22-H117 HydrophobicContact CD2-CB 3.95Å; Y22-H117 AromaticContact CD2-CD2 3.24Å; Y22-H117 WeakPolarHBondContact CD2-CD2 3.36Å; Y22-H117 AromaticContact CD2-CG 3.57Å; Y22-H117 AromaticContact CD2-NE2 3.89Å; Y22-H117 AromaticContact CE1-CD2 3.84Å; Y22-H117 AromaticContact CE1-NE2 3.95Å; Y22-H117 HydrophobicContact CE2-CB 4.47Å; Y22-H117 AromaticContact CE2-CD2 3.1Å; Y22-H117 WeakPolarHBondContact CE2-CD2 3.47Å; Y22-H117 AromaticContact CE2-CE1 3.8Å; Y22-H117 AromaticContact CE2-CG 3.62Å; Y22-H117 AromaticContact CE2-NE2 3.22Å; Y22-H117 WeakPolarHBondContact CE2-NE2 3.41Å; Y22-H117 HydrophobicContact CG-CB 4.48Å; Y22-H117 AromaticContact CG-CD2 3.66Å; Y22-H117 AromaticContact CZ-CD2 3.42Å; Y22-H117 VanDerWaalsContact CZ-CD2 3.42Å; Y22-H117 AromaticContact CZ-NE2 3.24Å; Y22-H117 PolarHBondContact OH-NE2 2.96Å; F23-H117 HydrophobicContact CE2-CB 4.36Å; F23-H117 WeakPolarHBondContact CZ-O 3.48Å; Q108-H117 CarbonylContact C-O 3.5Å; Q108-H117 VanDerWaalsContact CA-O 3.3Å; Q108-H117 WeakPolarHBondContact CA-O 3.19Å; M109-H117 PolarHBondContact N-O 2.98Å; M109-H117 PolarHBondContact O-N 2.79Å
118	T	87.9	Confident	85	Confident	78 Å²	78	45.4 Å²	45.4	48%	0.479	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	148.8	-170.3	58.3	0	0	0	0	113	Y106 C107 Q108	Y106-T118 HydrophobicContact CD2-CG2 3.96Å; Y106-T118 HydrophobicContact CE2-CG2 3.55Å; C107-T118 CarbonylContact O-C 3.59Å; C107-T118 VanDerWaalsContact O-CA 3.3Å; C107-T118 WeakPolarHBondContact O-CA 3.3Å; Q108-T118 HydrophobicContact CB-CG2 4.24Å; Q108-T118 HydrophobicContact CG-CG2 3.96Å
119	S	88.3	Confident	84.7	Confident	12 Å²	12	50.5 Å²	50.5	8%	0.084	28%	0.283	C	S	.	.			trans	-80.8	174.8	172.9	76	0	0	0	0	113.4	E26 C107	E26-S119 WeakPolarHBondContact OE1-CA 3.38Å; E26-S119 WeakPolarHBondContact OE1-CB 3.44Å; C107-S119 PolarHBondContact N-OG 2.88Å; C107-S119 PolarHBondContact O-N 2.92Å
120	K	88.6	Confident	84.6	Confident	115 Å²	115	51.6 Å²	51.6	50%	0.5	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-50.2	150.4	159	-67.9	179.1	-179.3	89.3	0	112.1	E26 P27	E26-K120 PolarHBondContact OE1-N 2.79Å; E26-K120 IonicContact OE2-NZ 2.78Å; E26-K120 PolarHBondContact OE2-NZ 3.19Å; P27-K120 WeakPolarHBondContact CG-O 3.41Å
121	E	91.3	Very high	84.3	Confident	86 Å²	86	52.3 Å²	52.3	40%	0.402	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-80.6	129.7	172.2	-61.7	179.4	156.1	0	0	111.4	L64 K104 F105	L64-E121 HydrophobicContact CD1-CG 4.27Å; L64-E121 VanDerWaalsContact CD1-OE1 3.3Å; L64-E121 WeakPolarHBondContact CD1-OE1 3.42Å; K104-E121 WeakPolarHBondContact CD-OE2 3.19Å; K104-E121 WeakPolarHBondContact CE-OE2 3.43Å; K104-E121 IonicContact NZ-OE1 3.87Å; K104-E121 PolarHBondContact NZ-OE1 2.97Å; K104-E121 IonicContact NZ-OE2 3.92Å; K104-E121 PolarHBondContact NZ-OE2 2.99Å; F105-E121 CarbonylContact O-C 3.58Å; F105-E121 WeakPolarHBondContact O-CA 3.4Å
122	A	91.4	Very high	84.5	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	127.5	164.7	0	0	0	0	0	110	P27 Y32 L43 K104 F105	P27-A122 HydrophobicContact CB-CB 3.7Å; P27-A122 HydrophobicContact CG-CB 3.97Å; Y32-A122 HydrophobicContact CE2-CB 4.17Å; L43-A122 HydrophobicContact CD1-CB 4.1Å; L43-A122 HydrophobicContact CD2-CB 3.98Å; K104-A122 CarbonylContact C-O 3.54Å; K104-A122 VanDerWaalsContact CA-O 3.26Å; K104-A122 WeakPolarHBondContact CA-O 3.43Å; F105-A122 PolarHBondContact N-O 2.73Å; F105-A122 PolarHBondContact O-N 3.49Å
123	N	92.3	Very high	84.9	Confident	54 Å²	54	54.8 Å²	54.8	29%	0.289	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	117.7	173.3	-175.6	31.6	0	0	0	110.5	P31 Y32	P31-N123 CarbonylContact C-O 3.55Å; P31-N123 WeakPolarHBondContact CA-O 3.45Å; Y32-N123 PolarHBondContact N-O 3.12Å
124	V	91.7	Very high	85.1	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	122.1	-178.4	-178.1	0	0	0	0	109.5	V34 L41 L43 D101 N102 G103 F105 V126	V34-V124 HydrophobicContact CG1-CG1 3.76Å; L41-V124 HydrophobicContact CD2-CG1 3.83Å; L41-V124 HydrophobicContact CD2-CG2 4.21Å; L43-V124 HydrophobicContact CD1-CG2 4.4Å; D101-V124 WeakPolarHBondContact O-CB 3.46Å; N102-V124 PolarHBondContact OD1-O 3.46Å; G103-V124 PolarHBondContact N-O 2.83Å; G103-V124 PolarHBondContact O-N 2.76Å; F105-V124 HydrophobicContact CD2-CG2 4.34Å; V124-V126 HydrophobicContact CG1-CG2 4.09Å
125	I	90.1	Very high	85.4	Confident	40 Å²	40	52.3 Å²	52.3	21%	0.205	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	106.2	178.4	-61.2	-178.5	0	0	0	108.4	P31 Y32 Y33 V34 L127	P31-I125 HydrophobicContact CB-CD1 3.59Å; P31-I125 HydrophobicContact CB-CG1 4.06Å; P31-I125 HydrophobicContact CG-CD1 4.14Å; Y32-I125 PolarHBondContact O-N 2.94Å; Y33-I125 WeakPolarHBondContact CA-O 3.43Å; Y33-I125 HydrophobicContact CD1-CB 4Å; Y33-I125 HydrophobicContact CD1-CD1 4.44Å; Y33-I125 HydrophobicContact CD1-CG2 3.87Å; Y33-I125 HydrophobicContact CE1-CB 4.17Å; Y33-I125 HydrophobicContact CE1-CD1 3.8Å; Y33-I125 HydrophobicContact CE1-CG2 3.9Å; V34-I125 PolarHBondContact N-O 3.43Å; V34-I125 VanDerWaalsContact N-O 3.09Å; I125-L127 PolarHBondContact O-N 2.93Å
126	V	89.8	Confident	85.7	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	102.6	-177.5	-174.7	0	0	0	0	109.7	V34 A36 V96 Y98 N102 V124 V128 N158	V34-V126 HydrophobicContact CG1-CG2 4.26Å; V34-V126 CarbonylContact O-C 3.49Å; V34-V126 WeakPolarHBondContact O-CA 2.97Å; A36-V126 HydrophobicContact CB-CG1 3.74Å; V96-V126 HydrophobicContact CG1-CG1 4.06Å; V96-V126 HydrophobicContact CG1-CG2 3.69Å; Y98-V126 HydrophobicContact CD2-CB 4.11Å; Y98-V126 HydrophobicContact CD2-CG1 4.39Å; N102-V126 HydrophobicContact CB-CB 4.2Å; N102-V126 HydrophobicContact CB-CG2 3.88Å; N102-V126 PolarHBondContact OD1-N 3.5Å; V124-V126 HydrophobicContact CG1-CG2 4.09Å; V126-V128 HydrophobicContact CG1-CG2 4.48Å; V126-N158 PolarHBondContact O-ND2 3.41Å
127	L	88.1	Confident	85.3	Confident	33 Å²	33	54.3 Å²	54.3	17%	0.173	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	137	171.8	-63.7	179	0	0	0	110.1	Y33 V34 T35 A36 I125 A214	Y33-L127 HydrophobicContact CD1-CD2 4.23Å; Y33-L127 HydrophobicContact CD1-CG 4.44Å; V34-L127 PolarHBondContact O-N 3.47Å; T35-L127 WeakPolarHBondContact CA-O 3.46Å; T35-L127 HydrophobicContact CG2-CB 4.16Å; A36-L127 PolarHBondContact N-O 3.23Å; I125-L127 PolarHBondContact O-N 2.93Å; L127-A214 HydrophobicContact CB-CB 3.98Å
128	V	84.6	Confident	84.6	Confident	24 Å²	24	60 Å²	60	15%	0.145	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-131	135.2	-178	-170.3	0	0	0	0	108.5	A36 Y98 V126 G157 N158 N212 A214	A36-V128 HydrophobicContact CB-CG2 4.32Å; Y98-V128 HydrophobicContact CD2-CG2 3.62Å; Y98-V128 HydrophobicContact CE2-CG2 4.36Å; Y98-V128 HydrophobicContact CG-CG2 4.17Å; V126-V128 HydrophobicContact CG1-CG2 4.48Å; V128-G157 CarbonylContact O-C 3.53Å; V128-G157 VanDerWaalsContact O-CA 3.28Å; V128-G157 WeakPolarHBondContact O-CA 3.39Å; V128-N158 HydrophobicContact CB-CB 4.01Å; V128-N158 HydrophobicContact CG2-CB 4.03Å; V128-N158 PolarHBondContact N-O 2.93Å; V128-N158 VanDerWaalsContact N-O 3.11Å; V128-N158 PolarHBondContact O-N 2.88Å; V128-N212 PolarHBondContact O-ND2 3.08Å; V128-A214 WeakPolarHBondContact O-CB 3.4Å
129	R	84.4	Confident	83.8	Confident	132 Å²	132	59.4 Å²	59.4	50%	0.498	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-71.5	152.8	173.7	-69.2	-180	-179.4	170.7	3.1	110.5	G157 A214 M215	R129-G157 WeakPolarHBondContact O-CA 3.34Å; R129-A214 HydrophobicContact CG-CB 4.05Å; R129-A214 VanDerWaalsContact CG-O 3.29Å; R129-A214 WeakPolarHBondContact CG-O 3.46Å; R129-A214 PolarHBondContact NE-O 3.23Å; R129-M215 HydrophobicContact CG-CG 4.11Å
130	P	82.3	Confident	82.9	Confident	23 Å²	23	59.5 Å²	59.5	15%	0.149	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-63.1	156.8	175	-19.2	34.6	0	0	0	111.5	S154 P161 I210 N212 M215	P130-S154 WeakPolarHBondContact CB-OG 3.3Å; P130-P161 HydrophobicContact CB-CB 3.87Å; P130-P161 HydrophobicContact CB-CG 4.11Å; P130-P161 HydrophobicContact CG-CB 3.87Å; P130-I210 HydrophobicContact CB-CG2 3.93Å; P130-I210 HydrophobicContact CG-CG2 4.02Å; P130-N212 WeakPolarHBondContact CD-OD1 3.37Å; P130-N212 HydrophobicContact CG-CB 4.04Å; P130-M215 HydrophobicContact CG-SD 4.23Å
131	G	78	Confident	81.9	Confident	32 Å²	32	56.5 Å²	56.5	33%	0.33	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-62	161.4	161.1	0	0	0	0	0	111.3	S154 V155	G131-S154 PolarHBondContact O-OG 3.2Å; G131-V155 WeakPolarHBondContact CA-O 3.13Å; G131-V155 PolarHBondContact N-O 3.2Å
132	Q	77.5	Confident	80.6	Confident	155 Å²	155	52.4 Å²	52.4	72%	0.724	27%	0.27	S	S	*	.	P	Polyproline II helix	trans	-57.4	151.8	174.4	-71.9	-174	-15.3	0	0	110.9	E134	Q132-E134 PolarHBondContact O-N 3.37Å
133	P	80.7	Confident	79.4	Confident	14 Å²	14	55.3 Å²	55.3	9%	0.091	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-60	131.1	167.4	21.5	-28.1	0	0	0	109.8	I210 V231 C233	P133-I210 HydrophobicContact CB-CD1 3.37Å; P133-I210 HydrophobicContact CB-CG1 4.42Å; P133-I210 HydrophobicContact CG-CD1 4.01Å; P133-V231 HydrophobicContact CG-CB 3.84Å; P133-V231 HydrophobicContact CG-CG1 3.57Å; P133-C233 HydrophobicContact CB-CB 3.67Å; P133-C233 HydrophobicContact CG-CB 3.86Å
134	E	81.1	Confident	78.3	Confident	115 Å²	115	57.9 Å²	57.9	54%	0.537	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	132.8	159.8	-74	176.8	-179	0	0	107.7	Q132 C152 H153	Q132-E134 PolarHBondContact O-N 3.37Å; E134-C152 CarbonylContact O-C 3.47Å; E134-C152 WeakPolarHBondContact O-CA 3.39Å; E134-H153 VanDerWaalsContact CB-NE2 3.31Å; E134-H153 WeakPolarHBondContact CB-NE2 3.5Å; E134-H153 PolarHBondContact N-O 3.44Å; E134-H153 PolarHBondContact O-N 3.09Å; E134-H153 IonicContact OE2-CD2 2.63Å; E134-H153 IonicContact OE2-CE1 3.26Å; E134-H153 IonicContact OE2-NE2 3.61Å; E134-H153 PolarHBondContact OE2-NE2 3.1Å
135	L	80.8	Confident	77.4	Confident	24 Å²	24	60.5 Å²	60.5	13%	0.126	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	148.6	166.7	-73.9	165.7	0	0	0	108.8	E137 K151 C152 W165 C208 C233 L235	L135-E137 WeakPolarHBondContact CB-O 3.21Å; L135-E137 PolarHBondContact O-N 2.94Å; L135-K151 CarbonylContact C-O 3.59Å; L135-K151 VanDerWaalsContact CA-O 3.3Å; L135-K151 WeakPolarHBondContact CA-O 3.23Å; L135-C152 HydrophobicContact CD2-CB 3.79Å; L135-W165 HydrophobicContact CD2-CH2 3.54Å; L135-W165 HydrophobicContact CD2-CZ3 3.85Å; L135-C208 HydrophobicContact CD2-CB 4.43Å; L135-C233 HydrophobicContact CD1-CB 3.74Å; L135-C233 HydrophobicContact CG-CB 3.89Å; L135-L235 HydrophobicContact CD1-CB 4.1Å
136	N	83.4	Confident	76.7	Confident	71 Å²	71	61.3 Å²	61.3	38%	0.38	33%	0.332	S	S	.	.	S	Bend	trans	-62.3	-25.2	167.3	64.6	-37.6	0	0	0	113	E149 K151	N136-E149 PolarHBondContact ND2-O 3.31Å; N136-E149 VanDerWaalsContact ND2-O 3.11Å; N136-K151 HydrophobicContact CB-CB 4.14Å; N136-K151 PolarHBondContact N-O 3.45Å; N136-K151 PolarHBondContact OD1-N 3.07Å; N136-K151 PolarHBondContact OD1-O 3.12Å
137	E	75.5	Confident	76.3	Confident	84 Å²	84	65.7 Å²	65.7	39%	0.393	36%	0.359	S	S	.	.			trans	-132.5	139.7	-176.3	-70.3	-67.2	169.5	0	0	110.5	L135 L140 L150 L235	L135-E137 WeakPolarHBondContact CB-O 3.21Å; L135-E137 PolarHBondContact O-N 2.94Å; E137-L140 HydrophobicContact CG-CD1 4.15Å; E137-L150 HydrophobicContact CB-CD2 3.95Å; E137-L150 HydrophobicContact CG-CD2 4.3Å; E137-L235 HydrophobicContact CB-CD1 3.77Å; E137-L235 WeakPolarHBondContact O-CD1 3.5Å
138	Q	69.4	Low	75.8	Confident	168 Å²	168	67.3 Å²	67.3	79%	0.785	37%	0.365	S	S	*	.	S	Bend	trans	-103	-25.3	176.4	-64.6	-170.7	3.1	0	0	113.1
139	S	71	Confident	75.9	Confident	65 Å²	65	69.5 Å²	69.5	46%	0.455	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	117.2	172.6	57.3	0	0	0	0	108.8
140	L	68.2	Low	76	Confident	15 Å²	15	63.2 Å²	63.2	8%	0.079	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	136.5	-175.5	-169.5	66.7	0	0	0	111.4	E137 L142 E148 L150 L235 F236 M238	E137-L140 HydrophobicContact CG-CD1 4.15Å; L140-L142 HydrophobicContact CD2-CD2 3.43Å; L140-L142 VanDerWaalsContact CD2-CD2 3.43Å; L140-L142 HydrophobicContact CD2-CG 4.1Å; L140-L142 HydrophobicContact CG-CD2 3.79Å; L140-L142 HydrophobicContact CG-CG 4.21Å; L140-E148 HydrophobicContact CD2-CB 4.11Å; L140-E148 HydrophobicContact CD2-CG 4.23Å; L140-L150 HydrophobicContact CD2-CD1 3.92Å; L140-L150 HydrophobicContact CD2-CD2 4.01Å; L140-L150 HydrophobicContact CD2-CG 4.04Å; L140-L235 HydrophobicContact CB-CD1 4.01Å; L140-L235 HydrophobicContact CB-CD2 3.81Å; L140-L235 HydrophobicContact CB-CG 4.12Å; L140-L235 HydrophobicContact CD2-CD2 4.24Å; L140-F236 PolarHBondContact N-O 3.36Å; L140-M238 PolarHBondContact O-N 3.48Å
141	V	68.8	Low	76.3	Confident	51 Å²	51	65.5 Å²	65.5	31%	0.309	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	98.3	-176.8	175.6	0	0	0	0	107.2	M238 Y272	V141-M238 CarbonylContact C-O 3.53Å; V141-M238 WeakPolarHBondContact CA-O 3.42Å; V141-M238 HydrophobicContact CG2-CE 4.24Å; V141-Y272 HydrophobicContact CG1-CD1 4.32Å; V141-Y272 HydrophobicContact CG1-CE1 3.52Å; V141-Y272 VanDerWaalsContact CG2-OH 3.23Å; V141-Y272 WeakPolarHBondContact CG2-OH 3.4Å
142	L	64.4	Low	76.8	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	127.6	-173.7	-68.6	-176.9	0	0	0	111.4	L140 E148 F195 A197 I237 M238 F239 S240	L140-L142 HydrophobicContact CD2-CD2 3.43Å; L140-L142 VanDerWaalsContact CD2-CD2 3.43Å; L140-L142 HydrophobicContact CD2-CG 4.1Å; L140-L142 HydrophobicContact CG-CD2 3.79Å; L140-L142 HydrophobicContact CG-CG 4.21Å; L142-E148 HydrophobicContact CD2-CB 4.16Å; L142-E148 HydrophobicContact CD2-CG 3.47Å; L142-E148 VanDerWaalsContact CD2-CG 3.47Å; L142-F195 HydrophobicContact CD1-CD1 3.79Å; L142-F195 HydrophobicContact CD1-CE1 3.63Å; L142-A197 HydrophobicContact CB-CB 3.63Å; L142-A197 HydrophobicContact CD1-CB 3.53Å; L142-A197 HydrophobicContact CD2-CB 4.27Å; L142-A197 HydrophobicContact CG-CB 4.01Å; L142-I237 HydrophobicContact CB-CG2 4.49Å; L142-I237 HydrophobicContact CD1-CG1 4.41Å; L142-I237 HydrophobicContact CD1-CG2 3.44Å; L142-I237 VanDerWaalsContact CD1-CG2 3.44Å; L142-I237 HydrophobicContact CG-CG2 4.1Å; L142-M238 PolarHBondContact N-O 3.4Å; L142-F239 HydrophobicContact CB-CZ 4.48Å; L142-F239 HydrophobicContact CD1-CE2 4.43Å; L142-F239 HydrophobicContact CD1-CZ 4.38Å; L142-F239 WeakPolarHBondContact O-CA 3.24Å; L142-S240 PolarHBondContact O-N 3.29Å
143	T	64.8	Low	77.3	Confident	62 Å²	62	58.8 Å²	58.8	38%	0.38	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-84.6	131.7	160.7	-58.4	0	0	0	0	108	G145 V146	T143-G145 PolarHBondContact O-N 3.22Å; T143-V146 HydrophobicContact CG2-CG2 3.85Å; T143-V146 WeakPolarHBondContact O-CB 3.25Å; T143-V146 PolarHBondContact O-N 3.26Å; T143-V146 VanDerWaalsContact O-N 3.16Å
144	E	69.6	Low	77.5	Confident	107 Å²	107	58.1 Å²	58.1	50%	0.5	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	134	-177.8	-175.6	165	-150.1	0	0	111.7	V146 A199 F239	E144-V146 VanDerWaalsContact C-N 3.27Å; E144-V146 PolarHBondContact O-N 2.67Å; E144-A199 VanDerWaalsContact OE1-CB 3.3Å; E144-A199 WeakPolarHBondContact OE1-CB 3.35Å; E144-A199 PolarHBondContact OE1-N 3.19Å; E144-F239 HydrophobicContact CB-CD1 4.24Å; E144-F239 HydrophobicContact CB-CE1 4.21Å; E144-F239 HydrophobicContact CG-CE1 4.45Å
145	G	73	Confident	77.6	Confident	55 Å²	55	56 Å²	56	57%	0.567	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	-3.3	-177.3	0	0	0	0	0	116.1	T143 A197	T143-G145 PolarHBondContact O-N 3.22Å; G145-A197 PolarHBondContact N-O 3.3Å
146	V	74.3	Confident	77.5	Confident	58 Å²	58	55.2 Å²	55.2	35%	0.352	31%	0.306	S	S	.	.			trans	-81.7	146.6	172.5	-178.8	0	0	0	0	110.4	T143 E144	T143-V146 HydrophobicContact CG2-CG2 3.85Å; T143-V146 WeakPolarHBondContact O-CB 3.25Å; T143-V146 PolarHBondContact O-N 3.26Å; T143-V146 VanDerWaalsContact O-N 3.16Å; E144-V146 VanDerWaalsContact C-N 3.27Å; E144-V146 PolarHBondContact O-N 2.67Å
147	V	81.4	Confident	77.3	Confident	92 Å²	92	52.1 Å²	52.1	56%	0.558	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.5	124.2	178	-171.1	0	0	0	0	109.2	F195 V196	V147-F195 WeakPolarHBondContact CA-O 3.49Å; V147-V196 HydrophobicContact CB-CG2 4.46Å; V147-V196 HydrophobicContact CG1-CG2 4.25Å; V147-V196 HydrophobicContact CG2-CG2 4.01Å
148	E	78.6	Confident	77.7	Confident	66 Å²	66	50.1 Å²	50.1	31%	0.308	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	148.2	177.4	-66.4	-59.3	161.4	0	0	112.7	L140 L142 F195	L140-E148 HydrophobicContact CD2-CB 4.11Å; L140-E148 HydrophobicContact CD2-CG 4.23Å; L142-E148 HydrophobicContact CD2-CB 4.16Å; L142-E148 HydrophobicContact CD2-CG 3.47Å; L142-E148 VanDerWaalsContact CD2-CG 3.47Å; E148-F195 PolarHBondContact N-O 3.41Å; E148-F195 PolarHBondContact O-N 3.07Å
149	E	86.7	Confident	78.3	Confident	70 Å²	70	44.5 Å²	44.5	33%	0.327	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	105.5	175	-68.5	-153.5	153.8	0	0	111.8	N136 K151 T192 R194	N136-E149 PolarHBondContact ND2-O 3.31Å; N136-E149 VanDerWaalsContact ND2-O 3.11Å; E149-K151 WeakPolarHBondContact OE2-CE 3.42Å; E149-K151 IonicContact OE2-NZ 2.94Å; E149-K151 PolarHBondContact OE2-NZ 2.8Å; E149-T192 HydrophobicContact CB-CG2 4.17Å; E149-T192 HydrophobicContact CG-CG2 4.42Å; E149-R194 HydrophobicContact CG-CG 4.27Å; E149-R194 IonicContact OE1-CZ 3.2Å; E149-R194 IonicContact OE1-NE 2.83Å; E149-R194 PolarHBondContact OE1-NE 2.77Å; E149-R194 IonicContact OE1-NH2 2.71Å; E149-R194 PolarHBondContact OE1-NH2 3.07Å
150	L	86.4	Confident	78.7	Confident	1 Å²	1	44 Å²	44	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	128.6	176.8	-79.1	165.9	0	0	0	110.9	E137 L140 W165 T192 L193 L206 L235	E137-L150 HydrophobicContact CB-CD2 3.95Å; E137-L150 HydrophobicContact CG-CD2 4.3Å; L140-L150 HydrophobicContact CD2-CD1 3.92Å; L140-L150 HydrophobicContact CD2-CD2 4.01Å; L140-L150 HydrophobicContact CD2-CG 4.04Å; L150-W165 HydrophobicContact CB-CH2 3.94Å; L150-W165 HydrophobicContact CB-CZ3 4.42Å; L150-T192 CarbonylContact O-C 3.59Å; L150-T192 VanDerWaalsContact O-CA 3.31Å; L150-T192 WeakPolarHBondContact O-CA 3.39Å; L150-L193 HydrophobicContact CB-CB 4.26Å; L150-L193 HydrophobicContact CD1-CD2 4.44Å; L150-L193 PolarHBondContact N-O 3.26Å; L150-L193 PolarHBondContact O-N 3.44Å; L150-L206 HydrophobicContact CD1-CD1 3.61Å; L150-L235 HydrophobicContact CD1-CD2 3.35Å; L150-L235 HydrophobicContact CD2-CD1 4.3Å; L150-L235 HydrophobicContact CD2-CD2 3.52Å; L150-L235 HydrophobicContact CG-CD2 4.06Å
151	K	88.8	Confident	79.4	Confident	71 Å²	71	43.4 Å²	43.4	31%	0.309	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	119	-173.7	-68.9	171.9	-178.8	156	0	108.7	L135 N136 E149 V190 S191 T192	L135-K151 CarbonylContact C-O 3.59Å; L135-K151 VanDerWaalsContact CA-O 3.3Å; L135-K151 WeakPolarHBondContact CA-O 3.23Å; N136-K151 HydrophobicContact CB-CB 4.14Å; N136-K151 PolarHBondContact N-O 3.45Å; N136-K151 PolarHBondContact OD1-N 3.07Å; N136-K151 PolarHBondContact OD1-O 3.12Å; E149-K151 WeakPolarHBondContact OE2-CE 3.42Å; E149-K151 IonicContact OE2-NZ 2.94Å; E149-K151 PolarHBondContact OE2-NZ 2.8Å; K151-V190 HydrophobicContact CB-CG1 4.47Å; K151-S191 WeakPolarHBondContact CA-O 3.44Å; K151-T192 HydrophobicContact CD-CG2 4.36Å; K151-T192 VanDerWaalsContact CE-CG2 3.43Å; K151-T192 HydrophobicContact CG-CG2 3.86Å
152	C	87.6	Confident	80.2	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	120.3	169.5	-174.3	0	0	0	0	107.7	E134 L135 I163 W165 S191 C208	E134-C152 CarbonylContact O-C 3.47Å; E134-C152 WeakPolarHBondContact O-CA 3.39Å; L135-C152 HydrophobicContact CD2-CB 3.79Å; C152-I163 HydrophobicContact CB-CG2 4.36Å; C152-W165 HydrophobicContact CB-CH2 3.68Å; C152-W165 HydrophobicContact CB-CZ2 3.41Å; C152-W165 VanDerWaalsContact CB-CZ2 3.41Å; C152-S191 PolarHBondContact N-O 2.91Å; C152-S191 PolarHBondContact O-N 2.88Å; C152-C208 HydrophobicContact CB-CB 3.73Å; C152-C208 WeakPolarHBondContact CB-SG 3.47Å; C152-C208 WeakPolarHBondContact SG-CB 3.39Å; C152-C208 CovalentContact SG-SG 2.03Å; C152-C208 PolarHBondContact SG-SG 2.86Å
153	H	88.5	Confident	81.3	Confident	45 Å²	45	45.6 Å²	45.6	21%	0.208	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	156.4	178.4	65.1	-100.4	0	0	0	112.6	E134 P188 T189 V190	E134-H153 VanDerWaalsContact CB-NE2 3.31Å; E134-H153 WeakPolarHBondContact CB-NE2 3.5Å; E134-H153 PolarHBondContact N-O 3.44Å; E134-H153 PolarHBondContact O-N 3.09Å; E134-H153 IonicContact OE2-CD2 2.63Å; E134-H153 IonicContact OE2-CE1 3.26Å; E134-H153 IonicContact OE2-NE2 3.61Å; E134-H153 PolarHBondContact OE2-NE2 3.1Å; H153-P188 HydrophobicContact CB-CB 4.14Å; H153-T189 CarbonylContact C-O 3.58Å; H153-T189 VanDerWaalsContact CA-O 3.24Å; H153-T189 WeakPolarHBondContact CA-O 3.47Å; H153-V190 HydrophobicContact CB-CB 4.32Å; H153-V190 HydrophobicContact CB-CG1 4.29Å; H153-V190 HydrophobicContact CB-CG2 3.88Å
154	S	85.5	Confident	82.3	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	119	178.7	-174.1	0	0	0	0	108.9	P130 G131 P188 T189	P130-S154 WeakPolarHBondContact CB-OG 3.3Å; G131-S154 PolarHBondContact O-OG 3.2Å; S154-P188 VanDerWaalsContact O-CA 3.25Å; S154-P188 WeakPolarHBondContact O-CA 3.43Å; S154-T189 PolarHBondContact N-O 2.84Å; S154-T189 PolarHBondContact O-N 2.77Å
155	V	83.8	Confident	83.2	Confident	70 Å²	70	38.9 Å²	38.9	42%	0.424	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	135.1	177.7	-179.9	0	0	0	0	109.6	G131 P188	G131-V155 WeakPolarHBondContact CA-O 3.13Å; G131-V155 PolarHBondContact N-O 3.2Å; V155-P188 HydrophobicContact CG2-CB 3.98Å
156	G	78.3	Confident	83.8	Confident	9 Å²	9	37 Å²	37	9%	0.093	20%	0.203	C	C	.	.			trans	70.9	-169.1	173.9	0	0	0	0	0	115.3	P161 K185	G156-P161 VanDerWaalsContact O-CD 3.26Å; G156-P161 WeakPolarHBondContact O-CD 3.46Å; G156-K185 WeakPolarHBondContact CA-O 3.39Å; G156-K185 PolarHBondContact N-O 2.79Å
157	G	79	Confident	84.2	Confident	6 Å²	6	34.9 Å²	34.9	6%	0.062	19%	0.189	C	C	.	.			trans	100	150	-159.9	0	0	0	0	0	111.6	V128 R129 P159	V128-G157 CarbonylContact O-C 3.53Å; V128-G157 VanDerWaalsContact O-CA 3.28Å; V128-G157 WeakPolarHBondContact O-CA 3.39Å; R129-G157 WeakPolarHBondContact O-CA 3.34Å; G157-P159 CarbonylContact C-O 3.46Å
158	N	83.4	Confident	84.1	Confident	41 Å²	41	33.8 Å²	33.8	22%	0.219	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-142.2	109.5	173.1	-178.9	26.7	0	0	0	107.7	Y98 V126 V128	Y98-N158 HydrophobicContact CE2-CB 4.36Å; V126-N158 PolarHBondContact O-ND2 3.41Å; V128-N158 HydrophobicContact CB-CB 4.01Å; V128-N158 HydrophobicContact CG2-CB 4.03Å; V128-N158 PolarHBondContact N-O 2.93Å; V128-N158 VanDerWaalsContact N-O 3.11Å; V128-N158 PolarHBondContact O-N 2.88Å
159	P	81.5	Confident	84	Confident	50 Å²	50	35.3 Å²	35.3	33%	0.325	20%	0.196	S	C	.	.	S	Bend	cis	-69.2	170.5	-1.2	31.6	-37.3	0	0	0	113.4	G157 N212 V213	G157-P159 CarbonylContact C-O 3.46Å; P159-N212 PolarHBondContact O-ND2 2.82Å; P159-V213 HydrophobicContact CG-CG2 3.75Å
160	P	80.5	Confident	83.5	Confident	54 Å²	54	34.3 Å²	34.3	35%	0.351	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-56.5	149	178.8	-27.4	36.1	0	0	0	114.4
161	P	83.3	Confident	83.3	Confident	3 Å²	3	37.9 Å²	37.9	2%	0.019	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-67.5	153.2	-176	15.8	-23	0	0	0	114.6	P130 G156 T189 I210	P130-P161 HydrophobicContact CB-CB 3.87Å; P130-P161 HydrophobicContact CB-CG 4.11Å; P130-P161 HydrophobicContact CG-CB 3.87Å; G156-P161 VanDerWaalsContact O-CD 3.26Å; G156-P161 WeakPolarHBondContact O-CD 3.46Å; P161-T189 PolarHBondContact O-OG1 2.83Å; P161-I210 HydrophobicContact CB-CG2 3.52Å
162	Q	85	Confident	83.2	Confident	87 Å²	87	38.4 Å²	38.4	41%	0.407	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	140.4	167	-63.5	-62.1	-85.8	0	0	109.8	I210 W211	Q162-I210 VanDerWaalsContact O-CA 3.29Å; Q162-I210 WeakPolarHBondContact O-CA 3.34Å; Q162-W211 HydrophobicContact CB-CD2 4.34Å; Q162-W211 HydrophobicContact CB-CG 4.49Å; Q162-W211 HydrophobicContact CB-CZ2 4.14Å; Q162-W211 HydrophobicContact CG-CZ2 4.11Å; Q162-W211 PolarHBondContact N-O 3.43Å; Q162-W211 PolarHBondContact O-N 2.82Å
163	I	87.3	Confident	83.1	Confident	10 Å²	10	38.9 Å²	38.9	5%	0.051	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	135.3	-172.9	-47.1	-168	0	0	0	110.4	C152 T189 C208 K209 I210	C152-I163 HydrophobicContact CB-CG2 4.36Å; I163-T189 HydrophobicContact CD1-CG2 3.74Å; I163-T189 HydrophobicContact CG1-CG2 3.95Å; I163-C208 WeakPolarHBondContact CG2-SG 3.48Å; I163-K209 WeakPolarHBondContact CA-O 3.35Å; I163-I210 HydrophobicContact CD1-CG1 4.46Å; I163-I210 HydrophobicContact CG1-CG1 4.17Å; I163-I210 HydrophobicContact CG2-CG1 4.41Å
164	T	86.7	Confident	82.9	Confident	28 Å²	28	38.3 Å²	38.3	17%	0.172	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	151.3	178.9	49.8	0	0	0	0	111.6	T174 K209	T164-T174 HydrophobicContact CG2-CG2 4.17Å; T164-K209 PolarHBondContact N-O 2.84Å; T164-K209 PolarHBondContact O-N 3.04Å
165	W	87.4	Confident	82.9	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	139.4	-172.6	-69.2	92.4	0	0	0	112.5	L135 L150 C152 L173 T174 S191 L193 V207 C208	L135-W165 HydrophobicContact CD2-CH2 3.54Å; L135-W165 HydrophobicContact CD2-CZ3 3.85Å; L150-W165 HydrophobicContact CB-CH2 3.94Å; L150-W165 HydrophobicContact CB-CZ3 4.42Å; C152-W165 HydrophobicContact CB-CH2 3.68Å; C152-W165 HydrophobicContact CB-CZ2 3.41Å; C152-W165 VanDerWaalsContact CB-CZ2 3.41Å; W165-L173 HydrophobicContact CB-CB 4.08Å; W165-L173 PolarHBondContact O-N 2.63Å; W165-T174 PolarHBondContact N-OG1 3.19Å; W165-T174 VanDerWaalsContact N-OG1 3.07Å; W165-T174 PolarHBondContact O-N 2.77Å; W165-S191 PolarHBondContact NE1-OG 2.97Å; W165-L193 HydrophobicContact CD2-CB 3.9Å; W165-L193 HydrophobicContact CD2-CD2 3.96Å; W165-L193 HydrophobicContact CD2-CG 4.41Å; W165-L193 HydrophobicContact CE3-CB 4.29Å; W165-L193 HydrophobicContact CE3-CD2 3.7Å; W165-L193 HydrophobicContact CG-CB 4.35Å; W165-L193 HydrophobicContact CG-CD1 4.45Å; W165-L193 HydrophobicContact CG-CD2 4.42Å; W165-L193 HydrophobicContact CH2-CB 4.17Å; W165-L193 HydrophobicContact CZ2-CB 3.78Å; W165-L193 HydrophobicContact CZ3-CB 4.42Å; W165-L193 HydrophobicContact CZ3-CD2 4.04Å; W165-V207 CarbonylContact C-O 3.58Å; W165-V207 WeakPolarHBondContact CA-O 3.29Å; W165-C208 HydrophobicContact CE3-CB 4.23Å; W165-C208 HydrophobicContact CZ3-CB 4.26Å
166	F	85.9	Confident	83	Confident	15 Å²	15	45.4 Å²	45.4	7%	0.066	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	154.8	179	-60.2	-96.9	0	0	0	111.8	T171 E172 V207 K209	F166-T171 CarbonylContact C-O 3.56Å; F166-T171 VanDerWaalsContact CA-O 3.25Å; F166-T171 WeakPolarHBondContact CA-O 3.27Å; F166-E172 HydrophobicContact CD1-CB 3.92Å; F166-E172 HydrophobicContact CD1-CG 4.24Å; F166-E172 HydrophobicContact CE1-CB 3.74Å; F166-E172 HydrophobicContact CE1-CG 3.85Å; F166-E172 HydrophobicContact CZ-CG 4.15Å; F166-V207 HydrophobicContact CB-CB 4.31Å; F166-V207 PolarHBondContact N-O 2.66Å; F166-V207 WeakPolarHBondContact O-CB 3.18Å; F166-V207 PolarHBondContact O-N 3.28Å; F166-K209 HydrophobicContact CD2-CD 3.9Å; F166-K209 HydrophobicContact CD2-CG 4.21Å; F166-K209 HydrophobicContact CE2-CD 3.59Å; F166-K209 HydrophobicContact CE2-CG 4.24Å; F166-K209 HydrophobicContact CZ-CD 4.43Å
167	H	82.4	Confident	83.4	Confident	14 Å²	14	46.2 Å²	46.2	7%	0.065	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	157.6	153	-73.7	-90.4	0	0	0	110.2	N169 G170 T171 L173 F195 D201 Q204 K205	H167-N169 WeakPolarHBondContact CB-OD1 3.44Å; H167-N169 PolarHBondContact O-N 3.36Å; H167-N169 VanDerWaalsContact O-N 3.12Å; H167-G170 PolarHBondContact O-N 3.24Å; H167-T171 PolarHBondContact N-O 3.11Å; H167-L173 VanDerWaalsContact CD2-CD1 3.47Å; H167-L173 WeakPolarHBondContact CD2-CD1 3.33Å; H167-F195 AromaticContact CE1-CE2 3.83Å; H167-F195 AromaticContact CE1-CZ 3.91Å; H167-F195 AromaticContact NE2-CE2 3.99Å; H167-D201 IonicContact CE1-OD1 2.67Å; H167-D201 PolarHBondContact CE1-OD1 3.16Å; H167-D201 VanDerWaalsContact CE1-OD1 3.26Å; H167-D201 IonicContact NE2-OD1 3.39Å; H167-Q204 PolarHBondContact ND1-OE1 2.99Å; H167-K205 CarbonylContact C-O 3.56Å
168	S	78.7	Confident	84	Confident	70 Å²	70	49 Å²	49	49%	0.49	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-10.5	177.1	54.5	0	0	0	0	115.3	G170 K205	S168-G170 VanDerWaalsContact C-N 3.3Å; S168-K205 WeakPolarHBondContact CB-O 3.36Å; S168-K205 PolarHBondContact N-O 3.32Å; S168-K205 PolarHBondContact OG-N 2.96Å; S168-K205 VanDerWaalsContact OG-N 3.08Å; S168-K205 PolarHBondContact OG-O 2.74Å
169	N	76.5	Confident	84.2	Confident	98 Å²	98	49.9 Å²	49.9	52%	0.524	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-2.5	169.7	60.3	18	0	0	0	113.2	H167 T171 Q204	H167-N169 WeakPolarHBondContact CB-OD1 3.44Å; H167-N169 PolarHBondContact O-N 3.36Å; H167-N169 VanDerWaalsContact O-N 3.12Å; N169-T171 VanDerWaalsContact OD1-CB 3.31Å; N169-T171 WeakPolarHBondContact OD1-CB 3.3Å; N169-T171 PolarHBondContact OD1-N 2.83Å; N169-T171 PolarHBondContact OD1-OG1 3.23Å; N169-Q204 PolarHBondContact ND2-OE1 2.69Å
170	G	76.7	Confident	84.5	Confident	48 Å²	48	52.5 Å²	52.5	50%	0.495	31%	0.31	S	S	.	.	S	Bend	trans	97	-6.7	-179.7	0	0	0	0	0	115.3	H167 S168 E172	H167-G170 PolarHBondContact O-N 3.24Å; S168-G170 VanDerWaalsContact C-N 3.3Å; G170-E172 PolarHBondContact O-N 2.85Å
171	T	82.6	Confident	84.7	Confident	76 Å²	76	54.2 Å²	54.2	47%	0.466	32%	0.317	S	S	.	.			trans	-65.6	125.4	178.4	-58	0	0	0	0	111.1	F166 H167 N169	F166-T171 CarbonylContact C-O 3.56Å; F166-T171 VanDerWaalsContact CA-O 3.25Å; F166-T171 WeakPolarHBondContact CA-O 3.27Å; H167-T171 PolarHBondContact N-O 3.11Å; N169-T171 VanDerWaalsContact OD1-CB 3.31Å; N169-T171 WeakPolarHBondContact OD1-CB 3.3Å; N169-T171 PolarHBondContact OD1-N 2.83Å; N169-T171 PolarHBondContact OD1-OG1 3.23Å
172	E	87.2	Confident	84.3	Confident	82 Å²	82	54.3 Å²	54.3	38%	0.383	32%	0.319	S	S	.	.	B	Isolated β-bridge	trans	-82.7	129.1	-178.4	-173.3	170.5	-178.9	0	0	112.8	F166 G170 T174 H175	F166-E172 HydrophobicContact CD1-CB 3.92Å; F166-E172 HydrophobicContact CD1-CG 4.24Å; F166-E172 HydrophobicContact CE1-CB 3.74Å; F166-E172 HydrophobicContact CE1-CG 3.85Å; F166-E172 HydrophobicContact CZ-CG 4.15Å; G170-E172 PolarHBondContact O-N 2.85Å; E172-T174 WeakPolarHBondContact CG-OG1 3.49Å; E172-T174 WeakPolarHBondContact OE1-CB 3.45Å; E172-T174 PolarHBondContact OE1-OG1 2.84Å; E172-H175 PolarHBondContact O-CE1 2.91Å; E172-H175 PolarHBondContact O-ND1 2.79Å
173	L	84.9	Confident	83.9	Confident	10 Å²	10	55.7 Å²	55.7	5%	0.052	33%	0.333	C	S	.	.			trans	-113.6	2.1	-179	-63.2	179.1	0	0	0	113.8	W165 H167 H175 L176 L193 F195 L206	W165-L173 HydrophobicContact CB-CB 4.08Å; W165-L173 PolarHBondContact O-N 2.63Å; H167-L173 VanDerWaalsContact CD2-CD1 3.47Å; H167-L173 WeakPolarHBondContact CD2-CD1 3.33Å; L173-H175 PolarHBondContact O-N 3.2Å; L173-L176 HydrophobicContact CD2-CD1 4.14Å; L173-L176 PolarHBondContact O-N 3.22Å; L173-L193 HydrophobicContact CB-CD1 4.09Å; L173-L193 HydrophobicContact CD1-CD2 4.41Å; L173-F195 HydrophobicContact CD1-CD2 4.36Å; L173-F195 HydrophobicContact CD1-CE2 4.17Å; L173-L206 HydrophobicContact CD1-CD2 3.32Å
174	T	83.7	Confident	83.2	Confident	33 Å²	33	58.6 Å²	58.6	20%	0.202	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-51.3	-30.8	179.6	-47	0	0	0	0	112.4	T164 W165 E172 L176 S177	T164-T174 HydrophobicContact CG2-CG2 4.17Å; W165-T174 PolarHBondContact N-OG1 3.19Å; W165-T174 VanDerWaalsContact N-OG1 3.07Å; W165-T174 PolarHBondContact O-N 2.77Å; E172-T174 WeakPolarHBondContact CG-OG1 3.49Å; E172-T174 WeakPolarHBondContact OE1-CB 3.45Å; E172-T174 PolarHBondContact OE1-OG1 2.84Å; T174-L176 PolarHBondContact O-N 2.89Å; T174-S177 PolarHBondContact O-N 3.37Å; T174-S177 PolarHBondContact O-OG 2.91Å
175	H	86.6	Confident	82.5	Confident	145 Å²	145	60.2 Å²	60.2	67%	0.671	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-64.9	-16.7	176.4	73.3	-88.6	0	0	0	115.3	E172 L173	E172-H175 PolarHBondContact O-CE1 2.91Å; E172-H175 PolarHBondContact O-ND1 2.79Å; L173-H175 PolarHBondContact O-N 3.2Å
176	L	85	Confident	81.8	Confident	74 Å²	74	66.2 Å²	66.2	39%	0.387	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-96.5	7.9	173.1	-58.1	-179.5	0	0	0	112.6	L173 T174 L193 R194	L173-L176 HydrophobicContact CD2-CD1 4.14Å; L173-L176 PolarHBondContact O-N 3.22Å; T174-L176 PolarHBondContact O-N 2.89Å; L176-L193 HydrophobicContact CB-CD1 3.65Å; L176-R194 PolarHBondContact O-N 2.88Å
177	S	87.9	Confident	81.5	Confident	26 Å²	26	69.8 Å²	69.8	18%	0.182	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	146.7	-175	75.3	0	0	0	0	113.6	T174 S191 T192	T174-S177 PolarHBondContact O-N 3.37Å; T174-S177 PolarHBondContact O-OG 2.91Å; S177-S191 PolarHBondContact OG-OG 3.47Å; S177-T192 CarbonylContact C-O 3.53Å; S177-T192 WeakPolarHBondContact CA-O 3.09Å
178	A	89.9	Confident	81.7	Confident	65 Å²	65	71.4 Å²	71.4	54%	0.537	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	122.2	172.3	0	0	0	0	0	109.8	T192	A178-T192 PolarHBondContact N-O 3.41Å; A178-T192 PolarHBondContact O-N 3.31Å
179	T	88.1	Confident	82.1	Confident	60 Å²	60	68.1 Å²	68.1	37%	0.368	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	127	-176.1	-57.6	0	0	0	0	111.6	T189 V190 S191	T179-T189 HydrophobicContact CG2-CG2 3.61Å; T179-V190 CarbonylContact C-O 3.6Å; T179-V190 WeakPolarHBondContact CA-O 3.28Å; T179-S191 WeakPolarHBondContact OG1-CB 3.48Å; T179-S191 PolarHBondContact OG1-OG 2.95Å
180	V	88.5	Confident	82.7	Confident	104 Å²	104	65.2 Å²	65.2	63%	0.63	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.7	116.6	172.8	-178.9	0	0	0	0	107.6	T189 V190	V180-T189 CarbonylContact O-C 3.45Å; V180-T189 VanDerWaalsContact O-CA 3.3Å; V180-T189 WeakPolarHBondContact O-CA 3.41Å; V180-V190 PolarHBondContact N-O 3Å; V180-V190 PolarHBondContact O-N 3Å
181	N	83.9	Confident	83.4	Confident	90 Å²	90	63 Å²	63	48%	0.481	35%	0.349	S	S	.	.			trans	-78.9	139.1	-179.7	-63.3	-22.9	0	0	0	111.1
182	G	76	Confident	83.8	Confident	6 Å²	6	60.6 Å²	60.6	6%	0.062	34%	0.335	C	S	.	.			trans	-65.4	137.7	169.6	0	0	0	0	0	111.1	P188 T189	G182-P188 WeakPolarHBondContact CA-O 3.47Å; G182-P188 PolarHBondContact N-O 3.46Å; G182-T189 PolarHBondContact N-OG1 3.35Å
183	T	76	Confident	83.9	Confident	116 Å²	116	56.7 Å²	56.7	71%	0.712	32%	0.317	S	S	*	.	S	Bend	trans	-84.2	-14	-177	68.9	0	0	0	0	113.9	Q187	T183-Q187 VanDerWaalsContact N-OE1 3.13Å; T183-Q187 PolarHBondContact OG1-OE1 2.91Å
184	N	72.5	Confident	84.1	Confident	71 Å²	71	63.6 Å²	63.6	38%	0.38	34%	0.342	S	S	.	.	S	Bend	trans	-147.1	-173.2	178.8	64.5	4.1	0	0	0	110.2	E186 Q187	N184-E186 VanDerWaalsContact C-N 3.27Å; N184-E186 WeakPolarHBondContact CB-OE2 3.29Å; N184-E186 PolarHBondContact ND2-OE2 2.89Å; N184-E186 PolarHBondContact O-N 2.79Å; N184-E186 PolarHBondContact OD1-N 3.03Å; N184-E186 PolarHBondContact OD1-OE2 3.2Å; N184-Q187 WeakPolarHBondContact OD1-CB 3.11Å; N184-Q187 VanDerWaalsContact OD1-CG 3.27Å; N184-Q187 WeakPolarHBondContact OD1-CG 3.48Å; N184-Q187 PolarHBondContact OD1-N 3.39Å
185	K	71.2	Confident	84	Confident	62 Å²	62	62.4 Å²	62.4	27%	0.27	33%	0.334	S	S	.	.	S	Bend	trans	-73.3	-21.4	-178.3	-176	-176.4	175.1	-171.2	0	112.5	Y98 G156	Y98-K185 HydrophobicContact CD1-CD 3.81Å; Y98-K185 HydrophobicContact CE1-CD 3.6Å; Y98-K185 HydrophobicContact CE2-CD 4.4Å; Y98-K185 HydrophobicContact CG-CD 4.3Å; G156-K185 WeakPolarHBondContact CA-O 3.39Å; G156-K185 PolarHBondContact N-O 2.79Å
186	E	74	Confident	83.8	Confident	126 Å²	126	59.4 Å²	59.4	59%	0.589	33%	0.326	S	S	*	.	S	Bend	trans	-87.4	-27.4	-176.3	-60.4	66.6	-141.9	0	0	112.3	N184	N184-E186 VanDerWaalsContact C-N 3.27Å; N184-E186 WeakPolarHBondContact CB-OE2 3.29Å; N184-E186 PolarHBondContact ND2-OE2 2.89Å; N184-E186 PolarHBondContact O-N 2.79Å; N184-E186 PolarHBondContact OD1-N 3.03Å; N184-E186 PolarHBondContact OD1-OE2 3.2Å
187	Q	79.9	Confident	83.2	Confident	89 Å²	89	56 Å²	56	42%	0.416	31%	0.309	S	S	.	.	S	Bend	trans	-85.8	136.9	177.9	-73.4	-179.4	8.4	0	0	112	T183 N184	T183-Q187 VanDerWaalsContact N-OE1 3.13Å; T183-Q187 PolarHBondContact OG1-OE1 2.91Å; N184-Q187 WeakPolarHBondContact OD1-CB 3.11Å; N184-Q187 VanDerWaalsContact OD1-CG 3.27Å; N184-Q187 WeakPolarHBondContact OD1-CG 3.48Å; N184-Q187 PolarHBondContact OD1-N 3.39Å
188	P	84.8	Confident	82.5	Confident	49 Å²	49	56.9 Å²	56.9	32%	0.318	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	142.9	172.2	27.7	-32.4	0	0	0	112	H153 S154 V155 G182 V190	H153-P188 HydrophobicContact CB-CB 4.14Å; S154-P188 VanDerWaalsContact O-CA 3.25Å; S154-P188 WeakPolarHBondContact O-CA 3.43Å; V155-P188 HydrophobicContact CG2-CB 3.98Å; G182-P188 WeakPolarHBondContact CA-O 3.47Å; G182-P188 PolarHBondContact N-O 3.46Å; P188-V190 HydrophobicContact CB-CG2 3.98Å; P188-V190 HydrophobicContact CG-CG2 3.9Å
189	T	88.5	Confident	81.6	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	130.3	149.2	-64.5	0	0	0	0	107.5	H153 S154 P161 I163 T179 V180 G182	H153-T189 CarbonylContact C-O 3.58Å; H153-T189 VanDerWaalsContact CA-O 3.24Å; H153-T189 WeakPolarHBondContact CA-O 3.47Å; S154-T189 PolarHBondContact N-O 2.84Å; S154-T189 PolarHBondContact O-N 2.77Å; P161-T189 PolarHBondContact O-OG1 2.83Å; I163-T189 HydrophobicContact CD1-CG2 3.74Å; I163-T189 HydrophobicContact CG1-CG2 3.95Å; T179-T189 HydrophobicContact CG2-CG2 3.61Å; V180-T189 CarbonylContact O-C 3.45Å; V180-T189 VanDerWaalsContact O-CA 3.3Å; V180-T189 WeakPolarHBondContact O-CA 3.41Å; G182-T189 PolarHBondContact N-OG1 3.35Å
190	V	89.4	Confident	80.9	Confident	38 Å²	38	58 Å²	58	23%	0.23	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	122.9	-178.9	-173.1	0	0	0	0	109.1	K151 H153 T179 V180 P188	K151-V190 HydrophobicContact CB-CG1 4.47Å; H153-V190 HydrophobicContact CB-CB 4.32Å; H153-V190 HydrophobicContact CB-CG1 4.29Å; H153-V190 HydrophobicContact CB-CG2 3.88Å; T179-V190 CarbonylContact C-O 3.6Å; T179-V190 WeakPolarHBondContact CA-O 3.28Å; V180-V190 PolarHBondContact N-O 3Å; V180-V190 PolarHBondContact O-N 3Å; P188-V190 HydrophobicContact CB-CG2 3.98Å; P188-V190 HydrophobicContact CG-CG2 3.9Å
191	S	91.1	Very high	80.2	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	122.7	170	-170.5	0	0	0	0	110.1	K151 C152 W165 S177 T179	K151-S191 WeakPolarHBondContact CA-O 3.44Å; C152-S191 PolarHBondContact N-O 2.91Å; C152-S191 PolarHBondContact O-N 2.88Å; W165-S191 PolarHBondContact NE1-OG 2.97Å; S177-S191 PolarHBondContact OG-OG 3.47Å; T179-S191 WeakPolarHBondContact OG1-CB 3.48Å; T179-S191 PolarHBondContact OG1-OG 2.95Å
192	T	91.2	Very high	79.3	Confident	27 Å²	27	55 Å²	55	17%	0.166	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	105.3	178	-53.6	0	0	0	0	109.8	E149 L150 K151 S177 A178	E149-T192 HydrophobicContact CB-CG2 4.17Å; E149-T192 HydrophobicContact CG-CG2 4.42Å; L150-T192 CarbonylContact O-C 3.59Å; L150-T192 VanDerWaalsContact O-CA 3.31Å; L150-T192 WeakPolarHBondContact O-CA 3.39Å; K151-T192 HydrophobicContact CD-CG2 4.36Å; K151-T192 VanDerWaalsContact CE-CG2 3.43Å; K151-T192 HydrophobicContact CG-CG2 3.86Å; S177-T192 CarbonylContact C-O 3.53Å; S177-T192 WeakPolarHBondContact CA-O 3.09Å; A178-T192 PolarHBondContact N-O 3.41Å; A178-T192 PolarHBondContact O-N 3.31Å
193	L	88.6	Confident	79	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	128.9	169.9	177.1	70.4	0	0	0	110	L150 W165 L173 L176 F195 L206	L150-L193 HydrophobicContact CB-CB 4.26Å; L150-L193 HydrophobicContact CD1-CD2 4.44Å; L150-L193 PolarHBondContact N-O 3.26Å; L150-L193 PolarHBondContact O-N 3.44Å; W165-L193 HydrophobicContact CD2-CB 3.9Å; W165-L193 HydrophobicContact CD2-CD2 3.96Å; W165-L193 HydrophobicContact CD2-CG 4.41Å; W165-L193 HydrophobicContact CE3-CB 4.29Å; W165-L193 HydrophobicContact CE3-CD2 3.7Å; W165-L193 HydrophobicContact CG-CB 4.35Å; W165-L193 HydrophobicContact CG-CD1 4.45Å; W165-L193 HydrophobicContact CG-CD2 4.42Å; W165-L193 HydrophobicContact CH2-CB 4.17Å; W165-L193 HydrophobicContact CZ2-CB 3.78Å; W165-L193 HydrophobicContact CZ3-CB 4.42Å; W165-L193 HydrophobicContact CZ3-CD2 4.04Å; L173-L193 HydrophobicContact CB-CD1 4.09Å; L173-L193 HydrophobicContact CD1-CD2 4.41Å; L176-L193 HydrophobicContact CB-CD1 3.65Å; L193-F195 HydrophobicContact CD2-CB 4.49Å; L193-F195 HydrophobicContact CG-CB 4.47Å; L193-L206 HydrophobicContact CD2-CD1 4.35Å; L193-L206 HydrophobicContact CD2-CD2 3.62Å
194	R	88.9	Confident	78.9	Confident	155 Å²	155	57.8 Å²	57.8	59%	0.585	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.9	112.3	168.9	-76.3	-177.3	166.4	-175.7	-5	109.4	E149 L176	E149-R194 HydrophobicContact CG-CG 4.27Å; E149-R194 IonicContact OE1-CZ 3.2Å; E149-R194 IonicContact OE1-NE 2.83Å; E149-R194 PolarHBondContact OE1-NE 2.77Å; E149-R194 IonicContact OE1-NH2 2.71Å; E149-R194 PolarHBondContact OE1-NH2 3.07Å; L176-R194 PolarHBondContact O-N 2.88Å
195	F	82	Confident	79.2	Confident	8 Å²	8	58.2 Å²	58.2	4%	0.035	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	139.8	-172.8	-167.9	-102.2	0	0	0	110.6	L142 V147 E148 H167 L173 L193 D201 L206 I237	L142-F195 HydrophobicContact CD1-CD1 3.79Å; L142-F195 HydrophobicContact CD1-CE1 3.63Å; V147-F195 WeakPolarHBondContact CA-O 3.49Å; E148-F195 PolarHBondContact N-O 3.41Å; E148-F195 PolarHBondContact O-N 3.07Å; H167-F195 AromaticContact CE1-CE2 3.83Å; H167-F195 AromaticContact CE1-CZ 3.91Å; H167-F195 AromaticContact NE2-CE2 3.99Å; L173-F195 HydrophobicContact CD1-CD2 4.36Å; L173-F195 HydrophobicContact CD1-CE2 4.17Å; L193-F195 HydrophobicContact CD2-CB 4.49Å; L193-F195 HydrophobicContact CG-CB 4.47Å; F195-D201 HydrophobicContact CE1-CB 4.38Å; F195-D201 HydrophobicContact CZ-CB 4.03Å; F195-L206 HydrophobicContact CD1-CD1 4.39Å; F195-L206 HydrophobicContact CD2-CD1 4.3Å; F195-L206 HydrophobicContact CE2-CD1 4.42Å; F195-L206 HydrophobicContact CG-CD1 4.29Å; F195-I237 HydrophobicContact CE1-CD1 4.01Å; F195-I237 HydrophobicContact CZ-CD1 3.99Å
196	V	82.5	Confident	79.6	Confident	82 Å²	82	55.2 Å²	55.2	50%	0.497	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	123.8	175.2	-174.1	0	0	0	0	108.2	V147	V147-V196 HydrophobicContact CB-CG2 4.46Å; V147-V196 HydrophobicContact CG1-CG2 4.25Å; V147-V196 HydrophobicContact CG2-CG2 4.01Å
197	A	71.6	Confident	80.1	Confident	3 Å²	3	49.8 Å²	49.8	3%	0.025	26%	0.264	C	S	.	.			trans	-81.8	118	-168.3	0	0	0	0	0	112.4	L142 G145 F239	L142-A197 HydrophobicContact CB-CB 3.63Å; L142-A197 HydrophobicContact CD1-CB 3.53Å; L142-A197 HydrophobicContact CD2-CB 4.27Å; L142-A197 HydrophobicContact CG-CB 4.01Å; G145-A197 PolarHBondContact N-O 3.3Å; A197-F239 HydrophobicContact CB-CE1 3.54Å; A197-F239 HydrophobicContact CB-CZ 3.48Å; A197-F239 VanDerWaalsContact CB-CZ 3.48Å
198	S	74.9	Confident	80.3	Confident	44 Å²	44	45.5 Å²	45.5	31%	0.308	24%	0.244	S	C	.	.			trans	-108.7	152.3	169.3	81.7	0	0	0	0	112.3	S200 D201 F239	S198-S200 PolarHBondContact O-N 3.3Å; S198-S200 PolarHBondContact OG-N 2.79Å; S198-S200 PolarHBondContact OG-OG 3.45Å; S198-D201 WeakPolarHBondContact CA-OD2 3.41Å; S198-D201 VanDerWaalsContact CB-OD2 3.31Å; S198-D201 WeakPolarHBondContact CB-OD2 3.39Å; S198-D201 PolarHBondContact N-OD2 2.96Å; S198-D201 WeakPolarHBondContact O-CB 3.49Å; S198-D201 PolarHBondContact O-N 3.34Å; S198-D201 PolarHBondContact OG-OD2 3.31Å; S198-F239 VanDerWaalsContact C-CE1 3.43Å; S198-F239 VanDerWaalsContact C-CZ 3.43Å; S198-F239 VanDerWaalsContact O-CE1 3.26Å; S198-F239 WeakPolarHBondContact O-CE1 3.31Å; S198-F239 WeakPolarHBondContact O-CE2 3.37Å; S198-F239 WeakPolarHBondContact O-CZ 3.44Å
199	A	69.8	Low	80.2	Confident	62 Å²	62	44 Å²	44	51%	0.512	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-51.9	-18.3	175	0	0	0	0	0	115.5	E144	E144-A199 VanDerWaalsContact OE1-CB 3.3Å; E144-A199 WeakPolarHBondContact OE1-CB 3.35Å; E144-A199 PolarHBondContact OE1-N 3.19Å
200	S	73.2	Confident	79.9	Confident	87 Å²	87	44.4 Å²	44.4	61%	0.608	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-78.7	-17.1	175.4	77.8	0	0	0	0	114.5	S198 K202 Q204	S198-S200 PolarHBondContact O-N 3.3Å; S198-S200 PolarHBondContact OG-N 2.79Å; S198-S200 PolarHBondContact OG-OG 3.45Å; S200-K202 VanDerWaalsContact C-N 3.28Å; S200-K202 PolarHBondContact O-N 3.17Å; S200-Q204 PolarHBondContact O-NE2 3.39Å
201	D	73.8	Confident	79.5	Confident	15 Å²	15	48.4 Å²	48.4	8%	0.08	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-84.7	-3.1	178.8	-55.6	-67.6	0	0	0	112.7	H167 F195 S198 E203 Q204 I237 F239	H167-D201 IonicContact CE1-OD1 2.67Å; H167-D201 PolarHBondContact CE1-OD1 3.16Å; H167-D201 VanDerWaalsContact CE1-OD1 3.26Å; H167-D201 IonicContact NE2-OD1 3.39Å; F195-D201 HydrophobicContact CE1-CB 4.38Å; F195-D201 HydrophobicContact CZ-CB 4.03Å; S198-D201 WeakPolarHBondContact CA-OD2 3.41Å; S198-D201 VanDerWaalsContact CB-OD2 3.31Å; S198-D201 WeakPolarHBondContact CB-OD2 3.39Å; S198-D201 PolarHBondContact N-OD2 2.96Å; S198-D201 WeakPolarHBondContact O-CB 3.49Å; S198-D201 PolarHBondContact O-N 3.34Å; S198-D201 PolarHBondContact OG-OD2 3.31Å; D201-E203 PolarHBondContact O-N 3.3Å; D201-Q204 WeakPolarHBondContact O-CB 3.19Å; D201-Q204 PolarHBondContact O-N 2.7Å; D201-I237 HydrophobicContact CB-CD1 4.3Å; D201-F239 HydrophobicContact CB-CE2 3.67Å; D201-F239 HydrophobicContact CB-CZ 3.87Å
202	K	66.3	Low	79.1	Confident	115 Å²	115	48.7 Å²	48.7	50%	0.5	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	133.9	177.5	-173	-174.4	178	-127.3	0	111.2	S200 Q204 F239	S200-K202 VanDerWaalsContact C-N 3.28Å; S200-K202 PolarHBondContact O-N 3.17Å; K202-Q204 PolarHBondContact O-N 3.06Å; K202-F239 HydrophobicContact CB-CD2 3.88Å; K202-F239 HydrophobicContact CB-CE2 4.49Å; K202-F239 HydrophobicContact CB-CG 4.43Å; K202-F239 HydrophobicContact CG-CB 4.47Å; K202-F239 HydrophobicContact CG-CD2 4.39Å
203	E	69	Low	78.6	Confident	143 Å²	143	50.7 Å²	50.7	67%	0.668	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	-1.2	-178.8	-66.2	156.8	-130.4	0	0	115	D201	D201-E203 PolarHBondContact O-N 3.3Å
204	Q	72.8	Confident	78.2	Confident	37 Å²	37	51 Å²	51	17%	0.173	26%	0.261	C	S	.	.			trans	-70.7	150.8	168.6	-57	-161	45.6	0	0	110.7	H167 N169 S200 D201 K202 I237	H167-Q204 PolarHBondContact ND1-OE1 2.99Å; N169-Q204 PolarHBondContact ND2-OE1 2.69Å; S200-Q204 PolarHBondContact O-NE2 3.39Å; D201-Q204 WeakPolarHBondContact O-CB 3.19Å; D201-Q204 PolarHBondContact O-N 2.7Å; K202-Q204 PolarHBondContact O-N 3.06Å; Q204-I237 HydrophobicContact CB-CD1 4.45Å; Q204-I237 WeakPolarHBondContact O-CB 3.48Å; Q204-I237 PolarHBondContact O-N 3.39Å
205	K	78.9	Confident	77.6	Confident	80 Å²	80	45.5 Å²	45.5	35%	0.348	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	131.4	177.6	-50.1	176.6	-170.7	178.2	0	108.9	H167 S168 L235 F236	H167-K205 CarbonylContact C-O 3.56Å; S168-K205 WeakPolarHBondContact CB-O 3.36Å; S168-K205 PolarHBondContact N-O 3.32Å; S168-K205 PolarHBondContact OG-N 2.96Å; S168-K205 VanDerWaalsContact OG-N 3.08Å; S168-K205 PolarHBondContact OG-O 2.74Å; K205-L235 CarbonylContact C-O 3.53Å; K205-L235 VanDerWaalsContact CA-O 3.23Å; K205-L235 WeakPolarHBondContact CA-O 3.4Å; K205-F236 HydrophobicContact CD-CD1 4.05Å; K205-F236 HydrophobicContact CD-CE1 3.79Å; K205-F236 HydrophobicContact CD-CZ 4.26Å; K205-F236 VanDerWaalsContact CE-CE1 3.46Å; K205-F236 HydrophobicContact CG-CD1 4.16Å; K205-F236 HydrophobicContact CG-CE1 4.41Å
206	L	81.4	Confident	76.8	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	139.6	174.7	-94.6	161.7	0	0	0	109.5	L150 L173 L193 F195 K234 L235 I237	L150-L206 HydrophobicContact CD1-CD1 3.61Å; L173-L206 HydrophobicContact CD1-CD2 3.32Å; L193-L206 HydrophobicContact CD2-CD1 4.35Å; L193-L206 HydrophobicContact CD2-CD2 3.62Å; F195-L206 HydrophobicContact CD1-CD1 4.39Å; F195-L206 HydrophobicContact CD2-CD1 4.3Å; F195-L206 HydrophobicContact CE2-CD1 4.42Å; F195-L206 HydrophobicContact CG-CD1 4.29Å; L206-K234 CarbonylContact O-C 3.44Å; L206-K234 WeakPolarHBondContact O-CA 3.28Å; L206-L235 HydrophobicContact CB-CB 3.95Å; L206-L235 HydrophobicContact CB-CD2 4.11Å; L206-L235 HydrophobicContact CD1-CD2 4.02Å; L206-L235 PolarHBondContact N-O 3.08Å; L206-L235 PolarHBondContact O-N 3.3Å; L206-I237 HydrophobicContact CD1-CD1 3.77Å; L206-I237 HydrophobicContact CD1-CG1 4.04Å; L206-I237 HydrophobicContact CG-CD1 4.02Å; L206-I237 HydrophobicContact CG-CG1 4.46Å
207	V	82.9	Confident	75.6	Confident	11 Å²	11	50 Å²	50	7%	0.067	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	113.1	-167.8	-178.5	0	0	0	0	110.1	W165 F166 L232 C233 K234	W165-V207 CarbonylContact C-O 3.58Å; W165-V207 WeakPolarHBondContact CA-O 3.29Å; F166-V207 HydrophobicContact CB-CB 4.31Å; F166-V207 PolarHBondContact N-O 2.66Å; F166-V207 WeakPolarHBondContact O-CB 3.18Å; F166-V207 PolarHBondContact O-N 3.28Å; V207-L232 HydrophobicContact CG1-CB 4.23Å; V207-L232 HydrophobicContact CG1-CD2 3.62Å; V207-L232 HydrophobicContact CG1-CG 4.5Å; V207-C233 WeakPolarHBondContact CA-O 3.38Å; V207-K234 HydrophobicContact CG2-CG 4.39Å
208	C	84.9	Confident	74.5	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	133.2	166.7	178.8	0	0	0	0	110.2	L135 C152 I163 W165 C233	L135-C208 HydrophobicContact CD2-CB 4.43Å; C152-C208 HydrophobicContact CB-CB 3.73Å; C152-C208 WeakPolarHBondContact CB-SG 3.47Å; C152-C208 WeakPolarHBondContact SG-CB 3.39Å; C152-C208 CovalentContact SG-SG 2.03Å; C152-C208 PolarHBondContact SG-SG 2.86Å; I163-C208 WeakPolarHBondContact CG2-SG 3.48Å; W165-C208 HydrophobicContact CE3-CB 4.23Å; W165-C208 HydrophobicContact CZ3-CB 4.26Å; C208-C233 HydrophobicContact CB-CB 3.98Å; C208-C233 PolarHBondContact N-O 3.23Å; C208-C233 PolarHBondContact O-N 2.89Å; C208-C233 VanDerWaalsContact O-N 3.07Å
209	K	81.8	Confident	73.3	Confident	16 Å²	16	58.5 Å²	58.5	7%	0.07	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	136.7	170.3	-64.3	179.7	-169.4	161.1	0	110	I163 T164 F166 P221 V230 L232	I163-K209 WeakPolarHBondContact CA-O 3.35Å; T164-K209 PolarHBondContact N-O 2.84Å; T164-K209 PolarHBondContact O-N 3.04Å; F166-K209 HydrophobicContact CD2-CD 3.9Å; F166-K209 HydrophobicContact CD2-CG 4.21Å; F166-K209 HydrophobicContact CE2-CD 3.59Å; F166-K209 HydrophobicContact CE2-CG 4.24Å; F166-K209 HydrophobicContact CZ-CD 4.43Å; K209-P221 PolarHBondContact NZ-O 2.92Å; K209-V230 HydrophobicContact CB-CG1 4.26Å; K209-V230 HydrophobicContact CD-CG1 4.34Å; K209-V230 HydrophobicContact CG-CG1 4.29Å; K209-L232 HydrophobicContact CG-CD2 3.85Å
210	I	82.9	Confident	72.2	Confident	9 Å²	9	58.2 Å²	58.2	5%	0.046	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	146.7	173.4	-61.5	156.5	0	0	0	110.8	P130 P133 P161 Q162 I163	P130-I210 HydrophobicContact CB-CG2 3.93Å; P130-I210 HydrophobicContact CG-CG2 4.02Å; P133-I210 HydrophobicContact CB-CD1 3.37Å; P133-I210 HydrophobicContact CB-CG1 4.42Å; P133-I210 HydrophobicContact CG-CD1 4.01Å; P161-I210 HydrophobicContact CB-CG2 3.52Å; Q162-I210 VanDerWaalsContact O-CA 3.29Å; Q162-I210 WeakPolarHBondContact O-CA 3.34Å; I163-I210 HydrophobicContact CD1-CG1 4.46Å; I163-I210 HydrophobicContact CG1-CG1 4.17Å; I163-I210 HydrophobicContact CG2-CG1 4.41Å
211	W	80.8	Confident	71.1	Confident	123 Å²	123	57.4 Å²	57.4	47%	0.466	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	161.2	167.9	65	-75.6	0	0	0	113.7	Q162 M215	Q162-W211 HydrophobicContact CB-CD2 4.34Å; Q162-W211 HydrophobicContact CB-CG 4.49Å; Q162-W211 HydrophobicContact CB-CZ2 4.14Å; Q162-W211 HydrophobicContact CG-CZ2 4.11Å; Q162-W211 PolarHBondContact N-O 3.43Å; Q162-W211 PolarHBondContact O-N 2.82Å; W211-M215 HydrophobicContact CB-SD 4.26Å
212	N	82.1	Confident	69.9	Low	6 Å²	6	65 Å²	65	3%	0.032	35%	0.35	C	S	.	.			trans	-148.8	175.1	159.5	82	-4	0	0	0	110.1	V128 P130 P159 A214 M215	V128-N212 PolarHBondContact O-ND2 3.08Å; P130-N212 WeakPolarHBondContact CD-OD1 3.37Å; P130-N212 HydrophobicContact CG-CB 4.04Å; P159-N212 PolarHBondContact O-ND2 2.82Å; N212-A214 VanDerWaalsContact C-N 3.26Å; N212-A214 PolarHBondContact O-N 2.84Å; N212-A214 WeakPolarHBondContact OD1-CA 3.3Å; N212-A214 VanDerWaalsContact OD1-CB 3.3Å; N212-A214 WeakPolarHBondContact OD1-CB 3.2Å; N212-A214 PolarHBondContact OD1-N 2.56Å; N212-M215 WeakPolarHBondContact O-CB 3.5Å; N212-M215 PolarHBondContact O-N 2.92Å; N212-M215 VanDerWaalsContact O-N 3.15Å
213	V	81.7	Confident	68.9	Low	69 Å²	69	62.5 Å²	62.5	42%	0.418	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-66.1	-19.6	-177.9	-62	0	0	0	0	114.8	P159 M215 G216	P159-V213 HydrophobicContact CG-CG2 3.75Å; V213-M215 PolarHBondContact O-N 2.93Å; V213-M215 VanDerWaalsContact O-N 3.11Å; V213-G216 PolarHBondContact O-N 2.65Å
214	A	79.6	Confident	67.9	Low	5 Å²	5	59.9 Å²	59.9	4%	0.041	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-71	-2.1	174.8	0	0	0	0	0	113.3	L127 V128 R129 N212	L127-A214 HydrophobicContact CB-CB 3.98Å; V128-A214 WeakPolarHBondContact O-CB 3.4Å; R129-A214 HydrophobicContact CG-CB 4.05Å; R129-A214 VanDerWaalsContact CG-O 3.29Å; R129-A214 WeakPolarHBondContact CG-O 3.46Å; R129-A214 PolarHBondContact NE-O 3.23Å; N212-A214 VanDerWaalsContact C-N 3.26Å; N212-A214 PolarHBondContact O-N 2.84Å; N212-A214 WeakPolarHBondContact OD1-CA 3.3Å; N212-A214 VanDerWaalsContact OD1-CB 3.3Å; N212-A214 WeakPolarHBondContact OD1-CB 3.2Å; N212-A214 PolarHBondContact OD1-N 2.56Å
215	M	76	Confident	66.7	Low	40 Å²	40	66.9 Å²	66.9	20%	0.197	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-93.5	-7.9	171.5	-61.3	170.9	59.2	0	0	113.1	R129 P130 W211 N212 V213 L229	R129-M215 HydrophobicContact CG-CG 4.11Å; P130-M215 HydrophobicContact CG-SD 4.23Å; W211-M215 HydrophobicContact CB-SD 4.26Å; N212-M215 WeakPolarHBondContact O-CB 3.5Å; N212-M215 PolarHBondContact O-N 2.92Å; N212-M215 VanDerWaalsContact O-N 3.15Å; V213-M215 PolarHBondContact O-N 2.93Å; V213-M215 VanDerWaalsContact O-N 3.11Å; M215-L229 HydrophobicContact CE-CB 4.26Å; M215-L229 WeakPolarHBondContact CE-O 3.4Å
216	G	66.3	Low	65.4	Low	51 Å²	51	68.5 Å²	68.5	53%	0.526	39%	0.39	S	S	.	.			trans	113.2	148.3	176.6	0	0	0	0	0	113.7	V213	V213-G216 PolarHBondContact O-N 2.65Å
217	D	56.2	Low	64	Low	133 Å²	133	71.2 Å²	71.2	71%	0.711	40%	0.404	S	S	*	.	S	Bend	trans	-74	151.5	-176.1	-77	-57.7	0	0	0	114.2	V219	D217-V219 PolarHBondContact O-N 2.64Å
218	S	49.9	Very low	62.4	Low	124 Å²	124	76.1 Å²	76.1	87%	0.867	44%	0.437	S	S	*	.			trans	72.8	-4.6	160.1	76.2	0	0	0	0	120.8	A220	S218-A220 PolarHBondContact O-N 2.88Å
219	V	49.2	Very low	61	Low	102 Å²	102	80 Å²	80	62%	0.618	46%	0.457	S	S	*	.			trans	-75.9	115.6	176.4	-175	0	0	0	0	111.4	D217	D217-V219 PolarHBondContact O-N 2.64Å
220	A	47.2	Very low	59.9	Low	57 Å²	57	81.5 Å²	81.5	47%	0.471	47%	0.467	S	S	.	.			trans	-70.8	152.8	-176.5	0	0	0	0	0	113.4	S218 Y222	S218-A220 PolarHBondContact O-N 2.88Å; A220-Y222 HydrophobicContact CB-CD2 4.2Å; A220-Y222 PolarHBondContact O-N 2.86Å
221	P	48.7	Very low	58.7	Low	69 Å²	69	83.6 Å²	83.6	45%	0.448	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-0.4	-174	-24.1	35.2	0	0	0	117.5	K209	K209-P221 PolarHBondContact NZ-O 2.92Å
222	Y	50.4	Low	57.8	Low	176 Å²	176	80.4 Å²	80.4	69%	0.69	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	-9.9	-164.7	-58.6	-71.8	0	0	0	114.9	A220 V224	A220-Y222 HydrophobicContact CB-CD2 4.2Å; A220-Y222 PolarHBondContact O-N 2.86Å; Y222-V224 PolarHBondContact O-N 3.17Å
223	S	45.3	Very low	56.9	Low	62 Å²	62	81.3 Å²	81.3	43%	0.434	48%	0.479	S	S	.	.			trans	-84.4	92.2	171.7	57.4	0	0	0	0	110.4	E225	S223-E225 PolarHBondContact O-N 2.81Å
224	V	46.2	Very low	56.3	Low	87 Å²	87	83.5 Å²	83.5	53%	0.527	48%	0.483	S	S	.	.			trans	-77	-20.7	-164.5	175.8	0	0	0	0	114.8	Y222	Y222-V224 PolarHBondContact O-N 3.17Å
225	E	49	Very low	55.9	Low	184 Å²	184	83.3 Å²	83.3	86%	0.86	48%	0.481	S	S	*	.	S	Bend	trans	-118.5	-10.9	-162.8	-59.3	-170.3	131.4	0	0	116.2	S223	S223-E225 PolarHBondContact O-N 2.81Å
226	T	50.6	Low	55.7	Low	115 Å²	115	86.3 Å²	86.3	71%	0.706	49%	0.493	S	S	*	.	S	Bend	trans	-110.3	-11.2	-162.8	51.3	0	0	0	0	116.8
227	N	52.5	Low	55.8	Low	56 Å²	56	84.1 Å²	84.1	30%	0.299	47%	0.469	S	S	.	.			trans	-121.5	99.3	-179.7	-169.4	-8.7	0	0	0	112.2	L229 V230	N227-L229 PolarHBondContact O-N 2.75Å; N227-L229 VanDerWaalsContact O-N 3.14Å; N227-L229 WeakPolarHBondContact OD1-CB 3.47Å; N227-L229 PolarHBondContact OD1-N 3.11Å; N227-L229 VanDerWaalsContact OD1-N 3.15Å; N227-V230 HydrophobicContact CB-CG2 4.33Å; N227-V230 PolarHBondContact O-N 3.27Å; N227-V230 VanDerWaalsContact O-N 3.1Å
228	P	50	Low	56.1	Low	114 Å²	114	82 Å²	82	74%	0.74	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-9.4	-177.3	29.3	-35.8	0	0	0	114.1	V230	P228-V230 VanDerWaalsContact C-N 3.29Å
229	L	54.5	Low	56.6	Low	82 Å²	82	78 Å²	78	43%	0.429	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-21.7	172	-64.4	169.3	0	0	0	112.4	M215 N227 V231	M215-L229 HydrophobicContact CE-CB 4.26Å; M215-L229 WeakPolarHBondContact CE-O 3.4Å; N227-L229 PolarHBondContact O-N 2.75Å; N227-L229 VanDerWaalsContact O-N 3.14Å; N227-L229 WeakPolarHBondContact OD1-CB 3.47Å; N227-L229 PolarHBondContact OD1-N 3.11Å; N227-L229 VanDerWaalsContact OD1-N 3.15Å; L229-V231 PolarHBondContact O-N 2.94Å
230	V	59.3	Low	56.9	Low	47 Å²	47	73.4 Å²	73.4	29%	0.285	40%	0.396	S	S	.	.	S	Bend	trans	-80.8	73.7	170.3	-173.2	0	0	0	0	107.7	K209 N227 P228 L232	K209-V230 HydrophobicContact CB-CG1 4.26Å; K209-V230 HydrophobicContact CD-CG1 4.34Å; K209-V230 HydrophobicContact CG-CG1 4.29Å; N227-V230 HydrophobicContact CB-CG2 4.33Å; N227-V230 PolarHBondContact O-N 3.27Å; N227-V230 VanDerWaalsContact O-N 3.1Å; P228-V230 VanDerWaalsContact C-N 3.29Å; V230-L232 PolarHBondContact O-N 3.48Å
231	V	57.1	Low	57.3	Low	54 Å²	54	76.1 Å²	76.1	33%	0.327	41%	0.406	S	S	.	.			trans	-60.8	122.9	-169.3	-174.3	0	0	0	0	110.5	P133 L229	P133-V231 HydrophobicContact CG-CB 3.84Å; P133-V231 HydrophobicContact CG-CG1 3.57Å; L229-V231 PolarHBondContact O-N 2.94Å
232	L	61.2	Low	57.9	Low	55 Å²	55	76.3 Å²	76.3	29%	0.288	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	98.1	-176.7	-61.1	169.8	0	0	0	109.7	V207 K209 V230 K234	V207-L232 HydrophobicContact CG1-CB 4.23Å; V207-L232 HydrophobicContact CG1-CD2 3.62Å; V207-L232 HydrophobicContact CG1-CG 4.5Å; K209-L232 HydrophobicContact CG-CD2 3.85Å; V230-L232 PolarHBondContact O-N 3.48Å; L232-K234 HydrophobicContact CB-CG 4.33Å; L232-K234 PolarHBondContact O-N 3.27Å
233	C	64	Low	58.6	Low	25 Å²	25	70 Å²	70	17%	0.169	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	108.5	173.2	-130.7	0	0	0	0	109	P133 L135 V207 C208	P133-C233 HydrophobicContact CB-CB 3.67Å; P133-C233 HydrophobicContact CG-CB 3.86Å; L135-C233 HydrophobicContact CD1-CB 3.74Å; L135-C233 HydrophobicContact CG-CB 3.89Å; V207-C233 WeakPolarHBondContact CA-O 3.38Å; C208-C233 HydrophobicContact CB-CB 3.98Å; C208-C233 PolarHBondContact N-O 3.23Å; C208-C233 PolarHBondContact O-N 2.89Å; C208-C233 VanDerWaalsContact O-N 3.07Å
234	K	70	Confident	60.1	Low	116 Å²	116	75.1 Å²	75.1	50%	0.504	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	102	-169.9	-72.4	173.4	-176.3	175.3	0	111.4	L206 V207 L232	L206-K234 CarbonylContact O-C 3.44Å; L206-K234 WeakPolarHBondContact O-CA 3.28Å; V207-K234 HydrophobicContact CG2-CG 4.39Å; L232-K234 HydrophobicContact CB-CG 4.33Å; L232-K234 PolarHBondContact O-N 3.27Å
235	L	71.3	Confident	61.8	Low	0 Å²	0	71.2 Å²	71.2	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	134.5	169.9	-176.1	83.1	0	0	0	109.9	L135 E137 L140 L150 K205 L206	L135-L235 HydrophobicContact CD1-CB 4.1Å; E137-L235 HydrophobicContact CB-CD1 3.77Å; E137-L235 WeakPolarHBondContact O-CD1 3.5Å; L140-L235 HydrophobicContact CB-CD1 4.01Å; L140-L235 HydrophobicContact CB-CD2 3.81Å; L140-L235 HydrophobicContact CB-CG 4.12Å; L140-L235 HydrophobicContact CD2-CD2 4.24Å; L150-L235 HydrophobicContact CD1-CD2 3.35Å; L150-L235 HydrophobicContact CD2-CD1 4.3Å; L150-L235 HydrophobicContact CD2-CD2 3.52Å; L150-L235 HydrophobicContact CG-CD2 4.06Å; K205-L235 CarbonylContact C-O 3.53Å; K205-L235 VanDerWaalsContact CA-O 3.23Å; K205-L235 WeakPolarHBondContact CA-O 3.4Å; L206-L235 HydrophobicContact CB-CB 3.95Å; L206-L235 HydrophobicContact CB-CD2 4.11Å; L206-L235 HydrophobicContact CD1-CD2 4.02Å; L206-L235 PolarHBondContact N-O 3.08Å; L206-L235 PolarHBondContact O-N 3.3Å
236	F	71.5	Confident	63.6	Low	104 Å²	104	68.8 Å²	68.8	46%	0.456	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	129.7	172.3	-66.9	-104.9	0	0	0	110.1	L140 K205	L140-F236 PolarHBondContact N-O 3.36Å; K205-F236 HydrophobicContact CD-CD1 4.05Å; K205-F236 HydrophobicContact CD-CE1 3.79Å; K205-F236 HydrophobicContact CD-CZ 4.26Å; K205-F236 VanDerWaalsContact CE-CE1 3.46Å; K205-F236 HydrophobicContact CG-CD1 4.16Å; K205-F236 HydrophobicContact CG-CE1 4.41Å
237	I	68.5	Low	65.5	Low	5 Å²	5	64.2 Å²	64.2	3%	0.026	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	114.1	172.3	-58.9	171	0	0	0	109.5	L142 F195 D201 Q204 L206 F239	L142-I237 HydrophobicContact CB-CG2 4.49Å; L142-I237 HydrophobicContact CD1-CG1 4.41Å; L142-I237 HydrophobicContact CD1-CG2 3.44Å; L142-I237 VanDerWaalsContact CD1-CG2 3.44Å; L142-I237 HydrophobicContact CG-CG2 4.1Å; F195-I237 HydrophobicContact CE1-CD1 4.01Å; F195-I237 HydrophobicContact CZ-CD1 3.99Å; D201-I237 HydrophobicContact CB-CD1 4.3Å; Q204-I237 HydrophobicContact CB-CD1 4.45Å; Q204-I237 WeakPolarHBondContact O-CB 3.48Å; Q204-I237 PolarHBondContact O-N 3.39Å; L206-I237 HydrophobicContact CD1-CD1 3.77Å; L206-I237 HydrophobicContact CD1-CG1 4.04Å; L206-I237 HydrophobicContact CG-CD1 4.02Å; L206-I237 HydrophobicContact CG-CG1 4.46Å; I237-F239 HydrophobicContact CG2-CD2 3.76Å; I237-F239 HydrophobicContact CG2-CE2 3.41Å; I237-F239 VanDerWaalsContact CG2-CE2 3.41Å; I237-F239 HydrophobicContact CG2-CZ 4.41Å
238	M	61.8	Low	67.3	Low	87 Å²	87	65.1 Å²	65.1	43%	0.429	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	111.5	168.6	-66.1	-162.7	-59.8	0	0	110.5	L140 V141 L142 S240	L140-M238 PolarHBondContact O-N 3.48Å; V141-M238 CarbonylContact C-O 3.53Å; V141-M238 WeakPolarHBondContact CA-O 3.42Å; V141-M238 HydrophobicContact CG2-CE 4.24Å; L142-M238 PolarHBondContact N-O 3.4Å; M238-S240 PolarHBondContact O-N 3.3Å
239	F	61.2	Low	69.3	Low	41 Å²	41	60.6 Å²	60.6	18%	0.18	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	121.3	170	-83.7	-100.4	0	0	0	109.9	L142 E144 A197 S198 D201 K202 I237	L142-F239 HydrophobicContact CB-CZ 4.48Å; L142-F239 HydrophobicContact CD1-CE2 4.43Å; L142-F239 HydrophobicContact CD1-CZ 4.38Å; L142-F239 WeakPolarHBondContact O-CA 3.24Å; E144-F239 HydrophobicContact CB-CD1 4.24Å; E144-F239 HydrophobicContact CB-CE1 4.21Å; E144-F239 HydrophobicContact CG-CE1 4.45Å; A197-F239 HydrophobicContact CB-CE1 3.54Å; A197-F239 HydrophobicContact CB-CZ 3.48Å; A197-F239 VanDerWaalsContact CB-CZ 3.48Å; S198-F239 VanDerWaalsContact C-CE1 3.43Å; S198-F239 VanDerWaalsContact C-CZ 3.43Å; S198-F239 VanDerWaalsContact O-CE1 3.26Å; S198-F239 WeakPolarHBondContact O-CE1 3.31Å; S198-F239 WeakPolarHBondContact O-CE2 3.37Å; S198-F239 WeakPolarHBondContact O-CZ 3.44Å; D201-F239 HydrophobicContact CB-CE2 3.67Å; D201-F239 HydrophobicContact CB-CZ 3.87Å; K202-F239 HydrophobicContact CB-CD2 3.88Å; K202-F239 HydrophobicContact CB-CE2 4.49Å; K202-F239 HydrophobicContact CB-CG 4.43Å; K202-F239 HydrophobicContact CG-CB 4.47Å; K202-F239 HydrophobicContact CG-CD2 4.39Å; I237-F239 HydrophobicContact CG2-CD2 3.76Å; I237-F239 HydrophobicContact CG2-CE2 3.41Å; I237-F239 VanDerWaalsContact CG2-CE2 3.41Å; I237-F239 HydrophobicContact CG2-CZ 4.41Å
240	S	55.2	Low	70.8	Confident	6 Å²	6	64 Å²	64	4%	0.042	31%	0.314	C	S	.	.			trans	-133	96.7	-178.1	-65.2	0	0	0	0	109.5	L142 M238 V242 Y272	L142-S240 PolarHBondContact O-N 3.29Å; M238-S240 PolarHBondContact O-N 3.3Å; S240-V242 PolarHBondContact O-N 3.32Å; S240-Y272 VanDerWaalsContact CB-CD1 3.46Å; S240-Y272 WeakPolarHBondContact OG-CD2 3.32Å
241	V	56	Low	72.1	Confident	113 Å²	113	64.8 Å²	64.8	69%	0.685	32%	0.32	S	S	*	.			trans	-69.3	115.8	155.1	-178.9	0	0	0	0	106	D243	V241-D243 PolarHBondContact O-N 2.65Å
242	V	59.9	Low	73.4	Confident	74 Å²	74	62.9 Å²	62.9	45%	0.448	31%	0.311	S	S	.	.			trans	-62.2	119.8	179.9	177.4	0	0	0	0	108.9	S240 Q316	S240-V242 PolarHBondContact O-N 3.32Å; V242-Q316 HydrophobicContact CG1-CG 3.42Å; V242-Q316 VanDerWaalsContact CG1-CG 3.42Å
243	D	64.6	Low	74.5	Confident	44 Å²	44	65.1 Å²	65.1	24%	0.235	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	150.4	-169.9	-162.6	7.6	0	0	0	112.4	V241 K246 Y272 N314	V241-D243 PolarHBondContact O-N 2.65Å; D243-K246 VanDerWaalsContact OD2-CE 3.24Å; D243-K246 WeakPolarHBondContact OD2-CE 3.38Å; D243-K246 IonicContact OD2-NZ 2.87Å; D243-K246 PolarHBondContact OD2-NZ 2.81Å; D243-Y272 PolarHBondContact N-O 3.5Å; D243-Y272 VanDerWaalsContact N-O 3.12Å; D243-N314 PolarHBondContact O-ND2 2.97Å
244	R	77.5	Confident	75.6	Confident	168 Å²	168	67.8 Å²	67.8	63%	0.634	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	158.1	171.6	63.4	-175.7	174.4	-160.2	-1.8	110.3	K246	R244-K246 PolarHBondContact O-N 2.9Å; R244-K246 VanDerWaalsContact O-N 3.17Å
245	P	82.7	Confident	76.5	Confident	5 Å²	5	63.9 Å²	63.9	3%	0.032	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	120.1	-177.5	-26	37.6	0	0	0	113.6	V247 A269 A271 P275 S312 N314 G319	P245-V247 HydrophobicContact CB-CG2 4.08Å; P245-V247 PolarHBondContact O-N 3.48Å; P245-A269 HydrophobicContact CB-CB 4.37Å; P245-A271 HydrophobicContact CB-CB 4.04Å; P245-A271 HydrophobicContact CG-CB 3.96Å; P245-P275 HydrophobicContact CB-CG 4.29Å; P245-P275 HydrophobicContact CG-CG 4.26Å; P245-S312 WeakPolarHBondContact CG-O 3.43Å; P245-N314 HydrophobicContact CG-CB 4.18Å; P245-G319 WeakPolarHBondContact O-CA 3.45Å
246	K	86.2	Confident	77.4	Confident	134 Å²	134	64.6 Å²	64.6	58%	0.583	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.5	92.6	167.1	-76.3	169.7	174.8	141.3	0	108.1	D243 R244 A269 N270	D243-K246 VanDerWaalsContact OD2-CE 3.24Å; D243-K246 WeakPolarHBondContact OD2-CE 3.38Å; D243-K246 IonicContact OD2-NZ 2.87Å; D243-K246 PolarHBondContact OD2-NZ 2.81Å; R244-K246 PolarHBondContact O-N 2.9Å; R244-K246 VanDerWaalsContact O-N 3.17Å; K246-A269 WeakPolarHBondContact O-CA 3.45Å; K246-N270 PolarHBondContact N-O 3.12Å; K246-N270 PolarHBondContact O-N 3.26Å
247	V	90.2	Very high	78.2	Confident	19 Å²	19	59.8 Å²	59.8	12%	0.115	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	139.3	-177.3	-169.6	0	0	0	0	110.7	P245 C267 D268 A269 C310 G319 A321	P245-V247 HydrophobicContact CB-CG2 4.08Å; P245-V247 PolarHBondContact O-N 3.48Å; V247-C267 WeakPolarHBondContact CG1-SG 3.48Å; V247-D268 CarbonylContact C-O 3.54Å; V247-A269 HydrophobicContact CG2-CB 3.97Å; V247-C310 HydrophobicContact CG1-CB 4.31Å; V247-G319 VanDerWaalsContact CG2-C 3.42Å; V247-G319 WeakPolarHBondContact CG2-O 3.42Å; V247-A321 HydrophobicContact CB-CB 4.06Å; V247-A321 HydrophobicContact CG1-CB 3.89Å
248	T	90.4	Very high	79.2	Confident	74 Å²	74	61 Å²	61	45%	0.454	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	143.9	172.5	54.4	0	0	0	0	109.1	D268	T248-D268 PolarHBondContact N-O 2.97Å; T248-D268 PolarHBondContact O-N 3.03Å; T248-D268 WeakPolarHBondContact OG1-CB 3.49Å; T248-D268 PolarHBondContact OG1-O 2.56Å
249	V	91.1	Very high	80.5	Confident	20 Å²	20	59.2 Å²	59.2	12%	0.121	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	140.1	179.3	-70	0	0	0	0	110.2	W280 C310 A321 V323	V249-W280 HydrophobicContact CB-CH2 4.21Å; V249-W280 HydrophobicContact CG1-CH2 3.58Å; V249-W280 HydrophobicContact CG1-CZ3 3.94Å; V249-C310 HydrophobicContact CG1-CB 4.15Å; V249-A321 HydrophobicContact CG1-CB 4.06Å; V249-A321 HydrophobicContact CG2-CB 4.49Å; V249-V323 HydrophobicContact CB-CB 4.33Å; V249-V323 HydrophobicContact CB-CG1 4.45Å; V249-V323 HydrophobicContact CG2-CB 3.94Å
250	R	87.7	Confident	81.8	Confident	153 Å²	153	59.7 Å²	59.7	58%	0.577	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.8	145.8	175.3	-69.5	179.8	177.5	161.7	1.6	110.2	S266 D268	R250-S266 PolarHBondContact N-O 3.4Å; R250-S266 PolarHBondContact O-N 3.16Å; R250-D268 WeakPolarHBondContact CD-OD2 3.38Å; R250-D268 IonicContact CZ-OD2 3.37Å; R250-D268 IonicContact NE-OD2 2.74Å; R250-D268 PolarHBondContact NE-OD2 3.19Å; R250-D268 IonicContact NH1-OD2 2.35Å; R250-D268 PolarHBondContact NH1-OD2 3.13Å; R250-D268 IonicContact NH2-OD2 2.73Å; R250-D268 PolarHBondContact NH2-OD2 2.8Å
251	P	85.8	Confident	83.3	Confident	64 Å²	64	63.1 Å²	63.1	42%	0.416	34%	0.339	S	S	.	.	S	Bend	cis	-80.9	-17.6	10.2	31.7	-36.2	0	0	0	115.7	Y255 M401	P251-Y255 HydrophobicContact CG-CD1 3.82Å; P251-Y255 HydrophobicContact CG-CD2 3.53Å; P251-Y255 HydrophobicContact CG-CE1 4.02Å; P251-Y255 HydrophobicContact CG-CE2 3.74Å; P251-Y255 HydrophobicContact CG-CG 3.57Å; P251-M401 HydrophobicContact CB-CE 3.71Å; P251-M401 HydrophobicContact CG-CE 3.57Å
252	G	83.9	Confident	84.9	Confident	14 Å²	14	62.3 Å²	62.3	14%	0.144	33%	0.328	C	S	.	.			trans	-175.9	-173.9	177.9	0	0	0	0	0	112.5	V254 V323	G252-V254 VanDerWaalsContact C-N 3.31Å; G252-V254 PolarHBondContact O-N 3.2Å; G252-V323 WeakPolarHBondContact O-CG2 3.5Å
253	P	84.1	Confident	86.3	Confident	102 Å²	102	58.8 Å²	58.8	66%	0.662	31%	0.306	S	S	*	.	S	Bend	trans	-73.2	-21.3	179.3	30.1	-35.6	0	0	0	113.6	N324	P253-N324 PolarHBondContact O-N 2.97Å
254	V	87.2	Confident	87.5	Confident	80 Å²	80	61.9 Å²	61.9	49%	0.485	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	137.4	170.3	-179.5	0	0	0	0	107.2	G252	G252-V254 VanDerWaalsContact C-N 3.31Å; G252-V254 PolarHBondContact O-N 3.2Å
255	Y	89.7	Confident	88.2	Confident	34 Å²	34	53.9 Å²	53.9	13%	0.133	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	105.4	179.1	-178.8	-157.4	0	0	0	109.4	P251 V257 A263 K264 L265 N324 L325 D326 M401	P251-Y255 HydrophobicContact CG-CD1 3.82Å; P251-Y255 HydrophobicContact CG-CD2 3.53Å; P251-Y255 HydrophobicContact CG-CE1 4.02Å; P251-Y255 HydrophobicContact CG-CE2 3.74Å; P251-Y255 HydrophobicContact CG-CG 3.57Å; Y255-V257 HydrophobicContact CD1-CG2 3.93Å; Y255-V257 HydrophobicContact CD2-CG2 3.58Å; Y255-V257 HydrophobicContact CE1-CG2 3.73Å; Y255-V257 HydrophobicContact CE2-CG2 3.36Å; Y255-V257 HydrophobicContact CG-CG2 3.87Å; Y255-V257 VanDerWaalsContact CZ-CG2 3.44Å; Y255-A263 HydrophobicContact CE1-CB 4.08Å; Y255-K264 PolarHBondContact OH-N 2.99Å; Y255-L265 HydrophobicContact CD1-CD2 3.57Å; Y255-L265 HydrophobicContact CE1-CD2 3.92Å; Y255-N324 PolarHBondContact N-O 3.08Å; Y255-L325 HydrophobicContact CD1-CD1 3.91Å; Y255-L325 HydrophobicContact CG-CD1 4.36Å; Y255-D326 PolarHBondContact O-N 3.17Å; Y255-M401 HydrophobicContact CD2-CE 3.86Å; Y255-M401 HydrophobicContact CD2-CG 4.44Å; Y255-M401 HydrophobicContact CE2-CE 4.34Å
256	S	89.1	Confident	88.6	Confident	15 Å²	15	55 Å²	55	11%	0.105	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	119.8	177.5	-60.3	0	0	0	0	110.8	D326 T399	S256-D326 WeakPolarHBondContact CA-O 3.38Å; S256-D326 WeakPolarHBondContact CB-OD2 3.23Å; S256-D326 PolarHBondContact OG-OD2 2.82Å; S256-T399 WeakPolarHBondContact CB-O 3.18Å
257	V	89.4	Confident	88.8	Confident	4 Å²	4	48.7 Å²	48.7	2%	0.024	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	137.1	-176.2	-171.9	0	0	0	0	109.9	Y255 R261 A263 V300 L325 D326 V327 Q328	Y255-V257 HydrophobicContact CD1-CG2 3.93Å; Y255-V257 HydrophobicContact CD2-CG2 3.58Å; Y255-V257 HydrophobicContact CE1-CG2 3.73Å; Y255-V257 HydrophobicContact CE2-CG2 3.36Å; Y255-V257 HydrophobicContact CG-CG2 3.87Å; Y255-V257 VanDerWaalsContact CZ-CG2 3.44Å; V257-R261 HydrophobicContact CG1-CB 4.03Å; V257-A263 HydrophobicContact CG2-CB 4.35Å; V257-V300 HydrophobicContact CB-CG2 4.36Å; V257-V300 HydrophobicContact CG1-CG2 3.87Å; V257-L325 HydrophobicContact CB-CD1 4.47Å; V257-L325 HydrophobicContact CG2-CD1 3.93Å; V257-D326 PolarHBondContact N-O 2.78Å; V257-V327 WeakPolarHBondContact O-CA 3.13Å; V257-Q328 PolarHBondContact O-N 3.41Å
258	E	89.7	Confident	88.8	Confident	31 Å²	31	48.8 Å²	48.8	15%	0.145	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	138.8	175.1	-177	174.5	-140.5	0	0	111.1	R261 Q328 L398 V400 R408	E258-R261 HydrophobicContact CB-CG 4.17Å; E258-R261 VanDerWaalsContact O-CB 3.3Å; E258-R261 WeakPolarHBondContact O-CB 3.35Å; E258-R261 WeakPolarHBondContact O-CG 3.19Å; E258-R261 PolarHBondContact O-N 2.85Å; E258-R261 VanDerWaalsContact O-N 3.13Å; E258-R261 IonicContact OE2-CZ 2.65Å; E258-R261 IonicContact OE2-NE 2.64Å; E258-R261 PolarHBondContact OE2-NE 2.97Å; E258-R261 IonicContact OE2-NH2 3.79Å; E258-R261 PolarHBondContact OE2-NH2 2.88Å; E258-Q328 CarbonylContact C-O 3.48Å; E258-Q328 VanDerWaalsContact CA-O 3.3Å; E258-Q328 WeakPolarHBondContact CA-O 3.39Å; E258-L398 HydrophobicContact CB-CD2 4.48Å; E258-L398 HydrophobicContact CG-CD2 3.93Å; E258-L398 WeakPolarHBondContact OE1-CD2 3.48Å; E258-V400 HydrophobicContact CB-CG2 3.85Å; E258-R408 IonicContact OE1-CZ 2.63Å; E258-R408 IonicContact OE1-NE 2.77Å; E258-R408 PolarHBondContact OE1-NE 2.63Å; E258-R408 IonicContact OE1-NH2 3.76Å; E258-R408 PolarHBondContact OE1-NH2 2.89Å; E258-R408 IonicContact OE2-NH2 2.82Å
259	V	89.8	Confident	88.6	Confident	48 Å²	48	45.9 Å²	45.9	29%	0.291	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.7	142.8	174.6	168.1	0	0	0	0	111.5	R261 K302 V327 Q328 Y329	V259-R261 PolarHBondContact O-N 2.97Å; V259-K302 HydrophobicContact CG2-CG 4.11Å; V259-V327 HydrophobicContact CG2-CG1 3.33Å; V259-Q328 PolarHBondContact N-O 3.42Å; V259-Y329 HydrophobicContact CG2-CD1 4.13Å; V259-Y329 HydrophobicContact CG2-CG 4.35Å
260	G	87.5	Confident	88.2	Confident	52 Å²	52	51 Å²	51	54%	0.536	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.4	-10	-176.4	0	0	0	0	0	114.7	V300	G260-V300 PolarHBondContact N-O 3.17Å
261	R	87.8	Confident	87.6	Confident	78 Å²	78	44.9 Å²	44.9	29%	0.294	26%	0.26	S	S	.	.	S	Bend	trans	-84.5	162.1	169.8	-57	-167.9	-173.3	-162.9	9	111.6	V257 E258 V259 I299 V300 Q403	V257-R261 HydrophobicContact CG1-CB 4.03Å; E258-R261 HydrophobicContact CB-CG 4.17Å; E258-R261 VanDerWaalsContact O-CB 3.3Å; E258-R261 WeakPolarHBondContact O-CB 3.35Å; E258-R261 WeakPolarHBondContact O-CG 3.19Å; E258-R261 PolarHBondContact O-N 2.85Å; E258-R261 VanDerWaalsContact O-N 3.13Å; E258-R261 IonicContact OE2-CZ 2.65Å; E258-R261 IonicContact OE2-NE 2.64Å; E258-R261 PolarHBondContact OE2-NE 2.97Å; E258-R261 IonicContact OE2-NH2 3.79Å; E258-R261 PolarHBondContact OE2-NH2 2.88Å; V259-R261 PolarHBondContact O-N 2.97Å; R261-I299 WeakPolarHBondContact O-CA 3.19Å; R261-V300 PolarHBondContact O-N 2.85Å; R261-Q403 VanDerWaalsContact NH1-CD 3.3Å
262	E	89.1	Confident	86.7	Confident	96 Å²	96	45 Å²	45	45%	0.449	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	118.9	174.8	-172.2	-168.6	-172.3	0	0	110.5	K264 F298	E262-K264 HydrophobicContact CG-CG 4.45Å; E262-K264 WeakPolarHBondContact OE1-CE 3.45Å; E262-K264 IonicContact OE1-NZ 2.85Å; E262-K264 PolarHBondContact OE1-NZ 2.84Å; E262-K264 WeakPolarHBondContact OE2-CE 3.31Å; E262-K264 IonicContact OE2-NZ 2.83Å; E262-K264 PolarHBondContact OE2-NZ 2.82Å; E262-F298 WeakPolarHBondContact CA-O 3.42Å
263	A	89.1	Confident	86	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	136.5	168.5	0	0	0	0	0	110	Y255 V257 S297 F298 V300 L325	Y255-A263 HydrophobicContact CE1-CB 4.08Å; V257-A263 HydrophobicContact CG2-CB 4.35Å; A263-S297 WeakPolarHBondContact O-CA 3.48Å; A263-F298 HydrophobicContact CB-CE2 4.27Å; A263-F298 HydrophobicContact CB-CZ 4.49Å; A263-F298 PolarHBondContact N-O 3.14Å; A263-F298 PolarHBondContact O-N 2.84Å; A263-V300 HydrophobicContact CB-CG2 3.45Å; A263-V300 VanDerWaalsContact CB-CG2 3.45Å; A263-L325 HydrophobicContact CB-CD1 4.3Å
264	K	90.5	Very high	85.7	Confident	108 Å²	108	45 Å²	45	47%	0.47	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	106.6	177.4	-77.6	169.1	163.5	137.3	0	110.2	Y255 E262	Y255-K264 PolarHBondContact OH-N 2.99Å; E262-K264 HydrophobicContact CG-CG 4.45Å; E262-K264 WeakPolarHBondContact OE1-CE 3.45Å; E262-K264 IonicContact OE1-NZ 2.85Å; E262-K264 PolarHBondContact OE1-NZ 2.84Å; E262-K264 WeakPolarHBondContact OE2-CE 3.31Å; E262-K264 IonicContact OE2-NZ 2.83Å; E262-K264 PolarHBondContact OE2-NZ 2.82Å
265	L	91.5	Very high	85.4	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	132.1	174.5	-51.7	-176.7	0	0	0	108.7	Y255 W280 N295 I296 F298 Y308 V323	Y255-L265 HydrophobicContact CD1-CD2 3.57Å; Y255-L265 HydrophobicContact CE1-CD2 3.92Å; L265-W280 HydrophobicContact CB-CH2 3.83Å; L265-W280 HydrophobicContact CB-CZ2 3.85Å; L265-W280 HydrophobicContact CB-CZ3 4.45Å; L265-W280 HydrophobicContact CD1-CZ3 4.42Å; L265-N295 CarbonylContact O-C 3.49Å; L265-N295 WeakPolarHBondContact O-CA 3.11Å; L265-I296 HydrophobicContact CB-CG1 3.87Å; L265-I296 HydrophobicContact CD1-CD1 4.17Å; L265-I296 HydrophobicContact CD1-CG1 4.3Å; L265-I296 HydrophobicContact CG-CG1 4.4Å; L265-I296 PolarHBondContact N-O 2.73Å; L265-I296 PolarHBondContact O-N 2.75Å; L265-F298 HydrophobicContact CD1-CE1 4.43Å; L265-Y308 HydrophobicContact CD1-CD1 3.7Å; L265-Y308 HydrophobicContact CD1-CD2 4.38Å; L265-Y308 HydrophobicContact CD1-CE1 4.24Å; L265-Y308 HydrophobicContact CD1-CG 3.77Å; L265-V323 HydrophobicContact CD1-CG1 4.13Å; L265-V323 HydrophobicContact CD2-CG1 4.02Å
266	S	91.4	Very high	85.1	Confident	30 Å²	30	45.7 Å²	45.7	21%	0.21	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	134	179.7	-60.8	0	0	0	0	111	R250 N295	R250-S266 PolarHBondContact N-O 3.4Å; R250-S266 PolarHBondContact O-N 3.16Å; S266-N295 WeakPolarHBondContact CA-OD1 3.26Å; S266-N295 VanDerWaalsContact CB-OD1 3.29Å; S266-N295 WeakPolarHBondContact CB-OD1 3.12Å; S266-N295 PolarHBondContact OG-OD1 3Å
267	C	90.7	Very high	85	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	118.7	-177.1	-171	0	0	0	0	110.9	V247 F278 W280 R294 C310	V247-C267 WeakPolarHBondContact CG1-SG 3.48Å; C267-F278 HydrophobicContact CB-CD1 4.29Å; C267-W280 HydrophobicContact CB-CZ2 3.7Å; C267-R294 HydrophobicContact CB-CG 4.41Å; C267-R294 VanDerWaalsContact CB-O 3.23Å; C267-R294 WeakPolarHBondContact CB-O 3.42Å; C267-R294 PolarHBondContact N-O 3.38Å; C267-R294 VanDerWaalsContact N-O 3.08Å; C267-R294 WeakPolarHBondContact O-CG 3.12Å; C267-R294 PolarHBondContact O-NE 3.36Å; C267-C310 HydrophobicContact CB-CB 3.78Å; C267-C310 WeakPolarHBondContact CB-SG 3.37Å; C267-C310 WeakPolarHBondContact SG-CB 3.18Å; C267-C310 CovalentContact SG-SG 2.03Å; C267-C310 PolarHBondContact SG-SG 3.18Å
268	D	89.5	Confident	85	Confident	22 Å²	22	52.1 Å²	52.1	12%	0.118	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	111	179.3	-74.5	-39.6	0	0	0	109.4	V247 T248 R250 R294	V247-D268 CarbonylContact C-O 3.54Å; T248-D268 PolarHBondContact N-O 2.97Å; T248-D268 PolarHBondContact O-N 3.03Å; T248-D268 WeakPolarHBondContact OG1-CB 3.49Å; T248-D268 PolarHBondContact OG1-O 2.56Å; R250-D268 WeakPolarHBondContact CD-OD2 3.38Å; R250-D268 IonicContact CZ-OD2 3.37Å; R250-D268 IonicContact NE-OD2 2.74Å; R250-D268 PolarHBondContact NE-OD2 3.19Å; R250-D268 IonicContact NH1-OD2 2.35Å; R250-D268 PolarHBondContact NH1-OD2 3.13Å; R250-D268 IonicContact NH2-OD2 2.73Å; R250-D268 PolarHBondContact NH2-OD2 2.8Å; D268-R294 IonicContact OD1-CZ 3.73Å; D268-R294 IonicContact OD1-NE 2.75Å; D268-R294 IonicContact OD1-NH2 2.76Å; D268-R294 PolarHBondContact OD1-NH2 3.22Å
269	A	87.2	Confident	85	Confident	13 Å²	13	52.8 Å²	52.8	11%	0.107	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	115.1	-176.4	0	0	0	0	0	111.2	P245 K246 V247 P275 F278 S312	P245-A269 HydrophobicContact CB-CB 4.37Å; K246-A269 WeakPolarHBondContact O-CA 3.45Å; V247-A269 HydrophobicContact CG2-CB 3.97Å; A269-P275 HydrophobicContact CB-CG 3.98Å; A269-F278 HydrophobicContact CB-CE1 3.69Å; A269-F278 HydrophobicContact CB-CZ 4.09Å; A269-S312 WeakPolarHBondContact CB-OG 3.15Å
270	N	81.8	Confident	85.1	Confident	126 Å²	126	50.6 Å²	50.6	67%	0.674	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.2	122.6	176.5	-70.1	-28.8	0	0	0	109.7	K246	K246-N270 PolarHBondContact N-O 3.12Å; K246-N270 PolarHBondContact O-N 3.26Å
271	A	75.3	Confident	85.1	Confident	25 Å²	25	54.1 Å²	54.1	21%	0.207	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	159.2	-175.7	0	0	0	0	0	111.4	P245 P273 P275 N314	P245-A271 HydrophobicContact CB-CB 4.04Å; P245-A271 HydrophobicContact CG-CB 3.96Å; A271-P273 CarbonylContact C-O 3.57Å; A271-P273 WeakPolarHBondContact CB-O 3.37Å; A271-P275 HydrophobicContact CB-CG 3.88Å; A271-N314 WeakPolarHBondContact CB-ND2 3.39Å
272	Y	67.4	Low	85	Confident	68 Å²	68	50.9 Å²	50.9	27%	0.267	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	122.7	160.4	-162.4	-82.7	0	0	0	111.7	V141 S240 D243	V141-Y272 HydrophobicContact CG1-CD1 4.32Å; V141-Y272 HydrophobicContact CG1-CE1 3.52Å; V141-Y272 VanDerWaalsContact CG2-OH 3.23Å; V141-Y272 WeakPolarHBondContact CG2-OH 3.4Å; S240-Y272 VanDerWaalsContact CB-CD1 3.46Å; S240-Y272 WeakPolarHBondContact OG-CD2 3.32Å; D243-Y272 PolarHBondContact N-O 3.5Å; D243-Y272 VanDerWaalsContact N-O 3.12Å
273	P	69	Low	84.1	Confident	33 Å²	33	48.4 Å²	48.4	21%	0.214	26%	0.258	C	S	.	.	S	Bend	cis	-61.5	160.2	-1.4	-23.5	35.4	0	0	0	113.4	A271 N314	A271-P273 CarbonylContact C-O 3.57Å; A271-P273 WeakPolarHBondContact CB-O 3.37Å; P273-N314 WeakPolarHBondContact O-CB 3.32Å; P273-N314 PolarHBondContact O-ND2 3.1Å
274	P	76.7	Confident	82.7	Confident	82 Å²	82	52.1 Å²	52.1	53%	0.532	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-54.9	146.6	176.6	-25.8	35.1	0	0	0	112.1	T276	P274-T276 PolarHBondContact O-N 2.76Å
275	P	81.7	Confident	81.1	Confident	26 Å²	26	49.3 Å²	49.3	17%	0.169	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-63	132.7	178.9	-21	33.2	0	0	0	112.3	P245 A269 A271 F278 S312 E313	P245-P275 HydrophobicContact CB-CG 4.29Å; P245-P275 HydrophobicContact CG-CG 4.26Å; A269-P275 HydrophobicContact CB-CG 3.98Å; A271-P275 HydrophobicContact CB-CG 3.88Å; P275-F278 HydrophobicContact CB-CE2 4.14Å; P275-F278 HydrophobicContact CB-CZ 4.13Å; P275-F278 HydrophobicContact CG-CZ 4.38Å; P275-S312 WeakPolarHBondContact CB-OG 3.37Å; P275-E313 CarbonylContact C-O 3.54Å; P275-E313 WeakPolarHBondContact CA-O 3.41Å
276	T	83.7	Confident	79.3	Confident	103 Å²	103	57 Å²	57	63%	0.632	33%	0.331	S	S	*	.	S	Bend	trans	-95.3	-17.1	-179.4	54.8	0	0	0	0	112.7	P274 E313	P274-T276 PolarHBondContact O-N 2.76Å; T276-E313 PolarHBondContact N-O 3.39Å
277	K	86.4	Confident	77.7	Confident	112 Å²	112	58.1 Å²	58.1	49%	0.487	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	148.7	173.5	-47	-171.6	-154.2	127.3	0	111.6	S312 E313	K277-S312 WeakPolarHBondContact O-CA 3.45Å; K277-S312 PolarHBondContact O-OG 3.46Å; K277-E313 HydrophobicContact CB-CB 4.26Å; K277-E313 WeakPolarHBondContact CD-OE2 3.36Å; K277-E313 WeakPolarHBondContact CE-OE2 2.89Å; K277-E313 PolarHBondContact N-O 2.89Å; K277-E313 IonicContact NZ-OE1 2.71Å; K277-E313 PolarHBondContact NZ-OE1 2.87Å; K277-E313 IonicContact NZ-OE2 3.03Å; K277-E313 PolarHBondContact NZ-OE2 2.86Å; K277-E313 PolarHBondContact O-N 3.27Å; K277-E313 VanDerWaalsContact O-N 3.12Å
278	F	90.3	Very high	76.4	Confident	41 Å²	41	63.1 Å²	63.1	18%	0.18	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	142.3	165.3	-69.3	-97.2	0	0	0	107.4	C267 A269 P275 R294	C267-F278 HydrophobicContact CB-CD1 4.29Å; A269-F278 HydrophobicContact CB-CE1 3.69Å; A269-F278 HydrophobicContact CB-CZ 4.09Å; P275-F278 HydrophobicContact CB-CE2 4.14Å; P275-F278 HydrophobicContact CB-CZ 4.13Å; P275-F278 HydrophobicContact CG-CZ 4.38Å; F278-R294 HydrophobicContact CB-CB 4.42Å; F278-R294 HydrophobicContact CD1-CB 4.3Å; F278-R294 HydrophobicContact CD1-CG 3.94Å; F278-R294 HydrophobicContact CD2-CB 4.39Å; F278-R294 HydrophobicContact CE1-CG 3.98Å; F278-R294 HydrophobicContact CG-CB 4.12Å; F278-R294 HydrophobicContact CG-CG 4.23Å; F278-R294 HydrophobicContact CZ-CG 4.34Å
279	S	89.5	Confident	75.5	Confident	46 Å²	46	63.2 Å²	63.2	32%	0.322	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	139.5	167.4	49.3	0	0	0	0	111	W291 C310 T311	S279-W291 CarbonylContact C-O 3.51Å; S279-W291 WeakPolarHBondContact CA-O 3.37Å; S279-C310 CarbonylContact O-C 3.54Å; S279-C310 WeakPolarHBondContact O-CA 3.39Å; S279-T311 PolarHBondContact N-O 3.08Å; S279-T311 PolarHBondContact O-N 2.95Å
280	W	90.6	Very high	75.2	Confident	1 Å²	1	67.5 Å²	67.5	0%	0.004	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	141.6	166.2	-70	92.2	0	0	0	109.7	V249 L265 C267 T290 W291 E293 R294 I296 T309 C310 V323	V249-W280 HydrophobicContact CB-CH2 4.21Å; V249-W280 HydrophobicContact CG1-CH2 3.58Å; V249-W280 HydrophobicContact CG1-CZ3 3.94Å; L265-W280 HydrophobicContact CB-CH2 3.83Å; L265-W280 HydrophobicContact CB-CZ2 3.85Å; L265-W280 HydrophobicContact CB-CZ3 4.45Å; L265-W280 HydrophobicContact CD1-CZ3 4.42Å; C267-W280 HydrophobicContact CB-CZ2 3.7Å; W280-T290 VanDerWaalsContact O-CA 3.24Å; W280-T290 WeakPolarHBondContact O-CA 3.12Å; W280-W291 HydrophobicContact CB-CB 4.29Å; W280-W291 HydrophobicContact CB-CE3 3.8Å; W280-W291 PolarHBondContact N-O 3.42Å; W280-W291 PolarHBondContact O-N 3.07Å; W280-E293 PolarHBondContact NE1-O 3.09Å; W280-R294 PolarHBondContact NE1-O 3.28Å; W280-R294 VanDerWaalsContact NE1-O 3.13Å; W280-I296 HydrophobicContact CB-CD1 3.93Å; W280-I296 HydrophobicContact CD2-CD1 3.99Å; W280-I296 HydrophobicContact CD2-CG1 4.39Å; W280-I296 HydrophobicContact CG-CD1 3.7Å; W280-I296 HydrophobicContact CG-CG1 4.27Å; W280-T309 CarbonylContact C-O 3.57Å; W280-T309 WeakPolarHBondContact CA-O 3.44Å; W280-C310 HydrophobicContact CD2-CB 3.86Å; W280-C310 HydrophobicContact CE3-CB 3.75Å; W280-C310 HydrophobicContact CH2-CB 3.95Å; W280-C310 HydrophobicContact CZ2-CB 4.02Å; W280-C310 HydrophobicContact CZ3-CB 3.78Å; W280-V323 HydrophobicContact CH2-CG1 4.17Å; W280-V323 HydrophobicContact CZ3-CG1 3.85Å
281	R	88.5	Confident	75.4	Confident	127 Å²	127	64.6 Å²	64.6	48%	0.479	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	124.8	167.8	-176.7	178.5	-177.2	-161.4	-0.7	110	D288 T290 T309	R281-D288 IonicContact CZ-OD2 2.96Å; R281-D288 VanDerWaalsContact CZ-OD2 3.26Å; R281-D288 IonicContact NE-OD2 2.62Å; R281-D288 PolarHBondContact NE-OD2 3.37Å; R281-D288 IonicContact NH2-OD1 2.69Å; R281-D288 IonicContact NH2-OD2 3.26Å; R281-D288 PolarHBondContact NH2-OD2 3.17Å; R281-T290 HydrophobicContact CB-CG2 4.29Å; R281-T290 HydrophobicContact CG-CG2 4.16Å; R281-T309 PolarHBondContact N-O 3.47Å; R281-T309 PolarHBondContact O-N 3.31Å
282	R	85.6	Confident	75.8	Confident	9 Å²	9	69.5 Å²	69.5	3%	0.034	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	127.7	166.9	176.1	166.2	146.4	-145.9	5.5	108.9	S289 W291 D303 Y308	R282-S289 PolarHBondContact N-O 3.34Å; R282-W291 HydrophobicContact CB-CH2 4.19Å; R282-W291 HydrophobicContact CB-CZ3 4.04Å; R282-D303 IonicContact CZ-OD2 3.68Å; R282-D303 IonicContact NH1-OD2 2.72Å; R282-D303 PolarHBondContact NH2-O 2.98Å; R282-D303 IonicContact NH2-OD2 3.63Å; R282-D303 PolarHBondContact NH2-OD2 2.94Å; R282-Y308 HydrophobicContact CB-CD1 4.36Å; R282-Y308 HydrophobicContact CB-CE1 4.21Å; R282-Y308 HydrophobicContact CG-CE2 4.23Å
283	S	70.3	Confident	76.7	Confident	44 Å²	44	71.8 Å²	71.8	31%	0.308	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	126.3	176.5	-56.4	0	0	0	0	108.6	S307	S283-S307 PolarHBondContact N-O 3.48Å; S283-S307 PolarHBondContact O-N 2.63Å; S283-S307 VanDerWaalsContact O-N 3.13Å
284	A	59.1	Low	77.6	Confident	78 Å²	78	76.1 Å²	76.1	65%	0.645	43%	0.427	S	S	*	.	S	Bend	trans	66.1	131.5	-162.1	0	0	0	0	0	114
285	G	56.2	Low	78.2	Confident	49 Å²	49	76.3 Å²	76.3	51%	0.505	42%	0.424	S	S	.	.	S	Bend	trans	144.2	169.9	-173	0	0	0	0	0	111.5	A287	G285-A287 VanDerWaalsContact C-N 3.3Å; G285-A287 PolarHBondContact O-N 3.13Å
286	L	55.3	Low	78.7	Confident	163 Å²	163	75.2 Å²	75.2	85%	0.853	42%	0.417	S	S	*	.	S	Bend	trans	-76.8	-14.4	-179.7	-87.9	160	0	0	0	114
287	A	57.7	Low	79	Confident	53 Å²	53	74 Å²	74	44%	0.438	41%	0.412	S	S	.	.	S	Bend	trans	-139.4	117.8	174.4	0	0	0	0	0	110.9	G285 S289	G285-A287 VanDerWaalsContact C-N 3.3Å; G285-A287 PolarHBondContact O-N 3.13Å; A287-S289 PolarHBondContact O-N 3.44Å; A287-S289 PolarHBondContact O-OG 3.46Å
288	D	62	Low	79.1	Confident	104 Å²	104	70.3 Å²	70.3	56%	0.556	40%	0.396	S	S	*	.			trans	-63.8	101.5	168.8	-128.8	67.2	0	0	0	107.4	R281	R281-D288 IonicContact CZ-OD2 2.96Å; R281-D288 VanDerWaalsContact CZ-OD2 3.26Å; R281-D288 IonicContact NE-OD2 2.62Å; R281-D288 PolarHBondContact NE-OD2 3.37Å; R281-D288 IonicContact NH2-OD1 2.69Å; R281-D288 IonicContact NH2-OD2 3.26Å; R281-D288 PolarHBondContact NH2-OD2 3.17Å
289	S	71.1	Confident	79.1	Confident	24 Å²	24	74 Å²	74	17%	0.168	42%	0.417	C	S	.	.			trans	-114	136	-167.7	26.5	0	0	0	0	109.7	R282 A287 W291	R282-S289 PolarHBondContact N-O 3.34Å; A287-S289 PolarHBondContact O-N 3.44Å; A287-S289 PolarHBondContact O-OG 3.46Å; S289-W291 VanDerWaalsContact CB-CH2 3.48Å; S289-W291 VanDerWaalsContact O-CZ3 3.23Å; S289-W291 WeakPolarHBondContact O-CZ3 3.44Å; S289-W291 WeakPolarHBondContact OG-CH2 3.15Å
290	T	80.8	Confident	79.1	Confident	103 Å²	103	71.9 Å²	71.9	63%	0.632	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.8	142.2	-175.9	54.2	0	0	0	0	111.6	W280 R281	W280-T290 VanDerWaalsContact O-CA 3.24Å; W280-T290 WeakPolarHBondContact O-CA 3.12Å; R281-T290 HydrophobicContact CB-CG2 4.29Å; R281-T290 HydrophobicContact CG-CG2 4.16Å
291	W	85.9	Confident	79.1	Confident	65 Å²	65	76 Å²	76	25%	0.246	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	142.1	178.3	-55.1	-103.9	0	0	0	108.6	S279 W280 R282 S289 I296 Y308	S279-W291 CarbonylContact C-O 3.51Å; S279-W291 WeakPolarHBondContact CA-O 3.37Å; W280-W291 HydrophobicContact CB-CB 4.29Å; W280-W291 HydrophobicContact CB-CE3 3.8Å; W280-W291 PolarHBondContact N-O 3.42Å; W280-W291 PolarHBondContact O-N 3.07Å; R282-W291 HydrophobicContact CB-CH2 4.19Å; R282-W291 HydrophobicContact CB-CZ3 4.04Å; S289-W291 VanDerWaalsContact CB-CH2 3.48Å; S289-W291 VanDerWaalsContact O-CZ3 3.23Å; S289-W291 WeakPolarHBondContact O-CZ3 3.44Å; S289-W291 WeakPolarHBondContact OG-CH2 3.15Å; W291-I296 HydrophobicContact CB-CG2 3.67Å; W291-I296 HydrophobicContact CD2-CD1 3.94Å; W291-I296 HydrophobicContact CE3-CD1 4Å; W291-I296 HydrophobicContact CG-CD1 4.29Å; W291-I296 HydrophobicContact CG-CG2 3.8Å; W291-I296 HydrophobicContact CZ3-CD1 4.44Å; W291-Y308 HydrophobicContact CH2-CD1 4.26Å; W291-Y308 AromaticContact CH2-CE1 3.53Å; W291-Y308 HydrophobicContact CH2-CE1 3.53Å; W291-Y308 HydrophobicContact CZ2-CE1 4.34Å; W291-Y308 HydrophobicContact CZ3-CD1 4.03Å; W291-Y308 AromaticContact CZ3-CE1 3.78Å; W291-Y308 HydrophobicContact CZ3-CE1 3.78Å
292	V	84.9	Confident	79	Confident	128 Å²	128	73.9 Å²	73.9	78%	0.776	42%	0.418	S	S	*	.			trans	-100.2	8	176.9	-70.1	0	0	0	0	113
293	E	84.8	Confident	79	Confident	117 Å²	117	76.4 Å²	76.4	55%	0.547	43%	0.433	S	S	.	.			trans	-89.6	140	-179.1	-61	174.5	155.4	0	0	110.2	W280 N295 I296	W280-E293 PolarHBondContact NE1-O 3.09Å; E293-N295 VanDerWaalsContact C-N 3.31Å; E293-N295 WeakPolarHBondContact CB-O 3.33Å; E293-N295 PolarHBondContact O-N 3.07Å; E293-I296 HydrophobicContact CB-CG2 4.06Å
294	R	88.1	Confident	79.9	Confident	123 Å²	123	76.5 Å²	76.5	46%	0.464	43%	0.428	S	S	.	.	S	Bend	trans	-63.9	-37.7	178.3	178.4	179.5	166.5	-169.3	-3	112.4	C267 D268 F278 W280	C267-R294 HydrophobicContact CB-CG 4.41Å; C267-R294 VanDerWaalsContact CB-O 3.23Å; C267-R294 WeakPolarHBondContact CB-O 3.42Å; C267-R294 PolarHBondContact N-O 3.38Å; C267-R294 VanDerWaalsContact N-O 3.08Å; C267-R294 WeakPolarHBondContact O-CG 3.12Å; C267-R294 PolarHBondContact O-NE 3.36Å; D268-R294 IonicContact OD1-CZ 3.73Å; D268-R294 IonicContact OD1-NE 2.75Å; D268-R294 IonicContact OD1-NH2 2.76Å; D268-R294 PolarHBondContact OD1-NH2 3.22Å; F278-R294 HydrophobicContact CB-CB 4.42Å; F278-R294 HydrophobicContact CD1-CB 4.3Å; F278-R294 HydrophobicContact CD1-CG 3.94Å; F278-R294 HydrophobicContact CD2-CB 4.39Å; F278-R294 HydrophobicContact CE1-CG 3.98Å; F278-R294 HydrophobicContact CG-CB 4.12Å; F278-R294 HydrophobicContact CG-CG 4.23Å; F278-R294 HydrophobicContact CZ-CG 4.34Å; W280-R294 PolarHBondContact NE1-O 3.28Å; W280-R294 VanDerWaalsContact NE1-O 3.13Å
295	N	90.5	Very high	81.2	Confident	86 Å²	86	74.6 Å²	74.6	46%	0.46	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	136.1	176.6	-58	-18.4	0	0	0	107.7	L265 S266 E293	L265-N295 CarbonylContact O-C 3.49Å; L265-N295 WeakPolarHBondContact O-CA 3.11Å; S266-N295 WeakPolarHBondContact CA-OD1 3.26Å; S266-N295 VanDerWaalsContact CB-OD1 3.29Å; S266-N295 WeakPolarHBondContact CB-OD1 3.12Å; S266-N295 PolarHBondContact OG-OD1 3Å; E293-N295 VanDerWaalsContact C-N 3.31Å; E293-N295 WeakPolarHBondContact CB-O 3.33Å; E293-N295 PolarHBondContact O-N 3.07Å
296	I	90.5	Very high	82.7	Confident	4 Å²	4	72.9 Å²	72.9	2%	0.021	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	138.7	176.5	58.4	176.4	0	0	0	110.3	L265 W280 W291 E293 F298 Y308	L265-I296 HydrophobicContact CB-CG1 3.87Å; L265-I296 HydrophobicContact CD1-CD1 4.17Å; L265-I296 HydrophobicContact CD1-CG1 4.3Å; L265-I296 HydrophobicContact CG-CG1 4.4Å; L265-I296 PolarHBondContact N-O 2.73Å; L265-I296 PolarHBondContact O-N 2.75Å; W280-I296 HydrophobicContact CB-CD1 3.93Å; W280-I296 HydrophobicContact CD2-CD1 3.99Å; W280-I296 HydrophobicContact CD2-CG1 4.39Å; W280-I296 HydrophobicContact CG-CD1 3.7Å; W280-I296 HydrophobicContact CG-CG1 4.27Å; W291-I296 HydrophobicContact CB-CG2 3.67Å; W291-I296 HydrophobicContact CD2-CD1 3.94Å; W291-I296 HydrophobicContact CE3-CD1 4Å; W291-I296 HydrophobicContact CG-CD1 4.29Å; W291-I296 HydrophobicContact CG-CG2 3.8Å; W291-I296 HydrophobicContact CZ3-CD1 4.44Å; E293-I296 HydrophobicContact CB-CG2 4.06Å; I296-F298 HydrophobicContact CD1-CE1 4.15Å; I296-F298 HydrophobicContact CG1-CE1 4.36Å; I296-Y308 HydrophobicContact CD1-CD1 4.16Å; I296-Y308 HydrophobicContact CD1-CE1 4.38Å
297	S	90	Very high	84.3	Confident	77 Å²	77	67.1 Å²	67.1	54%	0.538	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	126.7	-178.5	53.5	0	0	0	0	110.4	A263	A263-S297 WeakPolarHBondContact O-CA 3.48Å
298	F	89.5	Confident	85.9	Confident	34 Å²	34	64.7 Å²	64.7	15%	0.149	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	155.9	-180	51.7	-93.4	0	0	0	111.1	E262 A263 L265 I296 V300 H304 Y308 L325	E262-F298 WeakPolarHBondContact CA-O 3.42Å; A263-F298 HydrophobicContact CB-CE2 4.27Å; A263-F298 HydrophobicContact CB-CZ 4.49Å; A263-F298 PolarHBondContact N-O 3.14Å; A263-F298 PolarHBondContact O-N 2.84Å; L265-F298 HydrophobicContact CD1-CE1 4.43Å; I296-F298 HydrophobicContact CD1-CE1 4.15Å; I296-F298 HydrophobicContact CG1-CE1 4.36Å; F298-V300 HydrophobicContact CE2-CG2 4.35Å; F298-H304 AromaticContact CD2-ND1 3.54Å; F298-H304 HydrophobicContact CE2-CB 4.17Å; F298-H304 AromaticContact CE2-ND1 3.76Å; F298-Y308 AromaticContact CE1-CE1 4Å; F298-Y308 HydrophobicContact CE1-CE1 4Å; F298-Y308 AromaticContact CZ-CE1 3.81Å; F298-Y308 HydrophobicContact CZ-CE1 3.81Å; F298-Y308 AromaticContact CZ-CZ 3.69Å; F298-Y308 WeakPolarHBondContact CZ-OH 3.27Å; F298-L325 HydrophobicContact CE2-CD2 3.86Å; F298-L325 HydrophobicContact CZ-CD2 3.81Å
299	I	90.7	Very high	87.3	Confident	118 Å²	118	60.7 Å²	60.7	61%	0.605	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.6	135.4	169	-61.1	177.4	0	0	0	108	R261 H304	R261-I299 WeakPolarHBondContact O-CA 3.19Å; I299-H304 PolarHBondContact O-CE1 2.91Å; I299-H304 VanDerWaalsContact O-CE1 3.24Å; I299-H304 PolarHBondContact O-ND1 2.85Å; I299-H304 VanDerWaalsContact O-ND1 3.15Å
300	V	89.6	Confident	88.3	Confident	3 Å²	3	59.6 Å²	59.6	2%	0.018	32%	0.319	C	S	.	.			trans	-85.9	124.5	-172.9	176.4	0	0	0	0	111.6	V257 G260 R261 A263 F298 V327	V257-V300 HydrophobicContact CB-CG2 4.36Å; V257-V300 HydrophobicContact CG1-CG2 3.87Å; G260-V300 PolarHBondContact N-O 3.17Å; R261-V300 PolarHBondContact O-N 2.85Å; A263-V300 HydrophobicContact CB-CG2 3.45Å; A263-V300 VanDerWaalsContact CB-CG2 3.45Å; F298-V300 HydrophobicContact CE2-CG2 4.35Å; V300-V327 HydrophobicContact CG1-CB 3.97Å; V300-V327 HydrophobicContact CG1-CG1 3.38Å; V300-V327 HydrophobicContact CG1-CG2 3.44Å; V300-V327 VanDerWaalsContact CG1-CG2 3.44Å
301	D	89.5	Confident	88.8	Confident	87 Å²	87	55.9 Å²	55.9	47%	0.465	30%	0.296	S	S	.	.			trans	-108	163.6	165.9	-158.2	-71.1	0	0	0	110.3	D303 H304	D301-D303 PolarHBondContact O-N 3.21Å; D301-H304 PolarHBondContact N-ND1 2.86Å; D301-H304 WeakPolarHBondContact O-CB 3.47Å; D301-H304 PolarHBondContact O-N 2.35Å
302	K	87.5	Confident	89	Confident	82 Å²	82	52.8 Å²	52.8	36%	0.357	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-54.1	-34.2	179.4	-64.8	178.5	-179.6	175	0	112.5	V259 Y329 D332	V259-K302 HydrophobicContact CG2-CG 4.11Å; K302-Y329 HydrophobicContact CB-CE1 4.49Å; K302-Y329 HydrophobicContact CD-CD2 4.38Å; K302-Y329 HydrophobicContact CD-CE2 4.27Å; K302-Y329 HydrophobicContact CG-CD1 4.06Å; K302-Y329 HydrophobicContact CG-CE1 4.16Å; K302-Y329 HydrophobicContact CG-CG 4.27Å; K302-D332 IonicContact NZ-OD2 3.65Å; K302-D332 PolarHBondContact NZ-OD2 3.25Å
303	D	86	Confident	89.1	Confident	63 Å²	63	49.7 Å²	49.7	34%	0.337	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-76.2	-22.3	179.6	98.9	-69.7	0	0	0	113.4	R282 D301 A305	R282-D303 IonicContact CZ-OD2 3.68Å; R282-D303 IonicContact NH1-OD2 2.72Å; R282-D303 PolarHBondContact NH2-O 2.98Å; R282-D303 IonicContact NH2-OD2 3.63Å; R282-D303 PolarHBondContact NH2-OD2 2.94Å; D301-D303 PolarHBondContact O-N 3.21Å; D303-A305 PolarHBondContact O-N 3.25Å
304	H	87.9	Confident	89	Confident	45 Å²	45	44.4 Å²	44.4	21%	0.208	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-67	-6.6	-177.5	-67.6	174.7	0	0	0	113.5	F298 I299 D301 Y308	F298-H304 AromaticContact CD2-ND1 3.54Å; F298-H304 HydrophobicContact CE2-CB 4.17Å; F298-H304 AromaticContact CE2-ND1 3.76Å; I299-H304 PolarHBondContact O-CE1 2.91Å; I299-H304 VanDerWaalsContact O-CE1 3.24Å; I299-H304 PolarHBondContact O-ND1 2.85Å; I299-H304 VanDerWaalsContact O-ND1 3.15Å; D301-H304 PolarHBondContact N-ND1 2.86Å; D301-H304 WeakPolarHBondContact O-CB 3.47Å; D301-H304 PolarHBondContact O-N 2.35Å; H304-Y308 WeakPolarHBondContact O-CE2 3.43Å; H304-Y308 PolarHBondContact O-OH 2.85Å; H304-Y308 VanDerWaalsContact O-OH 3.14Å
305	A	87.6	Confident	88.7	Confident	39 Å²	39	45.5 Å²	45.5	32%	0.322	25%	0.251	S	S	.	.			trans	-58.8	138.9	173.2	0	0	0	0	0	112	D303 V327	D303-A305 PolarHBondContact O-N 3.25Å; A305-V327 HydrophobicContact CB-CB 4.07Å; A305-V327 HydrophobicContact CB-CG2 3.93Å
306	G	87.4	Confident	88.2	Confident	12 Å²	12	46.5 Å²	46.5	12%	0.124	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	155.5	-177.8	178.2	0	0	0	0	0	114.3	N324 L325	G306-N324 PolarHBondContact O-OD1 3.45Å; G306-L325 PolarHBondContact N-O 2.72Å; G306-L325 PolarHBondContact O-N 2Å
307	S	88.9	Confident	87.9	Confident	43 Å²	43	47.7 Å²	47.7	30%	0.301	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	112.8	178.8	-74.8	0	0	0	0	110.7	S283 N324	S283-S307 PolarHBondContact N-O 3.48Å; S283-S307 PolarHBondContact O-N 2.63Å; S283-S307 VanDerWaalsContact O-N 3.13Å; S307-N324 PolarHBondContact OG-OD1 2.86Å
308	Y	90.6	Very high	87.8	Confident	1 Å²	1	48.7 Å²	48.7	0%	0.004	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	109.1	178.5	-73.6	-111.2	0	0	0	109.1	L265 R282 W291 I296 F298 H304 T322 V323 L325	L265-Y308 HydrophobicContact CD1-CD1 3.7Å; L265-Y308 HydrophobicContact CD1-CD2 4.38Å; L265-Y308 HydrophobicContact CD1-CE1 4.24Å; L265-Y308 HydrophobicContact CD1-CG 3.77Å; R282-Y308 HydrophobicContact CB-CD1 4.36Å; R282-Y308 HydrophobicContact CB-CE1 4.21Å; R282-Y308 HydrophobicContact CG-CE2 4.23Å; W291-Y308 HydrophobicContact CH2-CD1 4.26Å; W291-Y308 AromaticContact CH2-CE1 3.53Å; W291-Y308 HydrophobicContact CH2-CE1 3.53Å; W291-Y308 HydrophobicContact CZ2-CE1 4.34Å; W291-Y308 HydrophobicContact CZ3-CD1 4.03Å; W291-Y308 AromaticContact CZ3-CE1 3.78Å; W291-Y308 HydrophobicContact CZ3-CE1 3.78Å; I296-Y308 HydrophobicContact CD1-CD1 4.16Å; I296-Y308 HydrophobicContact CD1-CE1 4.38Å; F298-Y308 AromaticContact CE1-CE1 4Å; F298-Y308 HydrophobicContact CE1-CE1 4Å; F298-Y308 AromaticContact CZ-CE1 3.81Å; F298-Y308 HydrophobicContact CZ-CE1 3.81Å; F298-Y308 AromaticContact CZ-CZ 3.69Å; F298-Y308 WeakPolarHBondContact CZ-OH 3.27Å; H304-Y308 WeakPolarHBondContact O-CE2 3.43Å; H304-Y308 PolarHBondContact O-OH 2.85Å; H304-Y308 VanDerWaalsContact O-OH 3.14Å; Y308-T322 WeakPolarHBondContact O-CA 3.39Å; Y308-V323 PolarHBondContact N-O 2.91Å; Y308-V323 PolarHBondContact O-N 3.02Å; Y308-L325 HydrophobicContact CD2-CB 4.01Å; Y308-L325 HydrophobicContact CE2-CB 3.93Å; Y308-L325 HydrophobicContact CE2-CD2 3.8Å
309	T	91.3	Very high	87.8	Confident	21 Å²	21	47.5 Å²	47.5	13%	0.129	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	123.9	174.3	-61.5	0	0	0	0	109.2	W280 R281 E320 A321 T322	W280-T309 CarbonylContact C-O 3.57Å; W280-T309 WeakPolarHBondContact CA-O 3.44Å; R281-T309 PolarHBondContact N-O 3.47Å; R281-T309 PolarHBondContact O-N 3.31Å; T309-E320 HydrophobicContact CG2-CB 4.01Å; T309-A321 WeakPolarHBondContact CA-O 3.34Å; T309-T322 PolarHBondContact OG1-OG1 3.11Å
310	C	92	Very high	87.9	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	126.3	160.8	-178.9	0	0	0	0	109.1	V247 V249 C267 S279 W280 E320 A321	V247-C310 HydrophobicContact CG1-CB 4.31Å; V249-C310 HydrophobicContact CG1-CB 4.15Å; C267-C310 HydrophobicContact CB-CB 3.78Å; C267-C310 WeakPolarHBondContact CB-SG 3.37Å; C267-C310 WeakPolarHBondContact SG-CB 3.18Å; C267-C310 CovalentContact SG-SG 2.03Å; C267-C310 PolarHBondContact SG-SG 3.18Å; S279-C310 CarbonylContact O-C 3.54Å; S279-C310 WeakPolarHBondContact O-CA 3.39Å; W280-C310 HydrophobicContact CD2-CB 3.86Å; W280-C310 HydrophobicContact CE3-CB 3.75Å; W280-C310 HydrophobicContact CH2-CB 3.95Å; W280-C310 HydrophobicContact CZ2-CB 4.02Å; W280-C310 HydrophobicContact CZ3-CB 3.78Å; C310-E320 CarbonylContact O-C 3.58Å; C310-E320 VanDerWaalsContact O-CA 3.26Å; C310-E320 WeakPolarHBondContact O-CA 3.26Å; C310-A321 PolarHBondContact N-O 3.2Å; C310-A321 PolarHBondContact O-N 2.98Å
311	T	91.2	Very high	87.9	Confident	25 Å²	25	48.6 Å²	48.6	15%	0.153	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	135.9	172.1	-54	0	0	0	0	108.1	S279 I318 E320	S279-T311 PolarHBondContact N-O 3.08Å; S279-T311 PolarHBondContact O-N 2.95Å; T311-I318 HydrophobicContact CG2-CG2 3.47Å; T311-I318 VanDerWaalsContact CG2-CG2 3.47Å; T311-E320 HydrophobicContact CG2-CG 4.09Å; T311-E320 WeakPolarHBondContact CG2-OE1 3.44Å; T311-E320 PolarHBondContact OG1-OE1 2.92Å
312	S	90.4	Very high	88	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	137.3	178.6	-166.6	0	0	0	0	110.3	P245 A269 P275 K277 I318 G319	P245-S312 WeakPolarHBondContact CG-O 3.43Å; A269-S312 WeakPolarHBondContact CB-OG 3.15Å; P275-S312 WeakPolarHBondContact CB-OG 3.37Å; K277-S312 WeakPolarHBondContact O-CA 3.45Å; K277-S312 PolarHBondContact O-OG 3.46Å; S312-I318 WeakPolarHBondContact O-CA 3.42Å; S312-G319 PolarHBondContact N-O 2.81Å; S312-G319 PolarHBondContact O-N 3Å
313	E	88.2	Confident	88.1	Confident	64 Å²	64	43.6 Å²	43.6	30%	0.299	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	132.9	-168	-174.1	-170.3	149.7	0	0	111.3	P275 T276 K277 I318	P275-E313 CarbonylContact C-O 3.54Å; P275-E313 WeakPolarHBondContact CA-O 3.41Å; T276-E313 PolarHBondContact N-O 3.39Å; K277-E313 HydrophobicContact CB-CB 4.26Å; K277-E313 WeakPolarHBondContact CD-OE2 3.36Å; K277-E313 WeakPolarHBondContact CE-OE2 2.89Å; K277-E313 PolarHBondContact N-O 2.89Å; K277-E313 IonicContact NZ-OE1 2.71Å; K277-E313 PolarHBondContact NZ-OE1 2.87Å; K277-E313 IonicContact NZ-OE2 3.03Å; K277-E313 PolarHBondContact NZ-OE2 2.86Å; K277-E313 PolarHBondContact O-N 3.27Å; K277-E313 VanDerWaalsContact O-N 3.12Å; E313-I318 HydrophobicContact CB-CG1 4.49Å; E313-I318 HydrophobicContact CG-CG1 4.25Å
314	N	81.9	Confident	88.3	Confident	5 Å²	5	44 Å²	44	3%	0.027	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	-178.3	164.1	78.7	-4.9	0	0	0	110.4	D243 P245 A271 P273 Q316 G317	D243-N314 PolarHBondContact O-ND2 2.97Å; P245-N314 HydrophobicContact CG-CB 4.18Å; A271-N314 WeakPolarHBondContact CB-ND2 3.39Å; P273-N314 WeakPolarHBondContact O-CB 3.32Å; P273-N314 PolarHBondContact O-ND2 3.1Å; N314-Q316 PolarHBondContact O-N 2.91Å; N314-Q316 WeakPolarHBondContact OD1-CA 3.31Å; N314-Q316 WeakPolarHBondContact OD1-CB 3.48Å; N314-Q316 PolarHBondContact OD1-N 2.86Å; N314-G317 PolarHBondContact N-O 3.45Å; N314-G317 PolarHBondContact O-N 3.45Å; N314-G317 PolarHBondContact OD1-N 3.12Å; N314-G317 PolarHBondContact OD1-O 2.85Å
315	L	82	Confident	88.4	Confident	146 Å²	146	42 Å²	42	76%	0.764	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-7.3	179.8	-66.5	174.8	0	0	0	115
316	Q	79.7	Confident	88.5	Confident	107 Å²	107	41.8 Å²	41.8	50%	0.5	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-4	175.4	-57.6	-58.6	-44.1	0	0	112.9	V242 N314	V242-Q316 HydrophobicContact CG1-CG 3.42Å; V242-Q316 VanDerWaalsContact CG1-CG 3.42Å; N314-Q316 PolarHBondContact O-N 2.91Å; N314-Q316 WeakPolarHBondContact OD1-CA 3.31Å; N314-Q316 WeakPolarHBondContact OD1-CB 3.48Å; N314-Q316 PolarHBondContact OD1-N 2.86Å
317	G	84.1	Confident	88.7	Confident	29 Å²	29	41.3 Å²	41.3	30%	0.299	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	123.6	-152.6	176.8	0	0	0	0	0	113.1	N314	N314-G317 PolarHBondContact N-O 3.45Å; N314-G317 PolarHBondContact O-N 3.45Å; N314-G317 PolarHBondContact OD1-N 3.12Å; N314-G317 PolarHBondContact OD1-O 2.85Å
318	I	88.5	Confident	88.8	Confident	99 Å²	99	39.6 Å²	39.6	51%	0.508	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	141.1	-166.7	-61	172.5	0	0	0	109.8	T311 S312 E313 E320	T311-I318 HydrophobicContact CG2-CG2 3.47Å; T311-I318 VanDerWaalsContact CG2-CG2 3.47Å; S312-I318 WeakPolarHBondContact O-CA 3.42Å; E313-I318 HydrophobicContact CB-CG1 4.49Å; E313-I318 HydrophobicContact CG-CG1 4.25Å; I318-E320 HydrophobicContact CG2-CG 3.95Å
319	G	88.8	Confident	88.8	Confident	9 Å²	9	41.6 Å²	41.6	9%	0.093	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	152	163.2	0	0	0	0	0	110.6	P245 V247 S312	P245-G319 WeakPolarHBondContact O-CA 3.45Å; V247-G319 VanDerWaalsContact CG2-C 3.42Å; V247-G319 WeakPolarHBondContact CG2-O 3.42Å; S312-G319 PolarHBondContact N-O 2.81Å; S312-G319 PolarHBondContact O-N 3Å
320	E	91.9	Very high	88.8	Confident	122 Å²	122	45.7 Å²	45.7	57%	0.57	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-140.1	149.9	-177.2	-54.7	-162.4	126.5	0	0	111.5	T309 C310 T311 I318	T309-E320 HydrophobicContact CG2-CB 4.01Å; C310-E320 CarbonylContact O-C 3.58Å; C310-E320 VanDerWaalsContact O-CA 3.26Å; C310-E320 WeakPolarHBondContact O-CA 3.26Å; T311-E320 HydrophobicContact CG2-CG 4.09Å; T311-E320 WeakPolarHBondContact CG2-OE1 3.44Å; T311-E320 PolarHBondContact OG1-OE1 2.92Å; I318-E320 HydrophobicContact CG2-CG 3.95Å
321	A	90.7	Very high	88.9	Confident	21 Å²	21	46 Å²	46	17%	0.174	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	144.6	167.7	0	0	0	0	0	110.8	V247 V249 T309 C310	V247-A321 HydrophobicContact CB-CB 4.06Å; V247-A321 HydrophobicContact CG1-CB 3.89Å; V249-A321 HydrophobicContact CG1-CB 4.06Å; V249-A321 HydrophobicContact CG2-CB 4.49Å; T309-A321 WeakPolarHBondContact CA-O 3.34Å; C310-A321 PolarHBondContact N-O 3.2Å; C310-A321 PolarHBondContact O-N 2.98Å
322	T	90.7	Very high	88.9	Confident	65 Å²	65	48.1 Å²	48.1	40%	0.399	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	137.3	-173.2	-50.9	0	0	0	0	111.4	Y308 T309	Y308-T322 WeakPolarHBondContact O-CA 3.39Å; T309-T322 PolarHBondContact OG1-OG1 3.11Å
323	V	90.5	Very high	89	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	133.7	165.2	52.9	0	0	0	0	109.1	V249 G252 L265 W280 Y308	V249-V323 HydrophobicContact CB-CB 4.33Å; V249-V323 HydrophobicContact CB-CG1 4.45Å; V249-V323 HydrophobicContact CG2-CB 3.94Å; G252-V323 WeakPolarHBondContact O-CG2 3.5Å; L265-V323 HydrophobicContact CD1-CG1 4.13Å; L265-V323 HydrophobicContact CD2-CG1 4.02Å; W280-V323 HydrophobicContact CH2-CG1 4.17Å; W280-V323 HydrophobicContact CZ3-CG1 3.85Å; Y308-V323 PolarHBondContact N-O 2.91Å; Y308-V323 PolarHBondContact O-N 3.02Å
324	N	89.9	Confident	89.1	Confident	71 Å²	71	49.4 Å²	49.4	38%	0.38	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	115.5	171.5	-159.7	48.8	0	0	0	109.4	P253 Y255 G306 S307 D326	P253-N324 PolarHBondContact O-N 2.97Å; Y255-N324 PolarHBondContact N-O 3.08Å; G306-N324 PolarHBondContact O-OD1 3.45Å; S307-N324 PolarHBondContact OG-OD1 2.86Å; N324-D326 PolarHBondContact O-N 3.15Å
325	L	90.2	Very high	89.5	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	108.1	178.7	-176.1	64.3	0	0	0	109.2	Y255 V257 A263 F298 G306 Y308 V327	Y255-L325 HydrophobicContact CD1-CD1 3.91Å; Y255-L325 HydrophobicContact CG-CD1 4.36Å; V257-L325 HydrophobicContact CB-CD1 4.47Å; V257-L325 HydrophobicContact CG2-CD1 3.93Å; A263-L325 HydrophobicContact CB-CD1 4.3Å; F298-L325 HydrophobicContact CE2-CD2 3.86Å; F298-L325 HydrophobicContact CZ-CD2 3.81Å; G306-L325 PolarHBondContact N-O 2.72Å; G306-L325 PolarHBondContact O-N 2Å; Y308-L325 HydrophobicContact CD2-CB 4.01Å; Y308-L325 HydrophobicContact CE2-CB 3.93Å; Y308-L325 HydrophobicContact CE2-CD2 3.8Å; L325-V327 HydrophobicContact CD2-CG2 4.27Å; L325-V327 HydrophobicContact CG-CG2 4.06Å
326	D	89.8	Confident	89.8	Confident	36 Å²	36	49.5 Å²	49.5	19%	0.193	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	99.4	177.4	168.9	42.7	0	0	0	109.3	Y255 S256 V257 N324 Q328 N356	Y255-D326 PolarHBondContact O-N 3.17Å; S256-D326 WeakPolarHBondContact CA-O 3.38Å; S256-D326 WeakPolarHBondContact CB-OD2 3.23Å; S256-D326 PolarHBondContact OG-OD2 2.82Å; V257-D326 PolarHBondContact N-O 2.78Å; N324-D326 PolarHBondContact O-N 3.15Å; D326-Q328 PolarHBondContact O-N 3.16Å; D326-Q328 WeakPolarHBondContact OD2-CG 3.26Å; D326-Q328 PolarHBondContact OD2-NE2 2.7Å; D326-N356 PolarHBondContact OD1-ND2 3.03Å
327	V	90.6	Very high	90.2	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.006	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	102.7	-179	177	0	0	0	0	109.6	V257 V259 V300 A305 L325 Y329 N356	V257-V327 WeakPolarHBondContact O-CA 3.13Å; V259-V327 HydrophobicContact CG2-CG1 3.33Å; V300-V327 HydrophobicContact CG1-CB 3.97Å; V300-V327 HydrophobicContact CG1-CG1 3.38Å; V300-V327 HydrophobicContact CG1-CG2 3.44Å; V300-V327 VanDerWaalsContact CG1-CG2 3.44Å; A305-V327 HydrophobicContact CB-CB 4.07Å; A305-V327 HydrophobicContact CB-CG2 3.93Å; L325-V327 HydrophobicContact CD2-CG2 4.27Å; L325-V327 HydrophobicContact CG-CG2 4.06Å; V327-Y329 HydrophobicContact CG1-CD1 4.46Å; V327-Y329 WeakPolarHBondContact O-CD1 3.43Å; V327-N356 PolarHBondContact O-ND2 3.46Å
328	Q	91.3	Very high	90.6	Very high	7 Å²	7	52.3 Å²	52.3	3%	0.033	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	144.4	180	-59.9	-167.9	-3.1	0	0	111.5	V257 E258 V259 D326 N356 L398 T399	V257-Q328 PolarHBondContact O-N 3.41Å; E258-Q328 CarbonylContact C-O 3.48Å; E258-Q328 VanDerWaalsContact CA-O 3.3Å; E258-Q328 WeakPolarHBondContact CA-O 3.39Å; V259-Q328 PolarHBondContact N-O 3.42Å; D326-Q328 PolarHBondContact O-N 3.16Å; D326-Q328 WeakPolarHBondContact OD2-CG 3.26Å; D326-Q328 PolarHBondContact OD2-NE2 2.7Å; Q328-N356 CarbonylContact C-O 3.55Å; Q328-N356 WeakPolarHBondContact CA-O 3.36Å; Q328-N356 WeakPolarHBondContact CB-O 3.36Å; Q328-L398 HydrophobicContact CB-CG 4.18Å; Q328-L398 VanDerWaalsContact OE1-CA 3.29Å; Q328-T399 PolarHBondContact NE2-OG1 2.99Å; Q328-T399 VanDerWaalsContact NE2-OG1 3.11Å
329	Y	91.2	Very high	90.7	Very high	43 Å²	43	49.2 Å²	49.2	17%	0.169	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	154.4	179.4	51.3	-85.3	0	0	0	111.4	V259 K302 V327 V354 N356 N396	V259-Y329 HydrophobicContact CG2-CD1 4.13Å; V259-Y329 HydrophobicContact CG2-CG 4.35Å; K302-Y329 HydrophobicContact CB-CE1 4.49Å; K302-Y329 HydrophobicContact CD-CD2 4.38Å; K302-Y329 HydrophobicContact CD-CE2 4.27Å; K302-Y329 HydrophobicContact CG-CD1 4.06Å; K302-Y329 HydrophobicContact CG-CE1 4.16Å; K302-Y329 HydrophobicContact CG-CG 4.27Å; V327-Y329 HydrophobicContact CG1-CD1 4.46Å; V327-Y329 WeakPolarHBondContact O-CD1 3.43Å; Y329-V354 HydrophobicContact CE2-CG1 4.15Å; Y329-N356 HydrophobicContact CD1-CB 3.88Å; Y329-N356 HydrophobicContact CE1-CB 3.43Å; Y329-N356 VanDerWaalsContact CE1-CB 3.43Å; Y329-N356 PolarHBondContact N-O 2.84Å; Y329-N356 PolarHBondContact O-N 3.48Å; Y329-N356 VanDerWaalsContact O-O 3.06Å; Y329-N396 PolarHBondContact O-ND2 2.87Å
330	E	91	Very high	90.8	Very high	108 Å²	108	53.2 Å²	53.2	51%	0.505	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	166.4	176.8	63.6	-173.3	173.7	0	0	113	D332 R408	E330-D332 PolarHBondContact O-N 3.01Å; E330-R408 HydrophobicContact CB-CB 3.58Å; E330-R408 HydrophobicContact CB-CG 3.74Å; E330-R408 WeakPolarHBondContact OE2-CD 3.33Å
331	P	93.7	Very high	90.8	Very high	5 Å²	5	47.9 Å²	47.9	3%	0.032	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	118.8	-174.1	-15.3	31.5	0	0	0	113	V353 A394 N396 A410	P331-V353 HydrophobicContact CB-CG1 3.75Å; P331-A394 HydrophobicContact CB-CB 3.74Å; P331-A394 HydrophobicContact CG-CB 4.27Å; P331-N396 WeakPolarHBondContact CD-OD1 3.44Å; P331-N396 HydrophobicContact CG-CB 4.33Å; P331-A410 HydrophobicContact CB-CB 4.16Å; P331-A410 WeakPolarHBondContact O-CB 3.4Å
332	D	91.6	Very high	90.7	Very high	71 Å²	71	51.3 Å²	51.3	38%	0.38	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	123.2	175.8	-161.5	-15.3	0	0	0	109.1	K302 E330 V353 V354	K302-D332 IonicContact NZ-OD2 3.65Å; K302-D332 PolarHBondContact NZ-OD2 3.25Å; E330-D332 PolarHBondContact O-N 3.01Å; D332-V353 CarbonylContact O-C 3.59Å; D332-V353 WeakPolarHBondContact O-CA 3.36Å; D332-V354 HydrophobicContact CB-CB 4.38Å; D332-V354 WeakPolarHBondContact CB-O 3.15Å; D332-V354 PolarHBondContact N-O 2.97Å; D332-V354 PolarHBondContact O-N 2.57Å
333	I	93.6	Very high	90.6	Very high	7 Å²	7	52.5 Å²	52.5	4%	0.036	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	115.4	-170.4	-54.8	-179.5	0	0	0	110.9	L335 V353 A394 A410 K412	I333-L335 HydrophobicContact CG2-CB 4.26Å; I333-V353 HydrophobicContact CG1-CG2 4.4Å; I333-A394 HydrophobicContact CD1-CB 4.21Å; I333-A410 HydrophobicContact CD1-CB 4.03Å; I333-A410 HydrophobicContact CG1-CB 4.3Å; I333-K412 HydrophobicContact CB-CB 3.94Å; I333-K412 HydrophobicContact CB-CD 4.07Å; I333-K412 HydrophobicContact CD1-CB 4.26Å; I333-K412 HydrophobicContact CG2-CB 3.86Å; I333-K412 HydrophobicContact CG2-CD 4.12Å; I333-K412 WeakPolarHBondContact O-CD 3.2Å; I333-K412 WeakPolarHBondContact O-CE 3.3Å; I333-K412 PolarHBondContact O-NZ 2.97Å
334	N	89.9	Confident	90.4	Very high	84 Å²	84	54.4 Å²	54.4	45%	0.449	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	110.1	171.1	-72.3	-36.9	0	0	0	109.4	D352	N334-D352 HydrophobicContact CB-CB 4.01Å; N334-D352 PolarHBondContact N-O 2.86Å
335	L	89.4	Confident	90.4	Very high	30 Å²	30	56 Å²	56	16%	0.157	30%	0.297	C	S	.	.			trans	-151.2	141.8	-179.6	-167	67.1	0	0	0	109.8	I333 W364 K412 T414	I333-L335 HydrophobicContact CG2-CB 4.26Å; L335-W364 HydrophobicContact CD1-CH2 3.67Å; L335-W364 HydrophobicContact CD1-CZ2 4.21Å; L335-W364 HydrophobicContact CD2-CH2 3.75Å; L335-W364 HydrophobicContact CD2-CZ3 4.14Å; L335-W364 HydrophobicContact CG-CH2 4.37Å; L335-K412 HydrophobicContact CB-CD 4.14Å; L335-K412 HydrophobicContact CB-CG 4.41Å; L335-T414 HydrophobicContact CD2-CG2 3.98Å; L335-T414 HydrophobicContact CG-CG2 4.39Å
336	L	89.2	Confident	90.4	Very high	123 Å²	123	58.9 Å²	58.9	64%	0.644	32%	0.317	S	S	*	.			trans	-69.1	143.7	174.3	-63.3	175	0	0	0	110.5	E338 V339 T414	L336-E338 VanDerWaalsContact C-N 3.29Å; L336-E338 PolarHBondContact O-N 3.07Å; L336-V339 HydrophobicContact CB-CG2 4.4Å; L336-V339 HydrophobicContact CD1-CG2 4.37Å; L336-T414 WeakPolarHBondContact O-CB 3.3Å; L336-T414 PolarHBondContact O-OG1 3.3Å
337	S	88.7	Confident	90.4	Very high	105 Å²	105	57.5 Å²	57.5	73%	0.734	31%	0.31	S	S	*	.	S	Bend	trans	-65.3	-33.3	176.7	-49.4	0	0	0	0	112.9	T415	S337-T415 PolarHBondContact O-N 3.09Å
338	E	90.7	Very high	90.5	Very high	89 Å²	89	63 Å²	63	42%	0.416	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	145	-176.2	-169	176.5	123.1	0	0	110.3	L336 T415 I417 Y450	L336-E338 VanDerWaalsContact C-N 3.29Å; L336-E338 PolarHBondContact O-N 3.07Å; E338-T415 CarbonylContact C-O 3.52Å; E338-T415 WeakPolarHBondContact CA-O 3.37Å; E338-I417 VanDerWaalsContact CD-CD1 3.43Å; E338-I417 HydrophobicContact CG-CD1 3.89Å; E338-I417 HydrophobicContact CG-CG1 4.09Å; E338-I417 WeakPolarHBondContact OE1-CD1 3.08Å; E338-Y450 PolarHBondContact OE1-OH 2.88Å
339	V	92.2	Very high	90.5	Very high	34 Å²	34	62.9 Å²	62.9	21%	0.206	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	118.9	172.7	178	0	0	0	0	108.6	L336 L347 L349 T415 V416 I417	L336-V339 HydrophobicContact CB-CG2 4.4Å; L336-V339 HydrophobicContact CD1-CG2 4.37Å; V339-L347 HydrophobicContact CG1-CD1 3.84Å; V339-L349 HydrophobicContact CB-CD2 4.37Å; V339-L349 HydrophobicContact CG1-CD2 4.37Å; V339-L349 HydrophobicContact CG2-CD2 3.97Å; V339-T415 PolarHBondContact N-O 3.37Å; V339-V416 WeakPolarHBondContact O-CA 3.4Å; V339-I417 PolarHBondContact O-N 2.89Å
340	I	90.7	Very high	90.6	Very high	93 Å²	93	66.7 Å²	66.7	48%	0.477	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	128.5	177	-56	165.6	0	0	0	108.7	I417 Y450	I340-I417 WeakPolarHBondContact CA-O 3.46Å; I340-Y450 HydrophobicContact CD1-CE1 4.05Å; I340-Y450 HydrophobicContact CG1-CE1 4.17Å; I340-Y450 HydrophobicContact CG2-CE1 4.08Å
341	V	91.4	Very high	90.7	Very high	11 Å²	11	61.9 Å²	61.9	7%	0.067	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	153.6	175.7	64.2	0	0	0	0	109.2	E345 L347 V382 V416 I417 V418 S419	V341-E345 HydrophobicContact CG2-CB 4.08Å; V341-L347 HydrophobicContact CB-CD1 4.42Å; V341-V382 HydrophobicContact CG1-CB 4.33Å; V341-V382 HydrophobicContact CG1-CG1 4.18Å; V341-V382 HydrophobicContact CG1-CG2 4.41Å; V341-V416 HydrophobicContact CG1-CG1 4.08Å; V341-I417 PolarHBondContact N-O 3Å; V341-V418 HydrophobicContact CG1-CG2 4.21Å; V341-V418 CarbonylContact O-C 3.55Å; V341-V418 WeakPolarHBondContact O-CA 3.31Å; V341-S419 PolarHBondContact O-N 2.95Å; V341-S419 PolarHBondContact O-OG 2.81Å
342	K	88.7	Confident	90.6	Very high	92 Å²	92	64.5 Å²	64.5	40%	0.4	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	144.4	174.6	-167.3	177.3	173.7	176.5	0	111.4	G344 E345 S419	K342-G344 PolarHBondContact O-N 2.9Å; K342-E345 HydrophobicContact CB-CB 4.48Å; K342-E345 VanDerWaalsContact CB-CD 3.46Å; K342-E345 HydrophobicContact CB-CG 3.98Å; K342-E345 WeakPolarHBondContact CB-OE2 3.26Å; K342-E345 WeakPolarHBondContact O-CB 3.17Å; K342-E345 PolarHBondContact O-N 3.45Å; K342-S419 VanDerWaalsContact CA-OG 3.32Å; K342-S419 WeakPolarHBondContact CA-OG 3.34Å
343	E	87.6	Confident	90.6	Very high	90 Å²	90	62.7 Å²	62.7	42%	0.421	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	128.4	172.5	-172.9	155.8	-128.9	0	0	110.7	K384 V418 S419 H420	E343-K384 WeakPolarHBondContact OE1-CB 3.44Å; E343-K384 PolarHBondContact OE1-N 2.85Å; E343-V418 HydrophobicContact CB-CG1 3.76Å; E343-V418 HydrophobicContact CG-CG1 4.4Å; E343-S419 PolarHBondContact N-O 2.86Å; E343-H420 HydrophobicContact CB-CB 4.37Å
344	G	86.6	Confident	90.5	Very high	40 Å²	40	65 Å²	65	41%	0.412	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.6	-21.3	-173.8	0	0	0	0	0	115.6	K342 S381 V382	K342-G344 PolarHBondContact O-N 2.9Å; G344-S381 VanDerWaalsContact C-OG 3.31Å; G344-S381 WeakPolarHBondContact CA-OG 3.33Å; G344-S381 PolarHBondContact O-OG 3Å; G344-V382 PolarHBondContact N-O 2.58Å
345	E	90	Very high	90.6	Very high	105 Å²	105	61.8 Å²	61.8	49%	0.491	33%	0.334	S	S	.	.	S	Bend	trans	-80.6	166.3	-179.4	-69	179.1	176.5	0	0	113	V341 K342 S381 V382	V341-E345 HydrophobicContact CG2-CB 4.08Å; K342-E345 HydrophobicContact CB-CB 4.48Å; K342-E345 VanDerWaalsContact CB-CD 3.46Å; K342-E345 HydrophobicContact CB-CG 3.98Å; K342-E345 WeakPolarHBondContact CB-OE2 3.26Å; K342-E345 WeakPolarHBondContact O-CB 3.17Å; K342-E345 PolarHBondContact O-N 3.45Å; E345-S381 CarbonylContact O-C 3.49Å; E345-S381 WeakPolarHBondContact O-CA 3.48Å; E345-V382 PolarHBondContact O-N 2.99Å
346	S	90.6	Very high	90.7	Very high	62 Å²	62	62.5 Å²	62.5	43%	0.434	34%	0.338	S	S	.	.			trans	-84	140.9	175.9	-53.8	0	0	0	0	112	L379 S380	S346-L379 CarbonylContact C-O 3.6Å; S346-L379 WeakPolarHBondContact CA-O 3.26Å; S346-L379 WeakPolarHBondContact CB-O 3.5Å; S346-S380 WeakPolarHBondContact CA-O 3.3Å; S346-S380 PolarHBondContact OG-O 3.36Å
347	L	90.9	Very high	90.8	Very high	8 Å²	8	58.4 Å²	58.4	4%	0.042	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	135.3	174.4	176	73	0	0	0	110.5	V339 V341 L349 Q378 L379 V382 V416	V339-L347 HydrophobicContact CG1-CD1 3.84Å; V341-L347 HydrophobicContact CB-CD1 4.42Å; L347-L349 HydrophobicContact CD1-CD2 4Å; L347-L349 HydrophobicContact CD1-CG 4.25Å; L347-L349 HydrophobicContact CD2-CD1 4.23Å; L347-L349 HydrophobicContact CD2-CG 4.09Å; L347-L349 HydrophobicContact CG-CD2 4.39Å; L347-L349 HydrophobicContact CG-CG 4.09Å; L347-Q378 WeakPolarHBondContact O-CA 3.22Å; L347-L379 HydrophobicContact CB-CB 4.35Å; L347-L379 HydrophobicContact CD2-CD1 4.19Å; L347-L379 PolarHBondContact N-O 3.12Å; L347-L379 PolarHBondContact O-N 3.41Å; L347-V382 HydrophobicContact CB-CG2 3.6Å; L347-V416 HydrophobicContact CD1-CG1 4.47Å; L347-V416 HydrophobicContact CD2-CG1 3.93Å; L347-V416 HydrophobicContact CD2-CG2 3.93Å
348	H	91.3	Very high	90.9	Very high	115 Å²	115	58 Å²	58	53%	0.532	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	102.6	174.7	-61.3	110.5	0	0	0	110.4	Q378	H348-Q378 VanDerWaalsContact CD2-CD 3.46Å; H348-Q378 PolarHBondContact NE2-NE2 3.39Å; H348-Q378 VanDerWaalsContact NE2-NE2 3.14Å
349	L	92.6	Very high	91	Very high	6 Å²	6	55.7 Å²	55.7	3%	0.031	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	110.8	173.2	-62	-178.1	0	0	0	110	V339 L347 W364 I376 L377 Y390 T414 V416	V339-L349 HydrophobicContact CB-CD2 4.37Å; V339-L349 HydrophobicContact CG1-CD2 4.37Å; V339-L349 HydrophobicContact CG2-CD2 3.97Å; L347-L349 HydrophobicContact CD1-CD2 4Å; L347-L349 HydrophobicContact CD1-CG 4.25Å; L347-L349 HydrophobicContact CD2-CD1 4.23Å; L347-L349 HydrophobicContact CD2-CG 4.09Å; L347-L349 HydrophobicContact CG-CD2 4.39Å; L347-L349 HydrophobicContact CG-CG 4.09Å; L349-W364 HydrophobicContact CB-CH2 3.85Å; L349-W364 HydrophobicContact CB-CZ2 3.61Å; L349-W364 HydrophobicContact CD1-CH2 4.07Å; L349-W364 HydrophobicContact CD1-CZ3 4.06Å; L349-I376 WeakPolarHBondContact O-CA 3.42Å; L349-L377 HydrophobicContact CB-CB 4.36Å; L349-L377 PolarHBondContact N-O 2.95Å; L349-L377 PolarHBondContact O-N 2.94Å; L349-Y390 HydrophobicContact CD1-CD1 4.11Å; L349-Y390 HydrophobicContact CD1-CD2 4.42Å; L349-Y390 HydrophobicContact CD1-CG 3.86Å; L349-T414 HydrophobicContact CD1-CG2 4.01Å; L349-T414 HydrophobicContact CD2-CG2 4.21Å; L349-V416 HydrophobicContact CD1-CG2 3.94Å; L349-V416 HydrophobicContact CD2-CG2 4.38Å
350	K	93	Very high	90.9	Very high	123 Å²	123	58.7 Å²	58.7	54%	0.535	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	122.8	169.3	-172.8	-155.5	-179.3	-160.6	0	109.1	D352 I376	K350-D352 WeakPolarHBondContact CE-OD1 3.35Å; K350-D352 IonicContact NZ-OD1 2.65Å; K350-D352 PolarHBondContact NZ-OD1 2.57Å; K350-I376 HydrophobicContact CG-CG1 4.31Å
351	C	91.9	Very high	91	Very high	6 Å²	6	57.2 Å²	57.2	4%	0.041	31%	0.307	C	S	.	.			trans	-85.4	111.4	166.1	-173.2	0	0	0	0	108.8	V353 V362 W364 S375 C392	C351-V353 WeakPolarHBondContact SG-CG2 3.31Å; C351-V362 HydrophobicContact CB-CG1 4.18Å; C351-W364 HydrophobicContact CB-CZ2 3.71Å; C351-S375 PolarHBondContact N-O 2.85Å; C351-C392 HydrophobicContact CB-CB 3.71Å; C351-C392 WeakPolarHBondContact CB-SG 3.28Å; C351-C392 WeakPolarHBondContact SG-CB 3.11Å; C351-C392 CovalentContact SG-SG 2.02Å; C351-C392 PolarHBondContact SG-SG 3.2Å
352	D	91.9	Very high	91.1	Very high	60 Å²	60	58 Å²	58	32%	0.321	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	120.9	178.6	-164.5	69.6	0	0	0	108.9	N334 K350	N334-D352 HydrophobicContact CB-CB 4.01Å; N334-D352 PolarHBondContact N-O 2.86Å; K350-D352 WeakPolarHBondContact CE-OD1 3.35Å; K350-D352 IonicContact NZ-OD1 2.65Å; K350-D352 PolarHBondContact NZ-OD1 2.57Å
353	V	92.6	Very high	91.4	Very high	33 Å²	33	53.8 Å²	53.8	20%	0.2	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	128.6	-166.7	-174.5	0	0	0	0	110.2	P331 D332 I333 C351 P359 V362 A394	P331-V353 HydrophobicContact CB-CG1 3.75Å; D332-V353 CarbonylContact O-C 3.59Å; D332-V353 WeakPolarHBondContact O-CA 3.36Å; I333-V353 HydrophobicContact CG1-CG2 4.4Å; C351-V353 WeakPolarHBondContact SG-CG2 3.31Å; V353-P359 HydrophobicContact CG1-CG 4.25Å; V353-V362 HydrophobicContact CG2-CG1 4.41Å; V353-V362 HydrophobicContact CG2-CG2 4.45Å; V353-A394 HydrophobicContact CG1-CB 3.74Å; V353-A394 HydrophobicContact CG2-CB 4.05Å
354	V	91.8	Very high	91.7	Very high	57 Å²	57	49.5 Å²	49.5	35%	0.345	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	113.6	178.1	-168.6	0	0	0	0	108.8	Y329 D332	Y329-V354 HydrophobicContact CE2-CG1 4.15Å; D332-V354 HydrophobicContact CB-CB 4.38Å; D332-V354 WeakPolarHBondContact CB-O 3.15Å; D332-V354 PolarHBondContact N-O 2.97Å; D332-V354 PolarHBondContact O-N 2.57Å
355	S	91.4	Very high	92.1	Very high	16 Å²	16	49.4 Å²	49.4	11%	0.112	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	151	179.5	81.9	0	0	0	0	111.7	P357 P358 P359	S355-P357 CarbonylContact C-O 3.58Å; S355-P357 CarbonylContact O-C 3.56Å; S355-P357 PolarHBondContact OG-O 2.9Å; S355-P358 WeakPolarHBondContact OG-CA 3.49Å; S355-P359 VanDerWaalsContact OG-CD 3.3Å; S355-P359 WeakPolarHBondContact OG-CD 3.33Å
356	N	91.4	Very high	92.2	Very high	44 Å²	44	44.8 Å²	44.8	24%	0.235	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	121.1	166.2	-173.9	39.4	0	0	0	110.4	D326 V327 Q328 Y329	D326-N356 PolarHBondContact OD1-ND2 3.03Å; V327-N356 PolarHBondContact O-ND2 3.46Å; Q328-N356 CarbonylContact C-O 3.55Å; Q328-N356 WeakPolarHBondContact CA-O 3.36Å; Q328-N356 WeakPolarHBondContact CB-O 3.36Å; Y329-N356 HydrophobicContact CD1-CB 3.88Å; Y329-N356 HydrophobicContact CE1-CB 3.43Å; Y329-N356 VanDerWaalsContact CE1-CB 3.43Å; Y329-N356 PolarHBondContact N-O 2.84Å; Y329-N356 PolarHBondContact O-N 3.48Å; Y329-N356 VanDerWaalsContact O-O 3.06Å
357	P	90.9	Very high	92.1	Very high	38 Å²	38	44.2 Å²	44.2	25%	0.247	24%	0.237	C	C	.	.	S	Bend	cis	-62.1	163.8	-6.3	27	-34.6	0	0	0	112.5	S355 N396 R397	S355-P357 CarbonylContact C-O 3.58Å; S355-P357 CarbonylContact O-C 3.56Å; S355-P357 PolarHBondContact OG-O 2.9Å; P357-N396 WeakPolarHBondContact O-CB 3.3Å; P357-N396 PolarHBondContact O-ND2 2.86Å; P357-R397 WeakPolarHBondContact CG-O 3.5Å
358	P	90.8	Very high	92	Very high	96 Å²	96	49.3 Å²	49.3	62%	0.623	27%	0.265	S	S	*	.	P	Polyproline II helix	trans	-54	155.5	174.2	-27.2	35.9	0	0	0	113.1	S355	S355-P358 WeakPolarHBondContact OG-CA 3.49Å
359	P	91.9	Very high	91.9	Very high	41 Å²	41	50.4 Å²	50.4	27%	0.266	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-73.4	135.2	-177.4	31	-33	0	0	0	110.9	V353 S355 V362 R395	V353-P359 HydrophobicContact CG1-CG 4.25Å; S355-P359 VanDerWaalsContact OG-CD 3.3Å; S355-P359 WeakPolarHBondContact OG-CD 3.33Å; P359-V362 HydrophobicContact CB-CG2 3.91Å; P359-V362 HydrophobicContact CG-CG2 3.65Å; P359-R395 CarbonylContact C-O 3.57Å; P359-R395 WeakPolarHBondContact CA-O 3.06Å; P359-R395 WeakPolarHBondContact CB-O 3.36Å
360	Y	91.9	Very high	91.9	Very high	97 Å²	97	55.6 Å²	55.6	38%	0.38	29%	0.294	S	S	.	.	S	Bend	trans	-89.7	-14.6	176.3	71.5	-82.2	0	0	0	112.3	R395 R397 E407	Y360-R395 HydrophobicContact CD1-CB 4.49Å; Y360-R395 WeakPolarHBondContact CD1-O 3.34Å; Y360-R395 HydrophobicContact CE1-CB 3.61Å; Y360-R395 WeakPolarHBondContact CE1-O 3.33Å; Y360-R395 PolarHBondContact N-O 2.83Å; Y360-R395 WeakPolarHBondContact OH-CB 3.15Å; Y360-R395 WeakPolarHBondContact OH-CD 3.47Å; Y360-R397 HydrophobicContact CD1-CG 4.36Å; Y360-R397 HydrophobicContact CE1-CG 3.9Å; Y360-E407 HydrophobicContact CE1-CG 4.43Å; Y360-E407 PolarHBondContact OH-OE1 3Å; Y360-E407 VanDerWaalsContact OH-OE1 3.07Å; Y360-E407 PolarHBondContact OH-OE2 2.82Å
361	I	92	Very high	91.8	Very high	61 Å²	61	53.7 Å²	53.7	31%	0.313	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	131.9	167.1	-69.7	172.9	0	0	0	108.5	A394 R395	I361-A394 WeakPolarHBondContact O-CA 3.26Å; I361-R395 HydrophobicContact CB-CB 4.4Å; I361-R395 PolarHBondContact O-N 2.89Å
362	V	94	Very high	91.8	Very high	27 Å²	27	56.4 Å²	56.4	16%	0.164	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	130	158.8	-176.5	0	0	0	0	107	C351 V353 P359 S374 I393 A394	C351-V362 HydrophobicContact CB-CG1 4.18Å; V353-V362 HydrophobicContact CG2-CG1 4.41Å; V353-V362 HydrophobicContact CG2-CG2 4.45Å; P359-V362 HydrophobicContact CB-CG2 3.91Å; P359-V362 HydrophobicContact CG-CG2 3.65Å; V362-S374 PolarHBondContact O-N 2.76Å; V362-I393 WeakPolarHBondContact CA-O 3.43Å; V362-A394 HydrophobicContact CG2-CB 4.32Å
363	S	94.2	Very high	91.7	Very high	5 Å²	5	59.9 Å²	59.9	4%	0.035	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	139	-174.1	57.7	0	0	0	0	111.6	H372 I393	S363-H372 CarbonylContact C-O 3.57Å; S363-H372 VanDerWaalsContact CA-O 3.27Å; S363-H372 WeakPolarHBondContact CA-O 3.45Å; S363-I393 PolarHBondContact N-O 3.05Å; S363-I393 PolarHBondContact O-N 3.49Å
364	W	94.8	Very high	91.5	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	142	169.9	-75.6	97.8	0	0	0	111.4	L335 L349 C351 V371 H372 S374 S375 L377 T391 C392 T414	L335-W364 HydrophobicContact CD1-CH2 3.67Å; L335-W364 HydrophobicContact CD1-CZ2 4.21Å; L335-W364 HydrophobicContact CD2-CH2 3.75Å; L335-W364 HydrophobicContact CD2-CZ3 4.14Å; L335-W364 HydrophobicContact CG-CH2 4.37Å; L349-W364 HydrophobicContact CB-CH2 3.85Å; L349-W364 HydrophobicContact CB-CZ2 3.61Å; L349-W364 HydrophobicContact CD1-CH2 4.07Å; L349-W364 HydrophobicContact CD1-CZ3 4.06Å; C351-W364 HydrophobicContact CB-CZ2 3.71Å; W364-V371 CarbonylContact O-C 3.58Å; W364-V371 WeakPolarHBondContact O-CA 3.45Å; W364-H372 HydrophobicContact CB-CB 4.37Å; W364-H372 PolarHBondContact N-O 3.05Å; W364-H372 PolarHBondContact O-N 3.28Å; W364-S374 VanDerWaalsContact CD1-O 3.3Å; W364-S375 PolarHBondContact NE1-O 3.14Å; W364-L377 HydrophobicContact CB-CB 4.39Å; W364-L377 HydrophobicContact CB-CD2 4.24Å; W364-L377 HydrophobicContact CD2-CB 4.33Å; W364-L377 HydrophobicContact CG-CB 3.9Å; W364-L377 HydrophobicContact CG-CD2 4.36Å; W364-T391 CarbonylContact C-O 3.54Å; W364-T391 WeakPolarHBondContact CA-O 3.47Å; W364-C392 HydrophobicContact CD2-CB 4.18Å; W364-C392 HydrophobicContact CE3-CB 4.05Å; W364-C392 HydrophobicContact CH2-CB 4.1Å; W364-C392 HydrophobicContact CZ2-CB 4.21Å; W364-C392 HydrophobicContact CZ3-CB 4.01Å; W364-T414 HydrophobicContact CH2-CG2 4.24Å; W364-T414 HydrophobicContact CZ3-CG2 4.18Å
365	I	94.3	Very high	91.5	Very high	38 Å²	38	60.7 Å²	60.7	20%	0.195	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	130.8	164.7	-54.3	-171.6	0	0	0	108.3	E370 V371 Y390 T391 I393	I365-E370 WeakPolarHBondContact CA-O 3.3Å; I365-V371 HydrophobicContact CG1-CG2 4.35Å; I365-Y390 WeakPolarHBondContact O-CA 3.42Å; I365-T391 PolarHBondContact N-O 2.78Å; I365-T391 PolarHBondContact O-N 3.03Å; I365-I393 HydrophobicContact CD1-CD1 3.56Å; I365-I393 HydrophobicContact CD1-CG1 4.46Å; I365-I393 HydrophobicContact CG1-CD1 4.21Å
366	T	91.9	Very high	91.5	Very high	7 Å²	7	64.2 Å²	64.2	4%	0.043	35%	0.349	C	S	.	.			trans	-89.6	168.9	178.8	63.2	0	0	0	0	111.9	D368 Q369 E370 H372 L377 Y390	T366-D368 WeakPolarHBondContact CB-OD1 3.37Å; T366-D368 PolarHBondContact O-N 2.71Å; T366-D368 PolarHBondContact OG1-OD1 3.22Å; T366-Q369 PolarHBondContact O-N 3.29Å; T366-E370 HydrophobicContact CG2-CB 4.39Å; T366-E370 PolarHBondContact N-O 2.83Å; T366-E370 WeakPolarHBondContact OG1-CB 3.37Å; T366-E370 PolarHBondContact OG1-N 3Å; T366-E370 PolarHBondContact OG1-O 3.16Å; T366-H372 WeakPolarHBondContact CG2-NE2 3.12Å; T366-L377 HydrophobicContact CG2-CD2 4.33Å; T366-Y390 HydrophobicContact CG2-CD1 4.11Å; T366-Y390 HydrophobicContact CG2-CE1 3.74Å
367	P	88.8	Confident	91.5	Very high	50 Å²	50	62.4 Å²	62.4	33%	0.325	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-37.3	178.3	-26.6	36.1	0	0	0	113.6	Q369 Y390	P367-Q369 VanDerWaalsContact C-N 3.25Å; P367-Q369 PolarHBondContact O-N 2.97Å; P367-Q369 PolarHBondContact O-NE2 2.03Å; P367-Y390 HydrophobicContact CG-CD2 4.17Å; P367-Y390 HydrophobicContact CG-CE2 3.84Å
368	D	89.4	Confident	91.5	Very high	115 Å²	115	66.5 Å²	66.5	62%	0.615	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	10.5	176.2	53.3	-19.2	0	0	0	114.6	T366 E370	T366-D368 WeakPolarHBondContact CB-OD1 3.37Å; T366-D368 PolarHBondContact O-N 2.71Å; T366-D368 PolarHBondContact OG1-OD1 3.22Å; D368-E370 VanDerWaalsContact C-N 3.33Å; D368-E370 PolarHBondContact O-N 3.22Å
369	Q	89.5	Confident	91.4	Very high	139 Å²	139	63.5 Å²	63.5	65%	0.65	33%	0.334	S	S	*	.			trans	68.7	16.3	176.1	-48.9	-61.5	-69	0	0	115.9	T366 P367	T366-Q369 PolarHBondContact O-N 3.29Å; P367-Q369 VanDerWaalsContact C-N 3.25Å; P367-Q369 PolarHBondContact O-N 2.97Å; P367-Q369 PolarHBondContact O-NE2 2.03Å
370	E	90.7	Very high	91.1	Very high	115 Å²	115	66.1 Å²	66.1	54%	0.537	35%	0.354	S	S	.	.			trans	-69.7	144.4	168.9	-59.8	-153.6	144.6	0	0	110.9	I365 T366 D368	I365-E370 WeakPolarHBondContact CA-O 3.3Å; T366-E370 HydrophobicContact CG2-CB 4.39Å; T366-E370 PolarHBondContact N-O 2.83Å; T366-E370 WeakPolarHBondContact OG1-CB 3.37Å; T366-E370 PolarHBondContact OG1-N 3Å; T366-E370 PolarHBondContact OG1-O 3.16Å; D368-E370 VanDerWaalsContact C-N 3.33Å; D368-E370 PolarHBondContact O-N 3.22Å
371	V	91	Very high	90.9	Very high	83 Å²	83	64.6 Å²	64.6	50%	0.503	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	110.2	-173.8	-174.7	0	0	0	0	111	W364 I365	W364-V371 CarbonylContact O-C 3.58Å; W364-V371 WeakPolarHBondContact O-CA 3.45Å; I365-V371 HydrophobicContact CG1-CG2 4.35Å
372	H	91.8	Very high	90.8	Very high	63 Å²	63	61.8 Å²	61.8	29%	0.292	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	110.5	177.7	-56.7	-94.5	0	0	0	110.6	S363 W364 T366 S374 L377	S363-H372 CarbonylContact C-O 3.57Å; S363-H372 VanDerWaalsContact CA-O 3.27Å; S363-H372 WeakPolarHBondContact CA-O 3.45Å; W364-H372 HydrophobicContact CB-CB 4.37Å; W364-H372 PolarHBondContact N-O 3.05Å; W364-H372 PolarHBondContact O-N 3.28Å; T366-H372 WeakPolarHBondContact CG2-NE2 3.12Å; H372-S374 PolarHBondContact O-N 3.03Å; H372-L377 HydrophobicContact CB-CD1 4.04Å
373	N	90.2	Very high	90.6	Very high	133 Å²	133	63.6 Å²	63.6	71%	0.711	35%	0.354	S	S	*	.			trans	-78.6	66.1	179.4	-65.1	-47.8	0	0	0	111.9
374	S	89.8	Confident	90.1	Very high	51 Å²	51	68 Å²	68	36%	0.357	37%	0.372	S	S	.	.	S	Bend	trans	-148	150.7	-180	176.6	0	0	0	0	109.8	V362 W364 H372 I376	V362-S374 PolarHBondContact O-N 2.76Å; W364-S374 VanDerWaalsContact CD1-O 3.3Å; H372-S374 PolarHBondContact O-N 3.03Å; S374-I376 VanDerWaalsContact C-N 3.29Å; S374-I376 WeakPolarHBondContact CB-O 3.29Å; S374-I376 PolarHBondContact OG-N 2.88Å; S374-I376 PolarHBondContact OG-O 2.94Å
375	S	90.5	Very high	89.7	Confident	56 Å²	56	72.5 Å²	72.5	39%	0.392	41%	0.41	S	S	.	.	S	Bend	trans	-74.8	-20.1	168	55	0	0	0	0	113	C351 W364	C351-S375 PolarHBondContact N-O 2.85Å; W364-S375 PolarHBondContact NE1-O 3.14Å
376	I	91.9	Very high	89.4	Confident	89 Å²	89	73.6 Å²	73.6	46%	0.456	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	121.9	177.3	-60.3	168.7	0	0	0	109	L349 K350 S374	L349-I376 WeakPolarHBondContact O-CA 3.42Å; K350-I376 HydrophobicContact CG-CG1 4.31Å; S374-I376 VanDerWaalsContact C-N 3.29Å; S374-I376 WeakPolarHBondContact CB-O 3.29Å; S374-I376 PolarHBondContact OG-N 2.88Å; S374-I376 PolarHBondContact OG-O 2.94Å
377	L	91.6	Very high	89.3	Confident	7 Å²	7	75.3 Å²	75.3	4%	0.037	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	131.8	166	-178.4	63.9	0	0	0	108.9	L349 W364 T366 H372 Y390	L349-L377 HydrophobicContact CB-CB 4.36Å; L349-L377 PolarHBondContact N-O 2.95Å; L349-L377 PolarHBondContact O-N 2.94Å; W364-L377 HydrophobicContact CB-CB 4.39Å; W364-L377 HydrophobicContact CB-CD2 4.24Å; W364-L377 HydrophobicContact CD2-CB 4.33Å; W364-L377 HydrophobicContact CG-CB 3.9Å; W364-L377 HydrophobicContact CG-CD2 4.36Å; T366-L377 HydrophobicContact CG2-CD2 4.33Å; H372-L377 HydrophobicContact CB-CD1 4.04Å; L377-Y390 HydrophobicContact CD2-CD1 3.54Å; L377-Y390 HydrophobicContact CD2-CE1 3.64Å
378	Q	90	Very high	89.4	Confident	124 Å²	124	74 Å²	74	58%	0.579	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.6	125.4	-178.8	176.9	169.6	-6.1	0	0	110.7	L347 H348	L347-Q378 WeakPolarHBondContact O-CA 3.22Å; H348-Q378 VanDerWaalsContact CD2-CD 3.46Å; H348-Q378 PolarHBondContact NE2-NE2 3.39Å; H348-Q378 VanDerWaalsContact NE2-NE2 3.14Å
379	L	89.2	Confident	89.7	Confident	33 Å²	33	72 Å²	72	17%	0.173	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	134.1	169.8	-57.1	178.2	0	0	0	108.4	S346 L347 V382	S346-L379 CarbonylContact C-O 3.6Å; S346-L379 WeakPolarHBondContact CA-O 3.26Å; S346-L379 WeakPolarHBondContact CB-O 3.5Å; L347-L379 HydrophobicContact CB-CB 4.35Å; L347-L379 HydrophobicContact CD2-CD1 4.19Å; L347-L379 PolarHBondContact N-O 3.12Å; L347-L379 PolarHBondContact O-N 3.41Å; L379-V382 HydrophobicContact CB-CG2 4Å; L379-V382 HydrophobicContact CD1-CG2 4.2Å
380	S	85.5	Confident	89.9	Confident	96 Å²	96	65.7 Å²	65.7	67%	0.671	39%	0.387	S	S	*	.	S	Bend	trans	-80.3	-32.2	-175.5	48.9	0	0	0	0	113.7	S346	S346-S380 WeakPolarHBondContact CA-O 3.3Å; S346-S380 PolarHBondContact OG-O 3.36Å
381	S	88.5	Confident	90.1	Very high	65 Å²	65	61.7 Å²	61.7	46%	0.455	37%	0.37	S	S	.	.	S	Bend	trans	-150.8	114	177.9	-163.9	0	0	0	0	108.4	G344 E345	G344-S381 VanDerWaalsContact C-OG 3.31Å; G344-S381 WeakPolarHBondContact CA-OG 3.33Å; G344-S381 PolarHBondContact O-OG 3Å; E345-S381 CarbonylContact O-C 3.49Å; E345-S381 WeakPolarHBondContact O-CA 3.48Å
382	V	90.4	Very high	90.3	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.006	35%	0.346	C	S	.	.			trans	-90	137.1	-174.1	-175.2	0	0	0	0	111.5	V341 G344 E345 L347 L379 Q386 V418	V341-V382 HydrophobicContact CG1-CB 4.33Å; V341-V382 HydrophobicContact CG1-CG1 4.18Å; V341-V382 HydrophobicContact CG1-CG2 4.41Å; G344-V382 PolarHBondContact N-O 2.58Å; E345-V382 PolarHBondContact O-N 2.99Å; L347-V382 HydrophobicContact CB-CG2 3.6Å; L379-V382 HydrophobicContact CB-CG2 4Å; L379-V382 HydrophobicContact CD1-CG2 4.2Å; V382-Q386 HydrophobicContact CG1-CB 4Å; V382-V418 HydrophobicContact CG1-CG2 3.56Å
383	T	89.7	Confident	90.4	Very high	65 Å²	65	55.8 Å²	55.8	40%	0.399	34%	0.338	S	S	.	.			trans	-107.7	157.4	175.7	62.9	0	0	0	0	111.3	A385 Q386	T383-A385 PolarHBondContact O-N 2.92Å; T383-Q386 WeakPolarHBondContact O-CB 3.49Å; T383-Q386 PolarHBondContact O-N 2.04Å; T383-Q386 PolarHBondContact OG1-OE1 2.82Å
384	K	83.4	Confident	90.7	Very high	98 Å²	98	49.5 Å²	49.5	43%	0.426	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-51.5	-30.3	175	-175	-179.7	177	-174.9	0	114	E343 Q386 A387 H420 S447	E343-K384 WeakPolarHBondContact OE1-CB 3.44Å; E343-K384 PolarHBondContact OE1-N 2.85Å; K384-Q386 PolarHBondContact O-N 2.87Å; K384-A387 WeakPolarHBondContact O-CB 3.31Å; K384-A387 PolarHBondContact O-N 3.05Å; K384-H420 WeakPolarHBondContact CD-NE2 3.24Å; K384-H420 WeakPolarHBondContact CE-NE2 3.5Å; K384-S447 PolarHBondContact NZ-OG 3.28Å
385	A	85.2	Confident	90.9	Very high	95 Å²	95	50 Å²	50	79%	0.785	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-69.7	-14.9	177.8	0	0	0	0	0	114.2	T383	T383-A385 PolarHBondContact O-N 2.92Å
386	Q	88.9	Confident	91	Very high	61 Å²	61	47.4 Å²	47.4	29%	0.285	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-98.3	8.3	177.9	-67.5	161	-52.2	0	0	112.5	V382 T383 K384 Y390	V382-Q386 HydrophobicContact CG1-CB 4Å; T383-Q386 WeakPolarHBondContact O-CB 3.49Å; T383-Q386 PolarHBondContact O-N 2.04Å; T383-Q386 PolarHBondContact OG1-OE1 2.82Å; K384-Q386 PolarHBondContact O-N 2.87Å; Q386-Y390 WeakPolarHBondContact O-CE2 3.46Å; Q386-Y390 PolarHBondContact O-OH 3.29Å
387	A	89	Confident	91	Very high	43 Å²	43	49.4 Å²	49.4	36%	0.355	28%	0.281	S	S	.	.			trans	-69.9	140.1	166.8	0	0	0	0	0	110.3	K384 V416 V418	K384-A387 WeakPolarHBondContact O-CB 3.31Å; K384-A387 PolarHBondContact O-N 3.05Å; A387-V416 WeakPolarHBondContact CA-O 3.37Å; A387-V418 HydrophobicContact CB-CB 4.35Å; A387-V418 HydrophobicContact CB-CG2 3.91Å
388	G	91.3	Very high	90.8	Very high	21 Å²	21	49.1 Å²	49.1	22%	0.216	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	148.2	-166.3	177.5	0	0	0	0	0	114.7	V416	G388-V416 PolarHBondContact N-O 2.72Å; G388-V416 PolarHBondContact O-N 2.74Å
389	T	94.7	Very high	90.4	Very high	75 Å²	75	46.8 Å²	46.8	46%	0.46	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	110.3	-173.7	-51.9	0	0	0	0	111.5
390	Y	94.1	Very high	89.8	Confident	6 Å²	6	45.9 Å²	45.9	2%	0.024	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	129	172.9	-73.9	-100.4	0	0	0	109.6	L349 I365 T366 P367 L377 Q386 S413 T414 V416	L349-Y390 HydrophobicContact CD1-CD1 4.11Å; L349-Y390 HydrophobicContact CD1-CD2 4.42Å; L349-Y390 HydrophobicContact CD1-CG 3.86Å; I365-Y390 WeakPolarHBondContact O-CA 3.42Å; T366-Y390 HydrophobicContact CG2-CD1 4.11Å; T366-Y390 HydrophobicContact CG2-CE1 3.74Å; P367-Y390 HydrophobicContact CG-CD2 4.17Å; P367-Y390 HydrophobicContact CG-CE2 3.84Å; L377-Y390 HydrophobicContact CD2-CD1 3.54Å; L377-Y390 HydrophobicContact CD2-CE1 3.64Å; Q386-Y390 WeakPolarHBondContact O-CE2 3.46Å; Q386-Y390 PolarHBondContact O-OH 3.29Å; Y390-S413 CarbonylContact O-C 3.57Å; Y390-S413 WeakPolarHBondContact O-CA 3.39Å; Y390-T414 PolarHBondContact N-O 2.98Å; Y390-T414 PolarHBondContact O-N 2.94Å; Y390-V416 HydrophobicContact CD2-CB 3.8Å; Y390-V416 HydrophobicContact CD2-CG2 3.36Å; Y390-V416 HydrophobicContact CE2-CB 3.76Å; Y390-V416 HydrophobicContact CE2-CG1 4.38Å; Y390-V416 HydrophobicContact CE2-CG2 3.67Å; Y390-V416 HydrophobicContact CG-CG2 4.17Å
391	T	95.4	Very high	88.9	Confident	30 Å²	30	44.8 Å²	44.8	18%	0.184	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	117.4	-174.6	-57.9	0	0	0	0	111.1	W364 I365 I393 S413	W364-T391 CarbonylContact C-O 3.54Å; W364-T391 WeakPolarHBondContact CA-O 3.47Å; I365-T391 PolarHBondContact N-O 2.78Å; I365-T391 PolarHBondContact O-N 3.03Å; T391-I393 HydrophobicContact CG2-CG1 4.26Å; T391-S413 WeakPolarHBondContact CG2-OG 3.35Å; T391-S413 PolarHBondContact OG1-OG 2.86Å
392	C	95.2	Very high	87.9	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	139.7	166.4	179	0	0	0	0	109.8	C351 W364 S411 K412	C351-C392 HydrophobicContact CB-CB 3.71Å; C351-C392 WeakPolarHBondContact CB-SG 3.28Å; C351-C392 WeakPolarHBondContact SG-CB 3.11Å; C351-C392 CovalentContact SG-SG 2.02Å; C351-C392 PolarHBondContact SG-SG 3.2Å; W364-C392 HydrophobicContact CD2-CB 4.18Å; W364-C392 HydrophobicContact CE3-CB 4.05Å; W364-C392 HydrophobicContact CH2-CB 4.1Å; W364-C392 HydrophobicContact CZ2-CB 4.21Å; W364-C392 HydrophobicContact CZ3-CB 4.01Å; C392-S411 CarbonylContact O-C 3.56Å; C392-S411 WeakPolarHBondContact O-CA 3.43Å; C392-K412 PolarHBondContact N-O 2.91Å; C392-K412 PolarHBondContact O-N 2.89Å
393	I	94.7	Very high	86.7	Confident	23 Å²	23	54.4 Å²	54.4	12%	0.118	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	130.5	170.5	-52.4	-174.3	0	0	0	108.9	V362 S363 I365 T391 V409 A410	V362-I393 WeakPolarHBondContact CA-O 3.43Å; S363-I393 PolarHBondContact N-O 3.05Å; S363-I393 PolarHBondContact O-N 3.49Å; I365-I393 HydrophobicContact CD1-CD1 3.56Å; I365-I393 HydrophobicContact CD1-CG1 4.46Å; I365-I393 HydrophobicContact CG1-CD1 4.21Å; T391-I393 HydrophobicContact CG2-CG1 4.26Å; I393-V409 HydrophobicContact CG2-CG1 3.67Å; I393-A410 WeakPolarHBondContact CA-O 3.1Å
394	A	95	Very high	86	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	145.7	174.9	0	0	0	0	0	111	P331 I333 V353 I361 V362 V409 A410	P331-A394 HydrophobicContact CB-CB 3.74Å; P331-A394 HydrophobicContact CG-CB 4.27Å; I333-A394 HydrophobicContact CD1-CB 4.21Å; V353-A394 HydrophobicContact CG1-CB 3.74Å; V353-A394 HydrophobicContact CG2-CB 4.05Å; I361-A394 WeakPolarHBondContact O-CA 3.26Å; V362-A394 HydrophobicContact CG2-CB 4.32Å; A394-V409 WeakPolarHBondContact O-CA 3.05Å; A394-A410 PolarHBondContact N-O 2.6Å; A394-A410 PolarHBondContact O-N 2.85Å
395	R	94.3	Very high	85.8	Confident	63 Å²	63	59 Å²	59	24%	0.238	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	130.9	-179.5	-53.5	-172.1	172.5	73	-1.2	112.2	P359 Y360 I361 R408 V409	P359-R395 CarbonylContact C-O 3.57Å; P359-R395 WeakPolarHBondContact CA-O 3.06Å; P359-R395 WeakPolarHBondContact CB-O 3.36Å; Y360-R395 HydrophobicContact CD1-CB 4.49Å; Y360-R395 WeakPolarHBondContact CD1-O 3.34Å; Y360-R395 HydrophobicContact CE1-CB 3.61Å; Y360-R395 WeakPolarHBondContact CE1-O 3.33Å; Y360-R395 PolarHBondContact N-O 2.83Å; Y360-R395 WeakPolarHBondContact OH-CB 3.15Å; Y360-R395 WeakPolarHBondContact OH-CD 3.47Å; I361-R395 HydrophobicContact CB-CB 4.4Å; I361-R395 PolarHBondContact O-N 2.89Å; R395-R408 WeakPolarHBondContact CA-O 3.06Å; R395-V409 HydrophobicContact CG-CB 4.42Å; R395-V409 HydrophobicContact CG-CG1 4.1Å; R395-V409 HydrophobicContact CG-CG2 3.96Å
396	N	93.2	Very high	85.7	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	171.5	166.3	76.8	-16.5	0	0	0	111.2	Y329 P331 P357 L398 E407 R408	Y329-N396 PolarHBondContact O-ND2 2.87Å; P331-N396 WeakPolarHBondContact CD-OD1 3.44Å; P331-N396 HydrophobicContact CG-CB 4.33Å; P357-N396 WeakPolarHBondContact O-CB 3.3Å; P357-N396 PolarHBondContact O-ND2 2.86Å; N396-L398 VanDerWaalsContact OD1-CD1 3.31Å; N396-L398 WeakPolarHBondContact OD1-CD1 3.32Å; N396-E407 WeakPolarHBondContact O-CA 3.36Å; N396-R408 PolarHBondContact N-O 2.8Å; N396-R408 VanDerWaalsContact N-O 3.17Å; N396-R408 PolarHBondContact O-N 3.24Å
397	R	90.7	Very high	85.8	Confident	131 Å²	131	57.9 Å²	57.9	49%	0.494	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	118.4	179.7	-74.4	-179.3	178.8	162.6	2	109.9	P357 Y360 T406 E407	P357-R397 WeakPolarHBondContact CG-O 3.5Å; Y360-R397 HydrophobicContact CD1-CG 4.36Å; Y360-R397 HydrophobicContact CE1-CG 3.9Å; R397-T406 WeakPolarHBondContact CA-O 3.46Å; R397-E407 HydrophobicContact CG-CB 4.37Å; R397-E407 HydrophobicContact CG-CG 4.12Å; R397-E407 IonicContact CZ-OE2 3.58Å; R397-E407 IonicContact NE-OE2 3.75Å; R397-E407 PolarHBondContact NE-OE2 2.95Å; R397-E407 IonicContact NH2-OE2 3.07Å; R397-E407 PolarHBondContact NH2-OE2 2.94Å
398	L	87.7	Confident	85.8	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	146.1	-179.8	-77.9	60.5	0	0	0	109.6	E258 Q328 N396 S405 T406 R408	E258-L398 HydrophobicContact CB-CD2 4.48Å; E258-L398 HydrophobicContact CG-CD2 3.93Å; E258-L398 WeakPolarHBondContact OE1-CD2 3.48Å; Q328-L398 HydrophobicContact CB-CG 4.18Å; Q328-L398 VanDerWaalsContact OE1-CA 3.29Å; N396-L398 VanDerWaalsContact OD1-CD1 3.31Å; N396-L398 WeakPolarHBondContact OD1-CD1 3.32Å; L398-S405 WeakPolarHBondContact O-CA 3.37Å; L398-S405 WeakPolarHBondContact O-CB 3.35Å; L398-S405 PolarHBondContact O-OG 2.88Å; L398-T406 PolarHBondContact N-O 2.99Å; L398-T406 PolarHBondContact O-N 2.95Å; L398-T406 VanDerWaalsContact O-N 3.1Å; L398-R408 HydrophobicContact CD1-CB 4.22Å; L398-R408 HydrophobicContact CD1-CG 3.65Å; L398-R408 HydrophobicContact CD2-CG 4.09Å; L398-R408 HydrophobicContact CG-CG 4.47Å
399	T	81.5	Confident	85.9	Confident	75 Å²	75	61 Å²	61	46%	0.46	31%	0.308	S	S	.	.			trans	-131.6	58.5	-179.2	59.7	0	0	0	0	109.9	S256 Q328	S256-T399 WeakPolarHBondContact CB-O 3.18Å; Q328-T399 PolarHBondContact NE2-OG1 2.99Å; Q328-T399 VanDerWaalsContact NE2-OG1 3.11Å
400	V	76.5	Confident	85.7	Confident	15 Å²	15	58.5 Å²	58.5	9%	0.091	30%	0.295	C	S	.	.			trans	-63.3	137.9	173.3	-171.8	0	0	0	0	109.2	E258 Q403	E258-V400 HydrophobicContact CB-CG2 3.85Å; V400-Q403 PolarHBondContact O-N 3.04Å
401	M	67.8	Low	85.7	Confident	72 Å²	72	62.2 Å²	62.2	36%	0.355	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	151.4	177.8	-55.7	-144.4	-49.9	0	0	111.7	P251 Y255 Q403	P251-M401 HydrophobicContact CB-CE 3.71Å; P251-M401 HydrophobicContact CG-CE 3.57Å; Y255-M401 HydrophobicContact CD2-CE 3.86Å; Y255-M401 HydrophobicContact CD2-CG 4.44Å; Y255-M401 HydrophobicContact CE2-CE 4.34Å; M401-Q403 PolarHBondContact O-N 3.12Å; M401-Q403 VanDerWaalsContact O-N 3.11Å
402	D	66.3	Low	85.6	Confident	169 Å²	169	64.9 Å²	64.9	90%	0.904	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	12.3	-176.3	-52.7	-42.8	0	0	0	115.9
403	Q	66.6	Low	85.6	Confident	100 Å²	100	67.4 Å²	67.4	47%	0.467	35%	0.349	S	S	.	.	S	Bend	trans	-127.3	153.7	176.3	-62.1	-167.8	-23.5	0	0	112.2	R261 V400 M401	R261-Q403 VanDerWaalsContact NH1-CD 3.3Å; V400-Q403 PolarHBondContact O-N 3.04Å; M401-Q403 PolarHBondContact O-N 3.12Å; M401-Q403 VanDerWaalsContact O-N 3.11Å
404	K	73.8	Confident	85.6	Confident	191 Å²	191	66.4 Å²	66.4	83%	0.83	34%	0.343	S	S	*	.			trans	-63	145.5	167.8	-73.3	-177.1	177	178.9	0	108.7	T406	K404-T406 PolarHBondContact O-N 3.04Å
405	S	79.9	Confident	85.5	Confident	68 Å²	68	69.1 Å²	69.1	48%	0.476	36%	0.36	S	S	.	.			trans	-57.8	132.6	172.6	-176.9	0	0	0	0	109.9	L398	L398-S405 WeakPolarHBondContact O-CA 3.37Å; L398-S405 WeakPolarHBondContact O-CB 3.35Å; L398-S405 PolarHBondContact O-OG 2.88Å
406	T	83.8	Confident	85.4	Confident	51 Å²	51	66.1 Å²	66.1	31%	0.313	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	136.3	-179.6	56.2	0	0	0	0	110.2	R397 L398 K404 R408	R397-T406 WeakPolarHBondContact CA-O 3.46Å; L398-T406 PolarHBondContact N-O 2.99Å; L398-T406 PolarHBondContact O-N 2.95Å; L398-T406 VanDerWaalsContact O-N 3.1Å; K404-T406 PolarHBondContact O-N 3.04Å; T406-R408 VanDerWaalsContact CB-NH1 3.33Å; T406-R408 PolarHBondContact OG1-NH1 2.8Å; T406-R408 PolarHBondContact OG1-NH2 2.97Å
407	E	89.8	Confident	85.3	Confident	82 Å²	82	67.7 Å²	67.7	38%	0.383	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	146.2	173.1	-154	156.2	106.4	0	0	109.4	Y360 N396 R397	Y360-E407 HydrophobicContact CE1-CG 4.43Å; Y360-E407 PolarHBondContact OH-OE1 3Å; Y360-E407 VanDerWaalsContact OH-OE1 3.07Å; Y360-E407 PolarHBondContact OH-OE2 2.82Å; N396-E407 WeakPolarHBondContact O-CA 3.36Å; R397-E407 HydrophobicContact CG-CB 4.37Å; R397-E407 HydrophobicContact CG-CG 4.12Å; R397-E407 IonicContact CZ-OE2 3.58Å; R397-E407 IonicContact NE-OE2 3.75Å; R397-E407 PolarHBondContact NE-OE2 2.95Å; R397-E407 IonicContact NH2-OE2 3.07Å; R397-E407 PolarHBondContact NH2-OE2 2.94Å
408	R	89.9	Confident	85.3	Confident	53 Å²	53	61.7 Å²	61.7	20%	0.2	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	141.2	165.8	-65.5	-75.1	179.2	-72	-8.7	108	E258 E330 R395 N396 L398 T406	E258-R408 IonicContact OE1-CZ 2.63Å; E258-R408 IonicContact OE1-NE 2.77Å; E258-R408 PolarHBondContact OE1-NE 2.63Å; E258-R408 IonicContact OE1-NH2 3.76Å; E258-R408 PolarHBondContact OE1-NH2 2.89Å; E258-R408 IonicContact OE2-NH2 2.82Å; E330-R408 HydrophobicContact CB-CB 3.58Å; E330-R408 HydrophobicContact CB-CG 3.74Å; E330-R408 WeakPolarHBondContact OE2-CD 3.33Å; R395-R408 WeakPolarHBondContact CA-O 3.06Å; N396-R408 PolarHBondContact N-O 2.8Å; N396-R408 VanDerWaalsContact N-O 3.17Å; N396-R408 PolarHBondContact O-N 3.24Å; L398-R408 HydrophobicContact CD1-CB 4.22Å; L398-R408 HydrophobicContact CD1-CG 3.65Å; L398-R408 HydrophobicContact CD2-CG 4.09Å; L398-R408 HydrophobicContact CG-CG 4.47Å; T406-R408 VanDerWaalsContact CB-NH1 3.33Å; T406-R408 PolarHBondContact OG1-NH1 2.8Å; T406-R408 PolarHBondContact OG1-NH2 2.97Å
409	V	92.5	Very high	85.5	Confident	76 Å²	76	62.2 Å²	62.2	46%	0.461	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	122.9	-175.9	-176.3	0	0	0	0	107.3	I393 A394 R395	I393-V409 HydrophobicContact CG2-CG1 3.67Å; A394-V409 WeakPolarHBondContact O-CA 3.05Å; R395-V409 HydrophobicContact CG-CB 4.42Å; R395-V409 HydrophobicContact CG-CG1 4.1Å; R395-V409 HydrophobicContact CG-CG2 3.96Å
410	A	92.3	Very high	85.9	Confident	23 Å²	23	59.8 Å²	59.8	19%	0.19	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	148.1	171.1	0	0	0	0	0	109.8	P331 I333 I393 A394	P331-A410 HydrophobicContact CB-CB 4.16Å; P331-A410 WeakPolarHBondContact O-CB 3.4Å; I333-A410 HydrophobicContact CD1-CB 4.03Å; I333-A410 HydrophobicContact CG1-CB 4.3Å; I393-A410 WeakPolarHBondContact CA-O 3.1Å; A394-A410 PolarHBondContact N-O 2.6Å; A394-A410 PolarHBondContact O-N 2.85Å
411	S	93.5	Very high	86.6	Confident	84 Å²	84	64 Å²	64	59%	0.587	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.6	137.4	176.2	56.3	0	0	0	0	110.4	C392	C392-S411 CarbonylContact O-C 3.56Å; C392-S411 WeakPolarHBondContact O-CA 3.43Å
412	K	93.8	Very high	87.8	Confident	85 Å²	85	60.7 Å²	60.7	37%	0.37	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	140	177.1	-170.3	172.5	-179.8	166.9	0	109.8	I333 L335 C392	I333-K412 HydrophobicContact CB-CB 3.94Å; I333-K412 HydrophobicContact CB-CD 4.07Å; I333-K412 HydrophobicContact CD1-CB 4.26Å; I333-K412 HydrophobicContact CG2-CB 3.86Å; I333-K412 HydrophobicContact CG2-CD 4.12Å; I333-K412 WeakPolarHBondContact O-CD 3.2Å; I333-K412 WeakPolarHBondContact O-CE 3.3Å; I333-K412 PolarHBondContact O-NZ 2.97Å; L335-K412 HydrophobicContact CB-CD 4.14Å; L335-K412 HydrophobicContact CB-CG 4.41Å; C392-K412 PolarHBondContact N-O 2.91Å; C392-K412 PolarHBondContact O-N 2.89Å
413	S	94.3	Very high	89	Confident	54 Å²	54	53.5 Å²	53.5	38%	0.378	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	151.8	-173	-47.8	0	0	0	0	112.1	Y390 T391	Y390-S413 CarbonylContact O-C 3.57Å; Y390-S413 WeakPolarHBondContact O-CA 3.39Å; T391-S413 WeakPolarHBondContact CG2-OG 3.35Å; T391-S413 PolarHBondContact OG1-OG 2.86Å
414	T	94.1	Very high	90.3	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.006	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	141.8	170.6	-169.2	0	0	0	0	109.2	L335 L336 L349 W364 Y390	L335-T414 HydrophobicContact CD2-CG2 3.98Å; L335-T414 HydrophobicContact CG-CG2 4.39Å; L336-T414 WeakPolarHBondContact O-CB 3.3Å; L336-T414 PolarHBondContact O-OG1 3.3Å; L349-T414 HydrophobicContact CD1-CG2 4.01Å; L349-T414 HydrophobicContact CD2-CG2 4.21Å; W364-T414 HydrophobicContact CH2-CG2 4.24Å; W364-T414 HydrophobicContact CZ3-CG2 4.18Å; Y390-T414 PolarHBondContact N-O 2.98Å; Y390-T414 PolarHBondContact O-N 2.94Å
415	T	94.1	Very high	91.3	Very high	57 Å²	57	42.5 Å²	42.5	35%	0.35	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	116.3	173.8	-55.5	0	0	0	0	109.2	S337 E338 V339 I417	S337-T415 PolarHBondContact O-N 3.09Å; E338-T415 CarbonylContact C-O 3.52Å; E338-T415 WeakPolarHBondContact CA-O 3.37Å; V339-T415 PolarHBondContact N-O 3.37Å; T415-I417 HydrophobicContact CG2-CD1 4.39Å; T415-I417 HydrophobicContact CG2-CG1 3.89Å
416	V	92.3	Very high	92	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.006	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	119.4	170.4	175.2	0	0	0	0	108.5	V339 V341 L347 L349 A387 G388 Y390	V339-V416 WeakPolarHBondContact O-CA 3.4Å; V341-V416 HydrophobicContact CG1-CG1 4.08Å; L347-V416 HydrophobicContact CD1-CG1 4.47Å; L347-V416 HydrophobicContact CD2-CG1 3.93Å; L347-V416 HydrophobicContact CD2-CG2 3.93Å; L349-V416 HydrophobicContact CD1-CG2 3.94Å; L349-V416 HydrophobicContact CD2-CG2 4.38Å; A387-V416 WeakPolarHBondContact CA-O 3.37Å; G388-V416 PolarHBondContact N-O 2.72Å; G388-V416 PolarHBondContact O-N 2.74Å; Y390-V416 HydrophobicContact CD2-CB 3.8Å; Y390-V416 HydrophobicContact CD2-CG2 3.36Å; Y390-V416 HydrophobicContact CE2-CB 3.76Å; Y390-V416 HydrophobicContact CE2-CG1 4.38Å; Y390-V416 HydrophobicContact CE2-CG2 3.67Å; Y390-V416 HydrophobicContact CG-CG2 4.17Å
417	I	91.1	Very high	92.6	Very high	33 Å²	33	41.5 Å²	41.5	17%	0.169	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	124.6	175.7	-52.2	-171.6	0	0	0	109.5	E338 V339 I340 V341 T415 Y450	E338-I417 VanDerWaalsContact CD-CD1 3.43Å; E338-I417 HydrophobicContact CG-CD1 3.89Å; E338-I417 HydrophobicContact CG-CG1 4.09Å; E338-I417 WeakPolarHBondContact OE1-CD1 3.08Å; V339-I417 PolarHBondContact O-N 2.89Å; I340-I417 WeakPolarHBondContact CA-O 3.46Å; V341-I417 PolarHBondContact N-O 3Å; T415-I417 HydrophobicContact CG2-CD1 4.39Å; T415-I417 HydrophobicContact CG2-CG1 3.89Å; I417-Y450 HydrophobicContact CB-CE1 4.45Å; I417-Y450 HydrophobicContact CD1-CE2 4.03Å; I417-Y450 HydrophobicContact CG2-CD1 3.61Å; I417-Y450 HydrophobicContact CG2-CD2 3.67Å; I417-Y450 HydrophobicContact CG2-CE1 3.73Å; I417-Y450 HydrophobicContact CG2-CE2 3.76Å; I417-Y450 HydrophobicContact CG2-CG 3.58Å
418	V	90.6	Very high	92.7	Very high	4 Å²	4	41.1 Å²	41.1	2%	0.024	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	110.2	178.6	-176.9	0	0	0	0	108.7	V341 E343 V382 A387 H420	V341-V418 HydrophobicContact CG1-CG2 4.21Å; V341-V418 CarbonylContact O-C 3.55Å; V341-V418 WeakPolarHBondContact O-CA 3.31Å; E343-V418 HydrophobicContact CB-CG1 3.76Å; E343-V418 HydrophobicContact CG-CG1 4.4Å; V382-V418 HydrophobicContact CG1-CG2 3.56Å; A387-V418 HydrophobicContact CB-CB 4.35Å; A387-V418 HydrophobicContact CB-CG2 3.91Å; V418-H420 PolarHBondContact O-CD2 2.95Å; V418-H420 VanDerWaalsContact O-CD2 3.31Å
419	S	90.9	Very high	92.9	Very high	12 Å²	12	39.8 Å²	39.8	8%	0.084	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	123.1	175.2	60.4	0	0	0	0	110.8	V341 K342 E343 Y450	V341-S419 PolarHBondContact O-N 2.95Å; V341-S419 PolarHBondContact O-OG 2.81Å; K342-S419 VanDerWaalsContact CA-OG 3.32Å; K342-S419 WeakPolarHBondContact CA-OG 3.34Å; E343-S419 PolarHBondContact N-O 2.86Å; S419-Y450 VanDerWaalsContact CA-O 3.27Å; S419-Y450 WeakPolarHBondContact CA-O 3.39Å; S419-Y450 VanDerWaalsContact CB-O 3.32Å; S419-Y450 WeakPolarHBondContact CB-O 3.34Å
420	H	89.9	Confident	92.7	Very high	24 Å²	24	42.5 Å²	42.5	11%	0.111	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-148.4	158	-174.6	70.1	76.4	0	0	0	110.5	E343 K384 V418 S447 G449 Y450 N492	E343-H420 HydrophobicContact CB-CB 4.37Å; K384-H420 WeakPolarHBondContact CD-NE2 3.24Å; K384-H420 WeakPolarHBondContact CE-NE2 3.5Å; V418-H420 PolarHBondContact O-CD2 2.95Å; V418-H420 VanDerWaalsContact O-CD2 3.31Å; H420-S447 PolarHBondContact CE1-OG 2.85Å; H420-G449 VanDerWaalsContact CE1-CA 3.49Å; H420-G449 WeakPolarHBondContact CE1-CA 3.42Å; H420-Y450 PolarHBondContact N-O 2.98Å; H420-Y450 VanDerWaalsContact N-O 3.16Å; H420-Y450 PolarHBondContact O-N 2.78Å; H420-N492 PolarHBondContact O-ND2 2.93Å
421	Q	91.7	Very high	92.3	Very high	103 Å²	103	47.3 Å²	47.3	48%	0.481	26%	0.264	S	S	.	.			trans	-68.9	161.3	177.6	68.2	-178.8	42	0	0	112.3	N496	Q421-N496 PolarHBondContact NE2-O 2.6Å
422	P	93.1	Very high	91.8	Very high	4 Å²	4	47 Å²	47	3%	0.026	26%	0.261	C	S	.	.			trans	-66.9	163.7	174.6	-19.7	35.2	0	0	0	112.8	S447 A453 P490 N492 G495 G497	P422-S447 CarbonylContact C-O 3.59Å; P422-S447 WeakPolarHBondContact CA-O 3.25Å; P422-A453 HydrophobicContact CB-CB 4.01Å; P422-A453 HydrophobicContact CG-CB 3.72Å; P422-P490 HydrophobicContact CB-CB 3.8Å; P422-P490 HydrophobicContact CB-CG 4.15Å; P422-P490 HydrophobicContact CG-CB 4.3Å; P422-N492 HydrophobicContact CG-CB 4.27Å; P422-G495 WeakPolarHBondContact CD-O 3.39Å; P422-G497 WeakPolarHBondContact O-CA 3.37Å
423	G	91.4	Very high	91.6	Very high	18 Å²	18	43.4 Å²	43.4	19%	0.186	25%	0.245	C	C	.	.			trans	-90	-137.5	175.8	0	0	0	0	0	113.8	D446 S447 G497 Q498	G423-D446 VanDerWaalsContact CA-OD1 3.23Å; G423-D446 WeakPolarHBondContact CA-OD1 3.22Å; G423-S447 PolarHBondContact N-O 2.03Å; G423-G497 CarbonylContact O-C 3.58Å; G423-G497 VanDerWaalsContact O-CA 3.31Å; G423-G497 WeakPolarHBondContact O-CA 3.24Å; G423-Q498 PolarHBondContact O-N 2.87Å
424	V	94.2	Very high	91.5	Very high	53 Å²	53	42.5 Å²	42.5	32%	0.321	24%	0.237	S	C	.	.	B	Isolated β-bridge	trans	-86.5	134.2	-176.5	-168.4	0	0	0	0	110.7	A445 D446 Q498	V424-A445 VanDerWaalsContact O-CA 3.26Å; V424-A445 WeakPolarHBondContact O-CA 3.05Å; V424-D446 PolarHBondContact N-OD1 2.9Å; V424-D446 PolarHBondContact O-N 2.91Å; V424-D446 VanDerWaalsContact O-N 3.13Å; V424-Q498 HydrophobicContact CG2-CB 4.37Å
425	A	94.8	Very high	91.4	Very high	7 Å²	7	44.8 Å²	44.8	6%	0.058	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	137.9	174.8	0	0	0	0	0	112.2	S444 C488 P490 Q498	A425-S444 CarbonylContact C-O 3.57Å; A425-S444 WeakPolarHBondContact CA-O 3.27Å; A425-C488 HydrophobicContact CB-CB 4.3Å; A425-C488 WeakPolarHBondContact CB-O 3.4Å; A425-P490 HydrophobicContact CB-CG 4.2Å; A425-Q498 PolarHBondContact N-O 2.86Å; A425-Q498 VanDerWaalsContact N-O 3.1Å
426	I	94.5	Very high	91.1	Very high	81 Å²	81	44.2 Å²	44.2	42%	0.415	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	122	172.9	-57.8	172.8	0	0	0	107.9	C443 S444 D446	I426-C443 WeakPolarHBondContact O-CA 3.25Å; I426-S444 PolarHBondContact N-O 3.28Å; I426-S444 PolarHBondContact O-N 2.95Å; I426-S444 PolarHBondContact O-OG 3.05Å; I426-D446 HydrophobicContact CD1-CB 4.22Å
427	I	95	Very high	91	Very high	17 Å²	17	46.1 Å²	46.1	9%	0.087	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	136.4	178.4	-60.8	164.8	0	0	0	109.5	L441 N442 C443 W457 C488 G500 Y502	I427-L441 HydrophobicContact CG2-CB 4.09Å; I427-L441 HydrophobicContact CG2-CD2 4.17Å; I427-N442 CarbonylContact C-O 3.46Å; I427-N442 VanDerWaalsContact CA-O 3.26Å; I427-N442 WeakPolarHBondContact CA-O 3.48Å; I427-C443 HydrophobicContact CG1-CB 4.4Å; I427-W457 HydrophobicContact CD1-CH2 4.47Å; I427-W457 HydrophobicContact CD1-CZ3 3.85Å; I427-W457 HydrophobicContact CG1-CH2 4.12Å; I427-W457 HydrophobicContact CG1-CZ3 4Å; I427-W457 HydrophobicContact CG2-CH2 3.99Å; I427-W457 HydrophobicContact CG2-CZ3 4.07Å; I427-C488 HydrophobicContact CD1-CB 3.77Å; I427-C488 HydrophobicContact CG1-CB 3.84Å; I427-G500 WeakPolarHBondContact CD1-O 3.34Å; I427-Y502 HydrophobicContact CG2-CG 4.14Å
428	T	93.6	Very high	91.1	Very high	74 Å²	74	49 Å²	49	45%	0.454	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	156	175.6	59.2	0	0	0	0	111.5	L441 N442	T428-L441 CarbonylContact O-C 3.55Å; T428-L441 WeakPolarHBondContact O-CA 3.48Å; T428-N442 PolarHBondContact N-O 2.9Å; T428-N442 PolarHBondContact O-N 2.84Å
429	V	92.8	Very high	91.1	Very high	24 Å²	24	49.3 Å²	49.3	15%	0.145	29%	0.292	C	S	.	.			trans	-152.2	156.5	178.6	75.6	0	0	0	0	109.6	E431 V433 V439 L441 Y502	V429-E431 HydrophobicContact CG1-CG 4.18Å; V429-V433 HydrophobicContact CG2-CG2 4.34Å; V429-V439 HydrophobicContact CG2-CG2 3.22Å; V429-L441 HydrophobicContact CG2-CG 4.35Å; V429-Y502 HydrophobicContact CB-CE1 4.38Å; V429-Y502 HydrophobicContact CG1-CE1 3.56Å; V429-Y502 HydrophobicContact CG1-CE2 4.22Å; V429-Y502 VanDerWaalsContact CG1-CZ 3.4Å; V429-Y502 WeakPolarHBondContact CG1-OH 3.27Å
430	D	88.5	Confident	91.3	Very high	133 Å²	133	50.7 Å²	50.7	71%	0.711	30%	0.299	S	S	*	.			trans	-83.2	126.8	172.5	-57	-50.3	0	0	0	110.3	V433	D430-V433 WeakPolarHBondContact O-CG2 3.18Å
431	E	83.1	Confident	91.5	Very high	125 Å²	125	49.5 Å²	49.5	58%	0.584	29%	0.294	S	S	*	.	S	Bend	trans	-112.4	150.5	178.9	-74.1	-168.9	-141.4	0	0	112	V429 Y502	V429-E431 HydrophobicContact CG1-CG 4.18Å; E431-Y502 PolarHBondContact OE1-OH 3.3Å
432	P	84.3	Confident	91.7	Very high	78 Å²	78	47.3 Å²	47.3	51%	0.506	29%	0.286	S	S	.	.	S	Bend	cis	-83.4	141.8	0.2	33.2	-34.4	0	0	0	113.1
433	V	90.1	Very high	91.8	Very high	8 Å²	8	47.5 Å²	47.5	5%	0.048	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	122.8	175.3	-175.8	0	0	0	0	110	V429 D430 V439 V478 L504 V506 R507	V429-V433 HydrophobicContact CG2-CG2 4.34Å; D430-V433 WeakPolarHBondContact O-CG2 3.18Å; V433-V439 HydrophobicContact CG1-CB 4.09Å; V433-V439 HydrophobicContact CG1-CG1 4.43Å; V433-V439 HydrophobicContact CG1-CG2 4.11Å; V433-V439 HydrophobicContact CG2-CG2 3.76Å; V433-V478 HydrophobicContact CG1-CG1 3.99Å; V433-L504 HydrophobicContact CB-CD1 4.47Å; V433-L504 HydrophobicContact CG1-CD1 4.41Å; V433-L504 HydrophobicContact CG2-CD1 3.98Å; V433-V506 HydrophobicContact CG1-CG2 4.44Å; V433-R507 PolarHBondContact O-N 3.21Å
434	V	91.2	Very high	91.9	Very high	35 Å²	35	49.1 Å²	49.1	21%	0.212	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	148.8	-173.8	-174.6	0	0	0	0	110.4	G436 A437 R507 P509	V434-G436 PolarHBondContact O-N 3.33Å; V434-A437 WeakPolarHBondContact O-CB 3.18Å; V434-A437 PolarHBondContact O-N 3.08Å; V434-R507 WeakPolarHBondContact CA-O 3.4Å; V434-P509 HydrophobicContact CG1-CG 3.5Å; V434-P509 VanDerWaalsContact CG1-CG 3.5Å
435	I	91.5	Very high	91.8	Very high	50 Å²	50	47.4 Å²	47.4	26%	0.256	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	139.4	174.6	-64.8	179.6	0	0	0	111.4	A437 V478 L480 V506 R507 E508	I435-A437 PolarHBondContact O-N 3.14Å; I435-V478 CarbonylContact C-O 3.57Å; I435-V478 VanDerWaalsContact CA-O 3.24Å; I435-V478 WeakPolarHBondContact CA-O 3.16Å; I435-L480 HydrophobicContact CD1-CD1 4.05Å; I435-L480 HydrophobicContact CD1-CD2 4.33Å; I435-L480 HydrophobicContact CD1-CG 3.76Å; I435-L480 HydrophobicContact CG1-CG 4.27Å; I435-V506 HydrophobicContact CG1-CG1 4.1Å; I435-R507 PolarHBondContact N-O 2.91Å; I435-E508 HydrophobicContact CD1-CB 3.64Å; I435-E508 HydrophobicContact CD1-CG 3.8Å; I435-E508 HydrophobicContact CG1-CB 4.38Å
436	G	89.2	Confident	91.6	Very high	44 Å²	44	52 Å²	52	45%	0.454	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	-9.4	178.5	0	0	0	0	0	114.8	V434 V478	V434-G436 PolarHBondContact O-N 3.33Å; G436-V478 PolarHBondContact N-O 2.94Å
437	A	89.1	Confident	91.4	Very high	41 Å²	41	49.2 Å²	49.2	34%	0.339	30%	0.298	S	S	.	.			trans	-66.5	163	169.3	0	0	0	0	0	111.3	V434 I435 D477 V478	V434-A437 WeakPolarHBondContact O-CB 3.18Å; V434-A437 PolarHBondContact O-N 3.08Å; I435-A437 PolarHBondContact O-N 3.14Å; A437-D477 PolarHBondContact O-N 3.15Å; A437-V478 WeakPolarHBondContact O-CG2 3.3Å; A437-V478 PolarHBondContact O-N 2.79Å
438	T	92.5	Very high	91	Very high	94 Å²	94	50.8 Å²	50.8	58%	0.577	31%	0.314	S	S	*	.			trans	-103.8	113.1	162.8	-63.6	0	0	0	0	107.8	T474 I475	T438-T474 HydrophobicContact CG2-CG2 3.71Å; T438-I475 WeakPolarHBondContact CA-O 3.38Å
439	V	92.6	Very high	90.7	Very high	11 Å²	11	47.9 Å²	47.9	7%	0.067	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	147.1	179.8	73.7	0	0	0	0	110.2	V429 V433 L441 T474 I475 V478	V429-V439 HydrophobicContact CG2-CG2 3.22Å; V433-V439 HydrophobicContact CG1-CB 4.09Å; V433-V439 HydrophobicContact CG1-CG1 4.43Å; V433-V439 HydrophobicContact CG1-CG2 4.11Å; V433-V439 HydrophobicContact CG2-CG2 3.76Å; V439-L441 HydrophobicContact CG1-CD1 4.49Å; V439-T474 CarbonylContact O-C 3.58Å; V439-T474 WeakPolarHBondContact O-CA 3.37Å; V439-I475 HydrophobicContact CG1-CB 3.94Å; V439-I475 HydrophobicContact CG1-CD1 4.19Å; V439-I475 HydrophobicContact CG1-CG1 4.34Å; V439-I475 PolarHBondContact N-O 2.6Å; V439-I475 PolarHBondContact O-N 2.86Å; V439-V478 HydrophobicContact CB-CG2 3.94Å; V439-V478 HydrophobicContact CG1-CG2 3.44Å; V439-V478 VanDerWaalsContact CG1-CG2 3.44Å
440	T	94.7	Very high	90.6	Very high	40 Å²	40	50 Å²	50	25%	0.245	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	118	170.8	-62.2	0	0	0	0	110.1	T472 Y473 T474	T440-T472 HydrophobicContact CG2-CG2 4.04Å; T440-Y473 WeakPolarHBondContact CA-O 3.49Å; T440-T474 WeakPolarHBondContact CG2-OG1 3.36Å; T440-T474 WeakPolarHBondContact OG1-CG2 3.31Å; T440-T474 PolarHBondContact OG1-OG1 2.69Å
441	L	94.5	Very high	90.7	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	126.4	168.8	-57.5	85.3	0	0	0	107.8	I427 T428 V429 V439 W457 T472 Y473 I475 Y486 Y502	I427-L441 HydrophobicContact CG2-CB 4.09Å; I427-L441 HydrophobicContact CG2-CD2 4.17Å; T428-L441 CarbonylContact O-C 3.55Å; T428-L441 WeakPolarHBondContact O-CA 3.48Å; V429-L441 HydrophobicContact CG2-CG 4.35Å; V439-L441 HydrophobicContact CG1-CD1 4.49Å; L441-W457 HydrophobicContact CB-CH2 3.66Å; L441-W457 HydrophobicContact CB-CZ3 3.95Å; L441-W457 HydrophobicContact CD2-CZ3 4.45Å; L441-W457 WeakPolarHBondContact O-CZ2 3.23Å; L441-T472 CarbonylContact O-C 3.59Å; L441-T472 WeakPolarHBondContact O-CA 3.38Å; L441-Y473 HydrophobicContact CD1-CD1 4.34Å; L441-Y473 PolarHBondContact N-O 3.07Å; L441-Y473 PolarHBondContact O-N 2.89Å; L441-I475 HydrophobicContact CD1-CD1 4.18Å; L441-Y486 HydrophobicContact CD2-CD2 4.18Å; L441-Y486 HydrophobicContact CD2-CG 3.98Å; L441-Y502 HydrophobicContact CD2-CD1 4.1Å
442	N	95	Very high	91.1	Very high	57 Å²	57	44.2 Å²	44.2	31%	0.305	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	134.9	178.2	-64	-56.9	0	0	0	109.2	I427 T428 T472	I427-N442 CarbonylContact C-O 3.46Å; I427-N442 VanDerWaalsContact CA-O 3.26Å; I427-N442 WeakPolarHBondContact CA-O 3.48Å; T428-N442 PolarHBondContact N-O 2.9Å; T428-N442 PolarHBondContact O-N 2.84Å; N442-T472 WeakPolarHBondContact OD1-CG2 3.48Å
443	C	94.5	Very high	91.4	Very high	8 Å²	8	41.2 Å²	41.2	5%	0.054	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	137.4	177.8	-179.9	0	0	0	0	111.3	I426 I427 Y455 W457 Y471 C488	I426-C443 WeakPolarHBondContact O-CA 3.25Å; I427-C443 HydrophobicContact CG1-CB 4.4Å; C443-Y455 HydrophobicContact CB-CD1 4.32Å; C443-Y455 WeakPolarHBondContact SG-CD1 3.4Å; C443-W457 HydrophobicContact CB-CH2 3.63Å; C443-W457 HydrophobicContact CB-CZ2 3.33Å; C443-Y471 PolarHBondContact N-O 2.84Å; C443-C488 HydrophobicContact CB-CB 3.77Å; C443-C488 WeakPolarHBondContact CB-SG 3.22Å; C443-C488 WeakPolarHBondContact SG-CB 3.2Å; C443-C488 CovalentContact SG-SG 2.03Å; C443-C488 PolarHBondContact SG-SG 2.78Å
444	S	93.8	Very high	91.6	Very high	51 Å²	51	46.5 Å²	46.5	36%	0.357	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	179.7	175.3	61.3	0	0	0	0	109.6	A425 I426	A425-S444 CarbonylContact C-O 3.57Å; A425-S444 WeakPolarHBondContact CA-O 3.27Å; I426-S444 PolarHBondContact N-O 3.28Å; I426-S444 PolarHBondContact O-N 2.95Å; I426-S444 PolarHBondContact O-OG 3.05Å
445	A	92.8	Very high	91.8	Very high	17 Å²	17	46.4 Å²	46.4	14%	0.14	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	143.9	170.2	0	0	0	0	0	110.3	V424 S447 Y455 P490	V424-A445 VanDerWaalsContact O-CA 3.26Å; V424-A445 WeakPolarHBondContact O-CA 3.05Å; A445-S447 PolarHBondContact O-N 2.9Å; A445-Y455 HydrophobicContact CB-CE1 4.35Å; A445-Y455 PolarHBondContact N-OH 3.04Å; A445-P490 HydrophobicContact CB-CB 4.21Å; A445-P490 HydrophobicContact CB-CG 4.26Å
446	D	91.1	Very high	91.9	Very high	103 Å²	103	46.8 Å²	46.8	55%	0.551	28%	0.28	S	S	*	.	S	Bend	trans	-56.7	-30.6	176	69	-21.3	0	0	0	113	G423 V424 I426	G423-D446 VanDerWaalsContact CA-OD1 3.23Å; G423-D446 WeakPolarHBondContact CA-OD1 3.22Å; V424-D446 PolarHBondContact N-OD1 2.9Å; V424-D446 PolarHBondContact O-N 2.91Å; V424-D446 VanDerWaalsContact O-N 3.13Å; I426-D446 HydrophobicContact CD1-CB 4.22Å
447	S	89.2	Confident	92.1	Very high	23 Å²	23	45 Å²	45	16%	0.161	26%	0.259	C	S	.	.	S	Bend	trans	-136.1	104.6	176.3	164.3	0	0	0	0	108.2	K384 H420 P422 G423 A445 G449	K384-S447 PolarHBondContact NZ-OG 3.28Å; H420-S447 PolarHBondContact CE1-OG 2.85Å; P422-S447 CarbonylContact C-O 3.59Å; P422-S447 WeakPolarHBondContact CA-O 3.25Å; G423-S447 PolarHBondContact N-O 2.03Å; A445-S447 PolarHBondContact O-N 2.9Å; S447-G449 PolarHBondContact O-N 2.88Å
448	A	87.3	Confident	92.4	Very high	51 Å²	51	44.2 Å²	44.2	42%	0.421	25%	0.248	S	C	.	.			trans	-62.7	-12.4	-170.5	0	0	0	0	0	116	A453	A448-A453 VanDerWaalsContact O-CB 3.29Å; A448-A453 WeakPolarHBondContact O-CB 3.42Å; A448-A453 PolarHBondContact O-N 2.92Å
449	G	87.9	Confident	92.3	Very high	12 Å²	12	40.5 Å²	40.5	12%	0.124	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.2	167.4	-172.2	0	0	0	0	0	112.8	H420 S447 P451	H420-G449 VanDerWaalsContact CE1-CA 3.49Å; H420-G449 WeakPolarHBondContact CE1-CA 3.42Å; S447-G449 PolarHBondContact O-N 2.88Å; G449-P451 CarbonylContact C-O 3.54Å
450	Y	89.6	Confident	92.1	Very high	68 Å²	68	41.7 Å²	41.7	27%	0.267	24%	0.235	S	C	.	.	B	Isolated β-bridge	trans	-137.3	120.2	164.4	-171.9	-84.5	0	0	0	109.7	E338 I340 I417 S419 H420 N492	E338-Y450 PolarHBondContact OE1-OH 2.88Å; I340-Y450 HydrophobicContact CD1-CE1 4.05Å; I340-Y450 HydrophobicContact CG1-CE1 4.17Å; I340-Y450 HydrophobicContact CG2-CE1 4.08Å; I417-Y450 HydrophobicContact CB-CE1 4.45Å; I417-Y450 HydrophobicContact CD1-CE2 4.03Å; I417-Y450 HydrophobicContact CG2-CD1 3.61Å; I417-Y450 HydrophobicContact CG2-CD2 3.67Å; I417-Y450 HydrophobicContact CG2-CE1 3.73Å; I417-Y450 HydrophobicContact CG2-CE2 3.76Å; I417-Y450 HydrophobicContact CG2-CG 3.58Å; S419-Y450 VanDerWaalsContact CA-O 3.27Å; S419-Y450 WeakPolarHBondContact CA-O 3.39Å; S419-Y450 VanDerWaalsContact CB-O 3.32Å; S419-Y450 WeakPolarHBondContact CB-O 3.34Å; H420-Y450 PolarHBondContact N-O 2.98Å; H420-Y450 VanDerWaalsContact N-O 3.16Å; H420-Y450 PolarHBondContact O-N 2.78Å; Y450-N492 PolarHBondContact N-ND2 3.49Å
451	P	91	Very high	91.6	Very high	45 Å²	45	43.9 Å²	43.9	29%	0.292	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	cis	-59.3	159.7	-1.7	-23.4	34.8	0	0	0	113.9	G449 N492	G449-P451 CarbonylContact C-O 3.54Å; P451-N492 WeakPolarHBondContact O-CB 3.42Å; P451-N492 PolarHBondContact O-ND2 2.98Å
452	P	91.1	Very high	91.3	Very high	93 Å²	93	46.8 Å²	46.8	60%	0.604	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	145.7	-176.7	-26.7	35.7	0	0	0	114.2
453	A	91.4	Very high	90.9	Very high	15 Å²	15	48.4 Å²	48.4	12%	0.124	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-62.3	136.6	-176.7	0	0	0	0	0	114	P422 A448 Y455 P490	P422-A453 HydrophobicContact CB-CB 4.01Å; P422-A453 HydrophobicContact CG-CB 3.72Å; A448-A453 VanDerWaalsContact O-CB 3.29Å; A448-A453 WeakPolarHBondContact O-CB 3.42Å; A448-A453 PolarHBondContact O-N 2.92Å; A453-Y455 HydrophobicContact CB-CE1 4.28Å; A453-Y455 HydrophobicContact CB-CE2 4.24Å; A453-Y455 VanDerWaalsContact O-CE2 3.32Å; A453-Y455 WeakPolarHBondContact O-CE2 3.4Å; A453-P490 HydrophobicContact CB-CB 4.01Å
454	R	94.4	Very high	90.6	Very high	118 Å²	118	54.1 Å²	54.1	45%	0.445	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	157.8	156.1	-66.4	-178.9	-78.5	162.2	-6.8	108.5	A469 P490 F491 D493	R454-A469 HydrophobicContact CB-CB 3.98Å; R454-A469 HydrophobicContact CG-CB 4.25Å; R454-P490 CarbonylContact O-C 3.49Å; R454-P490 WeakPolarHBondContact O-CA 3.47Å; R454-F491 HydrophobicContact CB-CD1 4.18Å; R454-F491 HydrophobicContact CB-CD2 4.41Å; R454-F491 HydrophobicContact CB-CE1 3.73Å; R454-F491 HydrophobicContact CB-CE2 3.99Å; R454-F491 HydrophobicContact CB-CZ 3.62Å; R454-F491 PolarHBondContact N-O 2.99Å; R454-F491 WeakPolarHBondContact O-CD1 3.29Å; R454-F491 PolarHBondContact O-N 2.83Å; R454-D493 IonicContact CZ-OD1 3.46Å; R454-D493 IonicContact NH2-OD1 2.63Å; R454-D493 PolarHBondContact NH2-OD1 3.23Å
455	Y	94.1	Very high	90.4	Very high	33 Å²	33	54.2 Å²	54.2	13%	0.129	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	143	-172.7	-57.8	-89.7	0	0	0	111	C443 A445 A453 A469 R470 P490	C443-Y455 HydrophobicContact CB-CD1 4.32Å; C443-Y455 WeakPolarHBondContact SG-CD1 3.4Å; A445-Y455 HydrophobicContact CB-CE1 4.35Å; A445-Y455 PolarHBondContact N-OH 3.04Å; A453-Y455 HydrophobicContact CB-CE1 4.28Å; A453-Y455 HydrophobicContact CB-CE2 4.24Å; A453-Y455 VanDerWaalsContact O-CE2 3.32Å; A453-Y455 WeakPolarHBondContact O-CE2 3.4Å; Y455-A469 CarbonylContact O-C 3.55Å; Y455-A469 VanDerWaalsContact O-CA 3.28Å; Y455-A469 WeakPolarHBondContact O-CA 3Å; Y455-R470 WeakPolarHBondContact CB-O 3.49Å; Y455-R470 PolarHBondContact O-N 2.9Å; Y455-P490 HydrophobicContact CD1-CB 3.85Å; Y455-P490 HydrophobicContact CE1-CB 3.76Å
456	R	94	Very high	90	Very high	59 Å²	59	56.5 Å²	56.5	22%	0.223	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	150.4	175.3	63.4	-178.8	105.6	142.4	10.8	110.4	Y465 C488 L489 F491 N496	R456-Y465 HydrophobicContact CB-CD1 4.23Å; R456-Y465 HydrophobicContact CG-CD1 3.58Å; R456-Y465 HydrophobicContact CG-CE1 4.25Å; R456-Y465 HydrophobicContact CG-CG 3.89Å; R456-C488 WeakPolarHBondContact O-CA 3.31Å; R456-L489 HydrophobicContact CG-CB 3.95Å; R456-L489 PolarHBondContact N-O 2.95Å; R456-L489 PolarHBondContact O-N 3.36Å; R456-F491 HydrophobicContact CB-CE1 4.24Å; R456-F491 HydrophobicContact CG-CD1 4.37Å; R456-F491 HydrophobicContact CG-CE1 4.26Å; R456-F491 VanDerWaalsContact NH2-CB 3.28Å; R456-N496 PolarHBondContact NH2-OD1 2.99Å
457	W	94.7	Very high	89.4	Confident	5 Å²	5	63.4 Å²	63.4	2%	0.019	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	153.8	-171.3	-65.6	88.5	0	0	0	113.3	I427 L441 C443 Y465 E466 R470 T472 Y473 W487 C488	I427-W457 HydrophobicContact CD1-CH2 4.47Å; I427-W457 HydrophobicContact CD1-CZ3 3.85Å; I427-W457 HydrophobicContact CG1-CH2 4.12Å; I427-W457 HydrophobicContact CG1-CZ3 4Å; I427-W457 HydrophobicContact CG2-CH2 3.99Å; I427-W457 HydrophobicContact CG2-CZ3 4.07Å; L441-W457 HydrophobicContact CB-CH2 3.66Å; L441-W457 HydrophobicContact CB-CZ3 3.95Å; L441-W457 HydrophobicContact CD2-CZ3 4.45Å; L441-W457 WeakPolarHBondContact O-CZ2 3.23Å; C443-W457 HydrophobicContact CB-CH2 3.63Å; C443-W457 HydrophobicContact CB-CZ2 3.33Å; W457-Y465 VanDerWaalsContact C-CD1 3.43Å; W457-Y465 CarbonylContact O-C 3.53Å; W457-Y465 WeakPolarHBondContact O-CA 3.3Å; W457-Y465 WeakPolarHBondContact O-CD1 3.05Å; W457-E466 PolarHBondContact O-N 3.12Å; W457-R470 PolarHBondContact NE1-O 3.36Å; W457-T472 PolarHBondContact NE1-O 3.48Å; W457-Y473 HydrophobicContact CB-CD2 3.54Å; W457-Y473 HydrophobicContact CB-CE2 3.92Å; W457-Y473 AromaticContact CD2-CD2 3.99Å; W457-Y473 HydrophobicContact CD2-CD2 3.99Å; W457-Y473 HydrophobicContact CD2-CG 4.24Å; W457-Y473 HydrophobicContact CE3-CD2 4.45Å; W457-Y473 HydrophobicContact CE3-CG 4.42Å; W457-Y473 AromaticContact CG-CD2 3.59Å; W457-Y473 HydrophobicContact CG-CD2 3.59Å; W457-Y473 HydrophobicContact CG-CE2 4.44Å; W457-Y473 HydrophobicContact CG-CG 4.31Å; W457-W487 CarbonylContact C-O 3.59Å; W457-W487 WeakPolarHBondContact CA-O 3.29Å; W457-C488 HydrophobicContact CD2-CB 4.27Å; W457-C488 HydrophobicContact CE3-CB 4.01Å; W457-C488 HydrophobicContact CH2-CB 4.4Å; W457-C488 HydrophobicContact CZ3-CB 4.09Å
458	K	93.9	Very high	88.7	Confident	26 Å²	26	64.1 Å²	64.1	11%	0.113	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	119.9	175.9	178.2	179.6	73.5	-153.3	0	106.8	Q462 Y465 W487 E499	K458-Q462 HydrophobicContact CG-CB 4.46Å; K458-Q462 WeakPolarHBondContact CG-O 3.45Å; K458-Y465 HydrophobicContact CB-CD1 3.79Å; K458-Y465 HydrophobicContact CB-CE1 3.66Å; K458-Y465 HydrophobicContact CB-CG 4.34Å; K458-Y465 HydrophobicContact CD-CE2 4.25Å; K458-Y465 PolarHBondContact NZ-OH 3.04Å; K458-W487 HydrophobicContact CB-CB 4.28Å; K458-W487 HydrophobicContact CB-CE3 4.24Å; K458-W487 HydrophobicContact CD-CE3 4.17Å; K458-W487 VanDerWaalsContact CE-CG 3.4Å; K458-W487 HydrophobicContact CG-CE3 3.91Å; K458-W487 HydrophobicContact CG-CZ3 4.49Å; K458-W487 PolarHBondContact N-O 3.26Å; K458-W487 PolarHBondContact O-N 2.87Å; K458-E499 IonicContact NZ-OE1 3.77Å; K458-E499 PolarHBondContact NZ-OE1 3.47Å; K458-E499 IonicContact NZ-OE2 2.66Å; K458-E499 PolarHBondContact NZ-OE2 2.92Å
459	A	91.3	Very high	88.4	Confident	15 Å²	15	64.5 Å²	64.5	12%	0.124	37%	0.365	C	S	.	.			trans	-86.9	165.6	-177	0	0	0	0	0	112.4	G461 Q462 Y486	A459-G461 PolarHBondContact O-N 2.86Å; A459-G461 VanDerWaalsContact O-N 3.09Å; A459-Q462 HydrophobicContact CB-CB 4.35Å; A459-Q462 VanDerWaalsContact O-CB 3.25Å; A459-Q462 WeakPolarHBondContact O-CB 3.48Å; A459-Q462 PolarHBondContact O-N 3.02Å; A459-Y486 HydrophobicContact CB-CD1 4.3Å; A459-Y486 HydrophobicContact CB-CE1 3.97Å
460	P	88.1	Confident	88.4	Confident	37 Å²	37	71.8 Å²	71.8	24%	0.24	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	115	179.4	-22.3	27.3	0	0	0	112.8	E485 Y486	P460-E485 WeakPolarHBondContact CA-O 3.36Å; P460-E485 WeakPolarHBondContact CD-O 3.37Å; P460-E485 VanDerWaalsContact CG-O 3.26Å; P460-E485 WeakPolarHBondContact CG-O 3.42Å; P460-Y486 VanDerWaalsContact CD-CE1 3.48Å; P460-Y486 HydrophobicContact CG-CD2 3.84Å; P460-Y486 HydrophobicContact CG-CE1 4.38Å; P460-Y486 HydrophobicContact CG-CE2 3.49Å; P460-Y486 VanDerWaalsContact CG-CE2 3.49Å; P460-Y486 HydrophobicContact CG-CG 4.4Å
461	G	84.8	Confident	88.4	Confident	85 Å²	85	75.8 Å²	75.8	88%	0.876	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.3	2.4	-179.2	0	0	0	0	0	115.5	A459	A459-G461 PolarHBondContact O-N 2.86Å; A459-G461 VanDerWaalsContact O-N 3.09Å
462	Q	88.2	Confident	88.6	Confident	62 Å²	62	75.4 Å²	75.4	29%	0.29	40%	0.401	S	S	.	.			trans	-82.8	131	173	-167.2	-176.1	-21.5	0	0	110.4	K458 A459 D464	K458-Q462 HydrophobicContact CG-CB 4.46Å; K458-Q462 WeakPolarHBondContact CG-O 3.45Å; A459-Q462 HydrophobicContact CB-CB 4.35Å; A459-Q462 VanDerWaalsContact O-CB 3.25Å; A459-Q462 WeakPolarHBondContact O-CB 3.48Å; A459-Q462 PolarHBondContact O-N 3.02Å; Q462-D464 VanDerWaalsContact CD-O 3.27Å; Q462-D464 VanDerWaalsContact CG-O 3.29Å; Q462-D464 WeakPolarHBondContact CG-O 3.46Å; Q462-D464 PolarHBondContact NE2-O 2.98Å
463	A	85.9	Confident	88.6	Confident	91 Å²	91	72.9 Å²	72.9	75%	0.752	38%	0.38	S	S	*	.	S	Bend	trans	-77.1	-49.3	-178.4	0	0	0	0	0	112.8
464	D	88.5	Confident	88.7	Confident	128 Å²	128	75.7 Å²	75.7	68%	0.684	40%	0.396	S	S	*	.	S	Bend	trans	-101.7	158.3	-177.3	-66.3	-66.6	0	0	0	112.3	Q462	Q462-D464 VanDerWaalsContact CD-O 3.27Å; Q462-D464 VanDerWaalsContact CG-O 3.29Å; Q462-D464 WeakPolarHBondContact CG-O 3.46Å; Q462-D464 PolarHBondContact NE2-O 2.98Å
465	Y	88.7	Confident	88.7	Confident	53 Å²	53	70.8 Å²	70.8	21%	0.208	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-69.9	143.9	172.3	-78.6	-85.2	0	0	0	112.4	R456 W457 K458 L489 E499	R456-Y465 HydrophobicContact CB-CD1 4.23Å; R456-Y465 HydrophobicContact CG-CD1 3.58Å; R456-Y465 HydrophobicContact CG-CE1 4.25Å; R456-Y465 HydrophobicContact CG-CG 3.89Å; W457-Y465 VanDerWaalsContact C-CD1 3.43Å; W457-Y465 CarbonylContact O-C 3.53Å; W457-Y465 WeakPolarHBondContact O-CA 3.3Å; W457-Y465 WeakPolarHBondContact O-CD1 3.05Å; K458-Y465 HydrophobicContact CB-CD1 3.79Å; K458-Y465 HydrophobicContact CB-CE1 3.66Å; K458-Y465 HydrophobicContact CB-CG 4.34Å; K458-Y465 HydrophobicContact CD-CE2 4.25Å; K458-Y465 PolarHBondContact NZ-OH 3.04Å; Y465-L489 HydrophobicContact CD1-CB 4.36Å; Y465-L489 HydrophobicContact CD2-CD2 4.44Å; Y465-L489 HydrophobicContact CE1-CB 3.67Å; Y465-L489 HydrophobicContact CE2-CB 4.36Å; Y465-L489 HydrophobicContact CE2-CD2 4.03Å; Y465-E499 VanDerWaalsContact OH-CD 3.25Å; Y465-E499 PolarHBondContact OH-OE2 3.08Å
466	E	85.9	Confident	88.5	Confident	65 Å²	65	73.5 Å²	73.5	30%	0.304	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-60.5	147.2	175	-72.8	-168.6	-177.1	0	0	112.7	W457 G468 Y473	W457-E466 PolarHBondContact O-N 3.12Å; E466-G468 PolarHBondContact O-N 3.44Å; E466-G468 VanDerWaalsContact O-N 3.07Å; E466-Y473 WeakPolarHBondContact OE1-CE2 3.36Å; E466-Y473 PolarHBondContact OE1-OH 2.81Å
467	Y	77.2	Confident	88.4	Confident	247 Å²	247	75.3 Å²	75.3	97%	0.969	41%	0.414	S	S	*	.	S	Bend	trans	-79.5	92	180	-166	-88.6	0	0	0	111.7
468	G	75.2	Confident	88.3	Confident	39 Å²	39	75.1 Å²	75.1	40%	0.402	41%	0.413	S	S	.	.	S	Bend	trans	168.3	165.1	171.4	0	0	0	0	0	113.3	E466	E466-G468 PolarHBondContact O-N 3.44Å; E466-G468 VanDerWaalsContact O-N 3.07Å
469	A	80.5	Confident	88.3	Confident	58 Å²	58	77 Å²	77	48%	0.479	42%	0.423	S	S	.	.			trans	-103.2	107.8	167.7	0	0	0	0	0	109	R454 Y455	R454-A469 HydrophobicContact CB-CB 3.98Å; R454-A469 HydrophobicContact CG-CB 4.25Å; Y455-A469 CarbonylContact O-C 3.55Å; Y455-A469 VanDerWaalsContact O-CA 3.28Å; Y455-A469 WeakPolarHBondContact O-CA 3Å
470	R	87.7	Confident	88.3	Confident	165 Å²	165	77.2 Å²	77.2	62%	0.623	42%	0.422	S	S	*	.			trans	-143.6	124.4	178.9	-63.8	-176.3	-177.9	170.6	1.6	110.3	Y455 W457 T472	Y455-R470 WeakPolarHBondContact CB-O 3.49Å; Y455-R470 PolarHBondContact O-N 2.9Å; W457-R470 PolarHBondContact NE1-O 3.36Å; R470-T472 PolarHBondContact O-N 3.11Å
471	Y	91.1	Very high	88.4	Confident	153 Å²	153	78.8 Å²	78.8	60%	0.6	43%	0.434	S	S	*	.	S	Bend	trans	-76.9	-4.1	172.5	69.1	-85.6	0	0	0	112.9	C443	C443-Y471 PolarHBondContact N-O 2.84Å
472	T	93.2	Very high	88.8	Confident	36 Å²	36	77.4 Å²	77.4	22%	0.221	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	151.1	178.3	64.7	0	0	0	0	112.6	T440 L441 N442 W457 R470	T440-T472 HydrophobicContact CG2-CG2 4.04Å; L441-T472 CarbonylContact O-C 3.59Å; L441-T472 WeakPolarHBondContact O-CA 3.38Å; N442-T472 WeakPolarHBondContact OD1-CG2 3.48Å; W457-T472 PolarHBondContact NE1-O 3.48Å; R470-T472 PolarHBondContact O-N 3.11Å
473	Y	93	Very high	89	Confident	41 Å²	41	74.5 Å²	74.5	16%	0.161	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	102.4	168.3	-158.5	-89.1	0	0	0	109.6	T440 L441 W457 E466 I475 Y486	T440-Y473 WeakPolarHBondContact CA-O 3.49Å; L441-Y473 HydrophobicContact CD1-CD1 4.34Å; L441-Y473 PolarHBondContact N-O 3.07Å; L441-Y473 PolarHBondContact O-N 2.89Å; W457-Y473 HydrophobicContact CB-CD2 3.54Å; W457-Y473 HydrophobicContact CB-CE2 3.92Å; W457-Y473 AromaticContact CD2-CD2 3.99Å; W457-Y473 HydrophobicContact CD2-CD2 3.99Å; W457-Y473 HydrophobicContact CD2-CG 4.24Å; W457-Y473 HydrophobicContact CE3-CD2 4.45Å; W457-Y473 HydrophobicContact CE3-CG 4.42Å; W457-Y473 AromaticContact CG-CD2 3.59Å; W457-Y473 HydrophobicContact CG-CD2 3.59Å; W457-Y473 HydrophobicContact CG-CE2 4.44Å; W457-Y473 HydrophobicContact CG-CG 4.31Å; E466-Y473 WeakPolarHBondContact OE1-CE2 3.36Å; E466-Y473 PolarHBondContact OE1-OH 2.81Å; Y473-I475 HydrophobicContact CD1-CD1 4.2Å; Y473-I475 HydrophobicContact CD1-CG1 3.85Å; Y473-I475 HydrophobicContact CE1-CD1 4.2Å; Y473-I475 HydrophobicContact CE1-CG1 3.86Å; Y473-Y486 HydrophobicContact CD1-CD1 4.22Å; Y473-Y486 AromaticContact CD1-CE1 3.92Å; Y473-Y486 HydrophobicContact CD1-CE1 3.92Å; Y473-Y486 HydrophobicContact CE1-CD1 4.25Å; Y473-Y486 AromaticContact CE1-CE1 3.64Å; Y473-Y486 HydrophobicContact CE1-CE1 3.64Å
474	T	92.8	Very high	89.2	Confident	74 Å²	74	70.7 Å²	70.7	45%	0.454	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	125.7	-177	-58.1	0	0	0	0	110.8	T438 V439 T440	T438-T474 HydrophobicContact CG2-CG2 3.71Å; V439-T474 CarbonylContact O-C 3.58Å; V439-T474 WeakPolarHBondContact O-CA 3.37Å; T440-T474 WeakPolarHBondContact CG2-OG1 3.36Å; T440-T474 WeakPolarHBondContact OG1-CG2 3.31Å; T440-T474 PolarHBondContact OG1-OG1 2.69Å
475	I	93.2	Very high	89.5	Confident	14 Å²	14	68.5 Å²	68.5	7%	0.072	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	106	176	-50.7	169.8	0	0	0	107.6	T438 V439 L441 Y473 V478 H482 Y486 L504	T438-I475 WeakPolarHBondContact CA-O 3.38Å; V439-I475 HydrophobicContact CG1-CB 3.94Å; V439-I475 HydrophobicContact CG1-CD1 4.19Å; V439-I475 HydrophobicContact CG1-CG1 4.34Å; V439-I475 PolarHBondContact N-O 2.6Å; V439-I475 PolarHBondContact O-N 2.86Å; L441-I475 HydrophobicContact CD1-CD1 4.18Å; Y473-I475 HydrophobicContact CD1-CD1 4.2Å; Y473-I475 HydrophobicContact CD1-CG1 3.85Å; Y473-I475 HydrophobicContact CE1-CD1 4.2Å; Y473-I475 HydrophobicContact CE1-CG1 3.86Å; I475-V478 HydrophobicContact CB-CG2 4.2Å; I475-V478 HydrophobicContact CG2-CG2 4.08Å; I475-V478 WeakPolarHBondContact O-CG2 3.17Å; I475-H482 WeakPolarHBondContact CG2-ND1 3.48Å; I475-Y486 HydrophobicContact CD1-CE1 4.15Å; I475-Y486 VanDerWaalsContact CD1-OH 3.29Å; I475-Y486 WeakPolarHBondContact CD1-OH 3.4Å; I475-L504 HydrophobicContact CD1-CD2 3.97Å
476	P	91.1	Very high	89.7	Confident	90 Å²	90	66.4 Å²	66.4	58%	0.584	34%	0.338	S	S	*	.	S	Bend	trans	-74.1	151.3	170.3	32.5	-33.9	0	0	0	110.5	V478	P476-V478 PolarHBondContact O-N 2.81Å
477	D	91.9	Very high	90.2	Very high	98 Å²	98	65.8 Å²	65.8	52%	0.524	33%	0.333	S	S	.	.	S	Bend	trans	48.9	60.8	176.4	-171.4	19.2	0	0	0	113	A437 Q479	A437-D477 PolarHBondContact O-N 3.15Å; D477-Q479 WeakPolarHBondContact O-CG 3.27Å; D477-Q479 PolarHBondContact O-N 2.89Å; D477-Q479 PolarHBondContact O-NE2 2.8Å; D477-Q479 PolarHBondContact OD1-NE2 3.27Å
478	V	93.2	Very high	91	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.286	C	S	.	.			trans	-58.9	132.5	-173.6	175.7	0	0	0	0	111.5	V433 I435 G436 A437 V439 I475 P476 V506	V433-V478 HydrophobicContact CG1-CG1 3.99Å; I435-V478 CarbonylContact C-O 3.57Å; I435-V478 VanDerWaalsContact CA-O 3.24Å; I435-V478 WeakPolarHBondContact CA-O 3.16Å; G436-V478 PolarHBondContact N-O 2.94Å; A437-V478 WeakPolarHBondContact O-CG2 3.3Å; A437-V478 PolarHBondContact O-N 2.79Å; V439-V478 HydrophobicContact CB-CG2 3.94Å; V439-V478 HydrophobicContact CG1-CG2 3.44Å; V439-V478 VanDerWaalsContact CG1-CG2 3.44Å; I475-V478 HydrophobicContact CB-CG2 4.2Å; I475-V478 HydrophobicContact CG2-CG2 4.08Å; I475-V478 WeakPolarHBondContact O-CG2 3.17Å; P476-V478 PolarHBondContact O-N 2.81Å; V478-V506 HydrophobicContact CG1-CB 4.3Å; V478-V506 HydrophobicContact CG1-CG1 3.7Å; V478-V506 HydrophobicContact CG1-CG2 3.55Å
479	Q	93.1	Very high	92	Very high	67 Å²	67	52.9 Å²	52.9	31%	0.313	27%	0.271	S	S	.	.			trans	-119.4	158.3	177.2	-58.4	-56	-42.4	0	0	110.3	D477 S481 H482	D477-Q479 WeakPolarHBondContact O-CG 3.27Å; D477-Q479 PolarHBondContact O-N 2.89Å; D477-Q479 PolarHBondContact O-NE2 2.8Å; D477-Q479 PolarHBondContact OD1-NE2 3.27Å; Q479-S481 WeakPolarHBondContact CB-OG 3.28Å; Q479-S481 PolarHBondContact O-N 3Å; Q479-S481 VanDerWaalsContact O-N 3.12Å; Q479-H482 PolarHBondContact N-ND1 2.87Å; Q479-H482 WeakPolarHBondContact O-CB 3.17Å; Q479-H482 PolarHBondContact O-N 3.37Å
480	L	91.6	Very high	92.6	Very high	19 Å²	19	50.1 Å²	50.1	10%	0.099	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-54.6	-31.9	176.6	-69.3	168	0	0	0	112.9	I435 H482 A483 V506 E508 N538 R573 C574	I435-L480 HydrophobicContact CD1-CD1 4.05Å; I435-L480 HydrophobicContact CD1-CD2 4.33Å; I435-L480 HydrophobicContact CD1-CG 3.76Å; I435-L480 HydrophobicContact CG1-CG 4.27Å; L480-H482 PolarHBondContact O-N 3.48Å; L480-H482 VanDerWaalsContact O-N 3.14Å; L480-A483 WeakPolarHBondContact O-CB 3.23Å; L480-A483 PolarHBondContact O-N 3.3Å; L480-V506 HydrophobicContact CD2-CB 4.37Å; L480-V506 HydrophobicContact CD2-CG1 4.15Å; L480-E508 HydrophobicContact CD1-CB 4.44Å; L480-E508 HydrophobicContact CD2-CB 4.43Å; L480-N538 HydrophobicContact CD2-CB 4.25Å; L480-R573 WeakPolarHBondContact O-CG 3.37Å; L480-C574 WeakPolarHBondContact CD1-O 3.26Å
481	S	90.7	Very high	92.9	Very high	70 Å²	70	43.7 Å²	43.7	49%	0.49	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-59.2	-21.1	174.9	46.2	0	0	0	0	114.5	Q479 R573	Q479-S481 WeakPolarHBondContact CB-OG 3.28Å; Q479-S481 PolarHBondContact O-N 3Å; Q479-S481 VanDerWaalsContact O-N 3.12Å; S481-R573 PolarHBondContact O-NH2 3.44Å
482	H	92.4	Very high	93	Very high	56 Å²	56	36.9 Å²	36.9	26%	0.259	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-83.2	-10.8	177.8	-53.1	155.5	0	0	0	113	I475 Q479 L480 Y486	I475-H482 WeakPolarHBondContact CG2-ND1 3.48Å; Q479-H482 PolarHBondContact N-ND1 2.87Å; Q479-H482 WeakPolarHBondContact O-CB 3.17Å; Q479-H482 PolarHBondContact O-N 3.37Å; L480-H482 PolarHBondContact O-N 3.48Å; L480-H482 VanDerWaalsContact O-N 3.14Å; H482-Y486 WeakPolarHBondContact O-CE2 3.3Å; H482-Y486 PolarHBondContact O-OH 2.86Å
483	A	91.3	Very high	92.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.218	C	C	.	.			trans	-63.3	137	175.2	0	0	0	0	0	111.3	L480 L504 V506 E572 R573	L480-A483 WeakPolarHBondContact O-CB 3.23Å; L480-A483 PolarHBondContact O-N 3.3Å; A483-L504 CarbonylContact C-O 3.56Å; A483-L504 VanDerWaalsContact CA-O 3.25Å; A483-L504 WeakPolarHBondContact CA-O 3.34Å; A483-L504 WeakPolarHBondContact CB-O 3.39Å; A483-V506 HydrophobicContact CB-CB 4.28Å; A483-V506 HydrophobicContact CB-CG2 4.1Å; A483-E572 HydrophobicContact CB-CB 4.11Å; A483-R573 HydrophobicContact CB-CG 4.39Å; A483-R573 VanDerWaalsContact O-CZ 3.25Å; A483-R573 PolarHBondContact O-NE 3.45Å; A483-R573 PolarHBondContact O-NH2 2.75Å
484	G	91.1	Very high	92.8	Very high	11 Å²	11	41.6 Å²	41.6	11%	0.113	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	150.2	-176.6	-176.6	0	0	0	0	0	113.7	K503 L504	G484-K503 CarbonylContact O-C 3.56Å; G484-L504 PolarHBondContact N-O 2.94Å; G484-L504 PolarHBondContact O-N 2.76Å
485	E	93.6	Very high	92.7	Very high	82 Å²	82	39 Å²	39	38%	0.383	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	127.5	-179.5	-167.5	171.4	-160.1	0	0	111.8	P460 W487 S501	P460-E485 WeakPolarHBondContact CA-O 3.36Å; P460-E485 WeakPolarHBondContact CD-O 3.37Å; P460-E485 VanDerWaalsContact CG-O 3.26Å; P460-E485 WeakPolarHBondContact CG-O 3.42Å; E485-W487 HydrophobicContact CB-CH2 3.96Å; E485-W487 HydrophobicContact CB-CZ2 3.88Å; E485-W487 HydrophobicContact CG-CD2 4.43Å; E485-W487 HydrophobicContact CG-CH2 4.18Å; E485-W487 HydrophobicContact CG-CZ2 3.62Å; E485-W487 WeakPolarHBondContact O-CH2 3.42Å; E485-W487 WeakPolarHBondContact O-CZ3 3.43Å; E485-W487 WeakPolarHBondContact OE2-CZ2 3.36Å; E485-S501 WeakPolarHBondContact OE1-CB 3.1Å; E485-S501 PolarHBondContact OE1-OG 2.97Å
486	Y	94.3	Very high	92.7	Very high	10 Å²	10	42.2 Å²	42.2	4%	0.039	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	141.4	174	-73.8	-101.8	0	0	0	109	L441 A459 P460 Y473 I475 H482 S501 Y502 L504	L441-Y486 HydrophobicContact CD2-CD2 4.18Å; L441-Y486 HydrophobicContact CD2-CG 3.98Å; A459-Y486 HydrophobicContact CB-CD1 4.3Å; A459-Y486 HydrophobicContact CB-CE1 3.97Å; P460-Y486 VanDerWaalsContact CD-CE1 3.48Å; P460-Y486 HydrophobicContact CG-CD2 3.84Å; P460-Y486 HydrophobicContact CG-CE1 4.38Å; P460-Y486 HydrophobicContact CG-CE2 3.49Å; P460-Y486 VanDerWaalsContact CG-CE2 3.49Å; P460-Y486 HydrophobicContact CG-CG 4.4Å; Y473-Y486 HydrophobicContact CD1-CD1 4.22Å; Y473-Y486 AromaticContact CD1-CE1 3.92Å; Y473-Y486 HydrophobicContact CD1-CE1 3.92Å; Y473-Y486 HydrophobicContact CE1-CD1 4.25Å; Y473-Y486 AromaticContact CE1-CE1 3.64Å; Y473-Y486 HydrophobicContact CE1-CE1 3.64Å; I475-Y486 HydrophobicContact CD1-CE1 4.15Å; I475-Y486 VanDerWaalsContact CD1-OH 3.29Å; I475-Y486 WeakPolarHBondContact CD1-OH 3.4Å; H482-Y486 WeakPolarHBondContact O-CE2 3.3Å; H482-Y486 PolarHBondContact O-OH 2.86Å; Y486-S501 CarbonylContact O-C 3.6Å; Y486-S501 WeakPolarHBondContact O-CA 3.32Å; Y486-Y502 PolarHBondContact N-O 2.96Å; Y486-Y502 PolarHBondContact O-N 3.27Å; Y486-L504 HydrophobicContact CD2-CB 3.96Å; Y486-L504 HydrophobicContact CD2-CD2 4.49Å; Y486-L504 HydrophobicContact CE2-CB 3.85Å; Y486-L504 HydrophobicContact CE2-CD2 3.74Å; Y486-L504 HydrophobicContact CE2-CG 4.46Å
487	W	95.5	Very high	92.8	Very high	52 Å²	52	38.5 Å²	38.5	20%	0.197	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	145.2	176.4	-52.7	-103.9	0	0	0	111.9	W457 K458 E485 E499 G500 S501	W457-W487 CarbonylContact C-O 3.59Å; W457-W487 WeakPolarHBondContact CA-O 3.29Å; K458-W487 HydrophobicContact CB-CB 4.28Å; K458-W487 HydrophobicContact CB-CE3 4.24Å; K458-W487 HydrophobicContact CD-CE3 4.17Å; K458-W487 VanDerWaalsContact CE-CG 3.4Å; K458-W487 HydrophobicContact CG-CE3 3.91Å; K458-W487 HydrophobicContact CG-CZ3 4.49Å; K458-W487 PolarHBondContact N-O 3.26Å; K458-W487 PolarHBondContact O-N 2.87Å; E485-W487 HydrophobicContact CB-CH2 3.96Å; E485-W487 HydrophobicContact CB-CZ2 3.88Å; E485-W487 HydrophobicContact CG-CD2 4.43Å; E485-W487 HydrophobicContact CG-CH2 4.18Å; E485-W487 HydrophobicContact CG-CZ2 3.62Å; E485-W487 WeakPolarHBondContact O-CH2 3.42Å; E485-W487 WeakPolarHBondContact O-CZ3 3.43Å; E485-W487 WeakPolarHBondContact OE2-CZ2 3.36Å; W487-E499 VanDerWaalsContact CD1-OE1 3.25Å; W487-G500 WeakPolarHBondContact CA-O 3.38Å; W487-S501 VanDerWaalsContact CD1-CB 3.47Å
488	C	94.9	Very high	92.9	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	138.9	172.4	178.2	0	0	0	0	110.1	A425 I427 C443 R456 W457 E499 G500	A425-C488 HydrophobicContact CB-CB 4.3Å; A425-C488 WeakPolarHBondContact CB-O 3.4Å; I427-C488 HydrophobicContact CD1-CB 3.77Å; I427-C488 HydrophobicContact CG1-CB 3.84Å; C443-C488 HydrophobicContact CB-CB 3.77Å; C443-C488 WeakPolarHBondContact CB-SG 3.22Å; C443-C488 WeakPolarHBondContact SG-CB 3.2Å; C443-C488 CovalentContact SG-SG 2.03Å; C443-C488 PolarHBondContact SG-SG 2.78Å; R456-C488 WeakPolarHBondContact O-CA 3.31Å; W457-C488 HydrophobicContact CD2-CB 4.27Å; W457-C488 HydrophobicContact CE3-CB 4.01Å; W457-C488 HydrophobicContact CH2-CB 4.4Å; W457-C488 HydrophobicContact CZ3-CB 4.09Å; C488-E499 VanDerWaalsContact O-CA 3.3Å; C488-E499 WeakPolarHBondContact O-CA 3.32Å; C488-G500 PolarHBondContact N-O 2.94Å; C488-G500 PolarHBondContact O-N 3.14Å; C488-G500 VanDerWaalsContact O-N 3.1Å
489	L	94.8	Very high	92.9	Very high	15 Å²	15	44.4 Å²	44.4	8%	0.079	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	111.2	175.8	178.6	62.5	0	0	0	110.8	R456 Y465 N496 G497 E499	R456-L489 HydrophobicContact CG-CB 3.95Å; R456-L489 PolarHBondContact N-O 2.95Å; R456-L489 PolarHBondContact O-N 3.36Å; Y465-L489 HydrophobicContact CD1-CB 4.36Å; Y465-L489 HydrophobicContact CD2-CD2 4.44Å; Y465-L489 HydrophobicContact CE1-CB 3.67Å; Y465-L489 HydrophobicContact CE2-CB 4.36Å; Y465-L489 HydrophobicContact CE2-CD2 4.03Å; L489-N496 HydrophobicContact CD1-CB 4.29Å; L489-G497 WeakPolarHBondContact CD1-O 3.3Å; L489-E499 HydrophobicContact CB-CB 4.44Å; L489-E499 HydrophobicContact CD1-CB 4.16Å
490	P	95.2	Very high	92.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	144.7	170.1	30.1	-35.1	0	0	0	110.9	P422 A425 A445 A453 R454 Y455 G497	P422-P490 HydrophobicContact CB-CB 3.8Å; P422-P490 HydrophobicContact CB-CG 4.15Å; P422-P490 HydrophobicContact CG-CB 4.3Å; A425-P490 HydrophobicContact CB-CG 4.2Å; A445-P490 HydrophobicContact CB-CB 4.21Å; A445-P490 HydrophobicContact CB-CG 4.26Å; A453-P490 HydrophobicContact CB-CB 4.01Å; R454-P490 CarbonylContact O-C 3.49Å; R454-P490 WeakPolarHBondContact O-CA 3.47Å; Y455-P490 HydrophobicContact CD1-CB 3.85Å; Y455-P490 HydrophobicContact CE1-CB 3.76Å; P490-G497 PolarHBondContact O-N 3.44Å
491	F	93.9	Very high	93.1	Very high	30 Å²	30	43.7 Å²	43.7	13%	0.132	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	148.9	176.8	69.3	-79.4	0	0	0	111.8	R454 R456 G495	R454-F491 HydrophobicContact CB-CD1 4.18Å; R454-F491 HydrophobicContact CB-CD2 4.41Å; R454-F491 HydrophobicContact CB-CE1 3.73Å; R454-F491 HydrophobicContact CB-CE2 3.99Å; R454-F491 HydrophobicContact CB-CZ 3.62Å; R454-F491 PolarHBondContact N-O 2.99Å; R454-F491 WeakPolarHBondContact O-CD1 3.29Å; R454-F491 PolarHBondContact O-N 2.83Å; R456-F491 HydrophobicContact CB-CE1 4.24Å; R456-F491 HydrophobicContact CG-CD1 4.37Å; R456-F491 HydrophobicContact CG-CE1 4.26Å; R456-F491 VanDerWaalsContact NH2-CB 3.28Å; F491-G495 WeakPolarHBondContact CA-O 3.14Å
492	N	92.6	Very high	93.2	Very high	10 Å²	10	42.7 Å²	42.7	5%	0.053	22%	0.224	C	C	.	.			trans	-133.4	-168.7	168.7	70.3	5.8	0	0	0	109.8	H420 P422 Y450 P451 I494 G495	H420-N492 PolarHBondContact O-ND2 2.93Å; P422-N492 HydrophobicContact CG-CB 4.27Å; Y450-N492 PolarHBondContact N-ND2 3.49Å; P451-N492 WeakPolarHBondContact O-CB 3.42Å; P451-N492 PolarHBondContact O-ND2 2.98Å; N492-I494 PolarHBondContact O-N 2.93Å; N492-I494 WeakPolarHBondContact OD1-CA 3.39Å; N492-I494 WeakPolarHBondContact OD1-CB 3.28Å; N492-I494 PolarHBondContact OD1-N 3.19Å; N492-G495 PolarHBondContact N-O 3.45Å; N492-G495 PolarHBondContact O-N 2.86Å; N492-G495 PolarHBondContact OD1-N 3.04Å; N492-G495 VanDerWaalsContact OD1-N 3.08Å; N492-G495 PolarHBondContact OD1-O 3.29Å
493	D	91.2	Very high	93.3	Very high	117 Å²	117	44.9 Å²	44.9	63%	0.626	23%	0.233	S	C	*	.	S	Bend	trans	-78.7	-4.4	-175.5	-50	-32.6	0	0	0	112.8	R454	R454-D493 IonicContact CZ-OD1 3.46Å; R454-D493 IonicContact NH2-OD1 2.63Å; R454-D493 PolarHBondContact NH2-OD1 3.23Å
494	I	90.3	Very high	93.4	Very high	58 Å²	58	44.9 Å²	44.9	30%	0.297	23%	0.233	S	C	.	.	S	Bend	trans	-91.7	-37.7	172.1	-50.5	-59	0	0	0	111.1	N492	N492-I494 PolarHBondContact O-N 2.93Å; N492-I494 WeakPolarHBondContact OD1-CA 3.39Å; N492-I494 WeakPolarHBondContact OD1-CB 3.28Å; N492-I494 PolarHBondContact OD1-N 3.19Å
495	G	90.8	Very high	93.3	Very high	19 Å²	19	48.1 Å²	48.1	20%	0.196	25%	0.247	C	C	.	.			trans	174	-176.5	179.9	0	0	0	0	0	115.2	P422 F491 N492	P422-G495 WeakPolarHBondContact CD-O 3.39Å; F491-G495 WeakPolarHBondContact CA-O 3.14Å; N492-G495 PolarHBondContact N-O 3.45Å; N492-G495 PolarHBondContact O-N 2.86Å; N492-G495 PolarHBondContact OD1-N 3.04Å; N492-G495 VanDerWaalsContact OD1-N 3.08Å; N492-G495 PolarHBondContact OD1-O 3.29Å
496	N	93.3	Very high	93.3	Very high	83 Å²	83	44.2 Å²	44.2	44%	0.444	23%	0.229	S	C	.	.	B	Isolated β-bridge	trans	-86.6	145.8	170	-57.1	-37.4	0	0	0	109.8	Q421 R456 L489	Q421-N496 PolarHBondContact NE2-O 2.6Å; R456-N496 PolarHBondContact NH2-OD1 2.99Å; L489-N496 HydrophobicContact CD1-CB 4.29Å
497	G	92.4	Very high	93.2	Very high	12 Å²	12	47.4 Å²	47.4	12%	0.124	24%	0.241	C	C	.	.			trans	-82.4	-163.1	163.5	0	0	0	0	0	112.1	P422 G423 L489 P490	P422-G497 WeakPolarHBondContact O-CA 3.37Å; G423-G497 CarbonylContact O-C 3.58Å; G423-G497 VanDerWaalsContact O-CA 3.31Å; G423-G497 WeakPolarHBondContact O-CA 3.24Å; L489-G497 WeakPolarHBondContact CD1-O 3.3Å; P490-G497 PolarHBondContact O-N 3.44Å
498	Q	94.4	Very high	93	Very high	130 Å²	130	46.1 Å²	46.1	61%	0.607	24%	0.237	S	C	*	.	B	Isolated β-bridge	trans	-89.1	136.2	173.9	-64.6	-175.6	-4.8	0	0	110.3	G423 V424 A425	G423-Q498 PolarHBondContact O-N 2.87Å; V424-Q498 HydrophobicContact CG2-CB 4.37Å; A425-Q498 PolarHBondContact N-O 2.86Å; A425-Q498 VanDerWaalsContact N-O 3.1Å
499	E	93.9	Very high	93	Very high	91 Å²	91	48.1 Å²	48.1	43%	0.425	25%	0.25	S	C	.	.			trans	-69.3	140.5	173.3	64.7	176.8	-104	0	0	111	K458 Y465 W487 C488 L489	K458-E499 IonicContact NZ-OE1 3.77Å; K458-E499 PolarHBondContact NZ-OE1 3.47Å; K458-E499 IonicContact NZ-OE2 2.66Å; K458-E499 PolarHBondContact NZ-OE2 2.92Å; Y465-E499 VanDerWaalsContact OH-CD 3.25Å; Y465-E499 PolarHBondContact OH-OE2 3.08Å; W487-E499 VanDerWaalsContact CD1-OE1 3.25Å; C488-E499 VanDerWaalsContact O-CA 3.3Å; C488-E499 WeakPolarHBondContact O-CA 3.32Å; L489-E499 HydrophobicContact CB-CB 4.44Å; L489-E499 HydrophobicContact CD1-CB 4.16Å
500	G	93.4	Very high	92.9	Very high	12 Å²	12	47.7 Å²	47.7	12%	0.124	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	153.3	171.8	0	0	0	0	0	109.9	I427 W487 C488	I427-G500 WeakPolarHBondContact CD1-O 3.34Å; W487-G500 WeakPolarHBondContact CA-O 3.38Å; C488-G500 PolarHBondContact N-O 2.94Å; C488-G500 PolarHBondContact O-N 3.14Å; C488-G500 VanDerWaalsContact O-N 3.1Å
501	S	94.6	Very high	92.8	Very high	60 Å²	60	51.5 Å²	51.5	42%	0.42	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	156.8	-179.3	71.5	0	0	0	0	113	E485 Y486 W487	E485-S501 WeakPolarHBondContact OE1-CB 3.1Å; E485-S501 PolarHBondContact OE1-OG 2.97Å; Y486-S501 CarbonylContact O-C 3.6Å; Y486-S501 WeakPolarHBondContact O-CA 3.32Å; W487-S501 VanDerWaalsContact CD1-CB 3.47Å
502	Y	94.5	Very high	92.7	Very high	48 Å²	48	51.3 Å²	51.3	19%	0.188	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	139.3	170.6	173.9	-88.2	0	0	0	109.6	I427 V429 E431 L441 Y486 L504	I427-Y502 HydrophobicContact CG2-CG 4.14Å; V429-Y502 HydrophobicContact CB-CE1 4.38Å; V429-Y502 HydrophobicContact CG1-CE1 3.56Å; V429-Y502 HydrophobicContact CG1-CE2 4.22Å; V429-Y502 VanDerWaalsContact CG1-CZ 3.4Å; V429-Y502 WeakPolarHBondContact CG1-OH 3.27Å; E431-Y502 PolarHBondContact OE1-OH 3.3Å; L441-Y502 HydrophobicContact CD2-CD1 4.1Å; Y486-Y502 PolarHBondContact N-O 2.96Å; Y486-Y502 PolarHBondContact O-N 3.27Å; Y502-L504 HydrophobicContact CE1-CB 4.41Å; Y502-L504 HydrophobicContact CE1-CD1 4.39Å
503	K	93.3	Very high	92.5	Very high	103 Å²	103	53 Å²	53	45%	0.448	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	100.7	-177	-171.8	-178	177.3	-172.1	0	110.4	G484 I505 E572	G484-K503 CarbonylContact O-C 3.56Å; K503-I505 PolarHBondContact O-N 3.2Å; K503-E572 VanDerWaalsContact CE-CD 3.44Å; K503-E572 WeakPolarHBondContact CE-OE1 3.32Å; K503-E572 WeakPolarHBondContact CE-OE2 3.41Å; K503-E572 IonicContact NZ-OE1 3.64Å; K503-E572 PolarHBondContact NZ-OE1 2.93Å; K503-E572 IonicContact NZ-OE2 2.59Å; K503-E572 PolarHBondContact NZ-OE2 2.96Å; K503-E572 VanDerWaalsContact NZ-OE2 3.14Å
504	L	92.9	Very high	92.1	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	117.6	178	-175	65.7	0	0	0	110.6	V433 I475 A483 G484 Y486 Y502 V506	V433-L504 HydrophobicContact CB-CD1 4.47Å; V433-L504 HydrophobicContact CG1-CD1 4.41Å; V433-L504 HydrophobicContact CG2-CD1 3.98Å; I475-L504 HydrophobicContact CD1-CD2 3.97Å; A483-L504 CarbonylContact C-O 3.56Å; A483-L504 VanDerWaalsContact CA-O 3.25Å; A483-L504 WeakPolarHBondContact CA-O 3.34Å; A483-L504 WeakPolarHBondContact CB-O 3.39Å; G484-L504 PolarHBondContact N-O 2.94Å; G484-L504 PolarHBondContact O-N 2.76Å; Y486-L504 HydrophobicContact CD2-CB 3.96Å; Y486-L504 HydrophobicContact CD2-CD2 4.49Å; Y486-L504 HydrophobicContact CE2-CB 3.85Å; Y486-L504 HydrophobicContact CE2-CD2 3.74Å; Y486-L504 HydrophobicContact CE2-CG 4.46Å; Y502-L504 HydrophobicContact CE1-CB 4.41Å; Y502-L504 HydrophobicContact CE1-CD1 4.39Å; L504-V506 HydrophobicContact CD2-CG2 4.39Å; L504-V506 HydrophobicContact CG-CG2 4.28Å
505	I	90.6	Very high	91.9	Very high	78 Å²	78	52.4 Å²	52.4	40%	0.4	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-103	117.8	173	-59.2	174.5	0	0	0	108.1	K503	K503-I505 PolarHBondContact O-N 3.2Å
506	V	92.3	Very high	91.9	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.006	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	136.4	175.6	-179	0	0	0	0	109.1	V433 I435 V478 L480 A483 L504	V433-V506 HydrophobicContact CG1-CG2 4.44Å; I435-V506 HydrophobicContact CG1-CG1 4.1Å; V478-V506 HydrophobicContact CG1-CB 4.3Å; V478-V506 HydrophobicContact CG1-CG1 3.7Å; V478-V506 HydrophobicContact CG1-CG2 3.55Å; L480-V506 HydrophobicContact CD2-CB 4.37Å; L480-V506 HydrophobicContact CD2-CG1 4.15Å; A483-V506 HydrophobicContact CB-CB 4.28Å; A483-V506 HydrophobicContact CB-CG2 4.1Å; L504-V506 HydrophobicContact CD2-CG2 4.39Å; L504-V506 HydrophobicContact CG-CG2 4.28Å
507	R	92.2	Very high	91.8	Very high	77 Å²	77	56.6 Å²	56.6	29%	0.291	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	144	178.8	-54.4	-171.2	-176.3	-153.9	2.2	112.6	V433 V434 I435 N538 A604	V433-R507 PolarHBondContact O-N 3.21Å; V434-R507 WeakPolarHBondContact CA-O 3.4Å; I435-R507 PolarHBondContact N-O 2.91Å; R507-N538 CarbonylContact C-O 3.59Å; R507-N538 VanDerWaalsContact CA-O 3.32Å; R507-N538 WeakPolarHBondContact CA-O 3.38Å; R507-N538 WeakPolarHBondContact CB-O 3.42Å; R507-A604 HydrophobicContact CB-CB 3.61Å; R507-A604 HydrophobicContact CG-CB 4.42Å
508	E	92.6	Very high	91.7	Very high	25 Å²	25	63 Å²	63	12%	0.117	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	119.4	173.2	178	-176.4	-134.3	0	0	108.8	I435 L480 H511 G537 N538 S575 N602	I435-E508 HydrophobicContact CD1-CB 3.64Å; I435-E508 HydrophobicContact CD1-CG 3.8Å; I435-E508 HydrophobicContact CG1-CB 4.38Å; L480-E508 HydrophobicContact CD1-CB 4.44Å; L480-E508 HydrophobicContact CD2-CB 4.43Å; E508-H511 IonicContact OE1-CE1 3.9Å; E508-H511 PolarHBondContact OE1-CE1 2.87Å; E508-G537 VanDerWaalsContact OE2-C 3.25Å; E508-G537 WeakPolarHBondContact OE2-CA 3.29Å; E508-G537 PolarHBondContact OE2-N 3Å; E508-N538 HydrophobicContact CB-CB 4Å; E508-N538 PolarHBondContact N-O 3.49Å; E508-N538 PolarHBondContact O-N 3.49Å; E508-S575 VanDerWaalsContact CD-OG 3.29Å; E508-S575 PolarHBondContact OE1-OG 3Å; E508-S575 WeakPolarHBondContact OE2-CA 3.47Å; E508-S575 WeakPolarHBondContact OE2-CB 3.45Å; E508-S575 PolarHBondContact OE2-OG 3.13Å; E508-N602 PolarHBondContact O-ND2 3.37Å
509	P	93.2	Very high	91.4	Very high	42 Å²	42	61.3 Å²	61.3	27%	0.273	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	144.9	176.2	-23.2	35.5	0	0	0	112.3	V434 H511	V434-P509 HydrophobicContact CG1-CG 3.5Å; V434-P509 VanDerWaalsContact CG1-CG 3.5Å; P509-H511 PolarHBondContact O-N 2.76Å; P509-H511 PolarHBondContact O-ND1 3.33Å
510	A	92.9	Very high	91.3	Very high	6 Å²	6	58.9 Å²	58.9	5%	0.05	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	127.4	173.9	0	0	0	0	0	111.2	H536 P541 A600 N602 S608	A510-H536 CarbonylContact C-O 3.4Å; A510-H536 VanDerWaalsContact CA-O 3.3Å; A510-H536 WeakPolarHBondContact CA-O 3.35Å; A510-P541 HydrophobicContact CB-CB 4.04Å; A510-P541 HydrophobicContact CB-CG 4.02Å; A510-A600 HydrophobicContact CB-CB 4.31Å; A510-A600 WeakPolarHBondContact CB-O 3.41Å; A510-N602 PolarHBondContact N-OD1 2.87Å; A510-S608 VanDerWaalsContact O-CB 3.23Å; A510-S608 WeakPolarHBondContact O-CB 3.29Å
511	H	92.9	Very high	91.1	Very high	80 Å²	80	61.8 Å²	61.8	37%	0.37	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	139.2	175.4	66	-88.8	0	0	0	111.9	E508 P509 G513 A535 H536	E508-H511 IonicContact OE1-CE1 3.9Å; E508-H511 PolarHBondContact OE1-CE1 2.87Å; P509-H511 PolarHBondContact O-N 2.76Å; P509-H511 PolarHBondContact O-ND1 3.33Å; H511-G513 PolarHBondContact O-N 3.06Å; H511-A535 CarbonylContact O-C 3.52Å; H511-A535 VanDerWaalsContact O-CA 3.29Å; H511-A535 WeakPolarHBondContact O-CA 3.44Å; H511-H536 WeakPolarHBondContact CE1-CB 3.38Å; H511-H536 PolarHBondContact N-O 3.44Å; H511-H536 PolarHBondContact ND1-O 3.25Å; H511-H536 WeakPolarHBondContact NE2-CB 3.37Å; H511-H536 PolarHBondContact O-N 2.03Å
512	L	93.2	Very high	91	Very high	26 Å²	26	59.8 Å²	59.8	14%	0.136	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	121.2	-177.1	-63.9	-177	0	0	0	112.3	V515 T534 A535 A600 S608 E609 S610	L512-V515 HydrophobicContact CB-CG1 4.31Å; L512-T534 CarbonylContact C-O 3.57Å; L512-T534 WeakPolarHBondContact CA-O 3.34Å; L512-A535 HydrophobicContact CD2-CB 3.99Å; L512-A600 HydrophobicContact CD2-CB 3.64Å; L512-S608 PolarHBondContact N-OG 3.06Å; L512-E609 VanDerWaalsContact CD1-C 3.45Å; L512-S610 VanDerWaalsContact CD1-CB 3.47Å
513	G	87.5	Confident	90.8	Very high	44 Å²	44	64.8 Å²	64.8	45%	0.454	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	-28.8	175.6	0	0	0	0	0	113.4	H511 T534	H511-G513 PolarHBondContact O-N 3.06Å; G513-T534 PolarHBondContact N-O 3.47Å
514	T	84	Confident	90.5	Very high	60 Å²	60	61.3 Å²	61.3	37%	0.368	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	121.7	168.3	64.5	0	0	0	0	110.6	T534	T514-T534 HydrophobicContact CG2-CG2 4.23Å; T514-T534 PolarHBondContact N-OG1 3.13Å; T514-T534 VanDerWaalsContact N-OG1 3.12Å; T514-T534 PolarHBondContact OG1-N 2.93Å; T514-T534 VanDerWaalsContact OG1-N 3.11Å; T514-T534 PolarHBondContact OG1-OG1 3.12Å
515	V	84.2	Confident	90.3	Very high	104 Å²	104	63.8 Å²	63.8	63%	0.63	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-91.1	153.3	175.8	-66.1	0	0	0	0	111.7	L512 S610	L512-V515 HydrophobicContact CB-CG1 4.31Å; V515-S610 WeakPolarHBondContact CB-OG 3.31Å
516	L	91.9	Very high	90.2	Very high	21 Å²	21	64.8 Å²	64.8	11%	0.11	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-70	166.3	173	-54.1	-178.8	0	0	0	111.4	L531 S532 W545 Y596 C598 S610 M612	L516-L531 HydrophobicContact CD2-CB 4.44Å; L516-S532 WeakPolarHBondContact CD2-O 3.21Å; L516-W545 HydrophobicContact CD1-CZ3 4.03Å; L516-W545 HydrophobicContact CD2-CH2 4.01Å; L516-W545 HydrophobicContact CD2-CZ3 4.1Å; L516-Y596 WeakPolarHBondContact CD1-O 3.08Å; L516-C598 HydrophobicContact CD1-CB 4.39Å; L516-S610 WeakPolarHBondContact CD1-O 3.5Å; L516-S610 PolarHBondContact N-OG 2.98Å; L516-M612 HydrophobicContact CB-CB 3.95Å; L516-M612 HydrophobicContact CD1-CB 4.07Å
517	R	91.4	Very high	90	Very high	168 Å²	168	69.1 Å²	69.1	63%	0.634	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-67.2	157.7	166.6	-67.1	176.5	173.7	172.8	-2.2	109.2	E520 M612	R517-E520 IonicContact CZ-OE1 2.79Å; R517-E520 IonicContact NH1-OE1 2.85Å; R517-E520 PolarHBondContact NH1-OE1 3.5Å; R517-M612 HydrophobicContact CB-CG 4.39Å; R517-M612 HydrophobicContact CB-SD 4.34Å; R517-M612 VanDerWaalsContact O-CA 3.26Å; R517-M612 WeakPolarHBondContact O-CA 3.24Å; R517-M612 WeakPolarHBondContact O-CB 3.45Å; R517-M612 WeakPolarHBondContact O-CG 3.22Å
518	K	89.3	Confident	89.6	Confident	146 Å²	146	67.2 Å²	67.2	64%	0.635	37%	0.374	S	S	*	.	S	Bend	trans	-72.3	-37.5	172.8	-68.3	178.7	180	170.2	0	112.1	F613 S1095	K518-F613 PolarHBondContact O-N 2.83Å; K518-S1095 PolarHBondContact NZ-OG 3.15Å
519	E	89.8	Confident	89.5	Confident	95 Å²	95	67.1 Å²	67.1	44%	0.444	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	144.5	178.4	-174	178	113.6	0	0	109.1	F613 K615	E519-F613 CarbonylContact C-O 3.56Å; E519-F613 VanDerWaalsContact CA-O 3.28Å; E519-F613 WeakPolarHBondContact CA-O 3.5Å; E519-F613 HydrophobicContact CG-CD1 4.38Å; E519-K615 HydrophobicContact CG-CD 4.35Å; E519-K615 WeakPolarHBondContact OE1-CE 3.47Å; E519-K615 IonicContact OE1-NZ 3.56Å; E519-K615 PolarHBondContact OE1-NZ 3.01Å; E519-K615 WeakPolarHBondContact OE2-CE 3.34Å; E519-K615 IonicContact OE2-NZ 2.85Å; E519-K615 PolarHBondContact OE2-NZ 2.96Å
520	E	90.4	Very high	89.5	Confident	41 Å²	41	68.2 Å²	68.2	19%	0.192	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	145.9	167.9	-175.9	140.4	-104.2	0	0	109.7	R517 Y529 M612 F613 L614 K615	R517-E520 IonicContact CZ-OE1 2.79Å; R517-E520 IonicContact NH1-OE1 2.85Å; R517-E520 PolarHBondContact NH1-OE1 3.5Å; E520-Y529 WeakPolarHBondContact OE2-CE2 3.11Å; E520-Y529 PolarHBondContact OE2-OH 3.4Å; E520-M612 HydrophobicContact CB-CE 4.11Å; E520-M612 HydrophobicContact CB-CG 4.45Å; E520-M612 HydrophobicContact CB-SD 3.65Å; E520-F613 PolarHBondContact N-O 3.13Å; E520-L614 HydrophobicContact CB-CD1 4.24Å; E520-L614 HydrophobicContact CG-CD1 4.4Å; E520-K615 PolarHBondContact O-N 3.08Å
521	T	90.5	Very high	89.5	Confident	73 Å²	73	68.4 Å²	68.4	45%	0.448	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	124.3	177.4	-60.8	0	0	0	0	110.3	K615 Q617	T521-K615 WeakPolarHBondContact CA-O 3.38Å; T521-K615 HydrophobicContact CG2-CB 4.18Å; T521-Q617 HydrophobicContact CG2-CG 4.07Å
522	I	91.4	Very high	89.5	Confident	18 Å²	18	68.5 Å²	68.5	9%	0.092	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	158.2	-178	-165.1	156.2	0	0	0	110.7	H526 Y529 V588 L614 K615 V616 Q617	I522-H526 HydrophobicContact CD1-CB 3.97Å; I522-H526 HydrophobicContact CG1-CB 3.87Å; I522-Y529 HydrophobicContact CD1-CD1 3.95Å; I522-Y529 HydrophobicContact CD1-CD2 3.54Å; I522-Y529 HydrophobicContact CD1-CE1 4.33Å; I522-Y529 HydrophobicContact CD1-CE2 3.96Å; I522-Y529 HydrophobicContact CD1-CG 3.54Å; I522-V588 HydrophobicContact CD1-CG2 4.17Å; I522-V588 HydrophobicContact CG2-CG1 3.92Å; I522-L614 HydrophobicContact CB-CD1 4.46Å; I522-L614 HydrophobicContact CG2-CD1 3.82Å; I522-L614 HydrophobicContact CG2-CG 4.34Å; I522-K615 PolarHBondContact N-O 3.5Å; I522-V616 HydrophobicContact CG2-CG2 3.97Å; I522-V616 CarbonylContact O-C 3.5Å; I522-V616 WeakPolarHBondContact O-CA 3.13Å; I522-Q617 PolarHBondContact O-N 2.59Å
523	R	90.4	Very high	89.5	Confident	153 Å²	153	67.2 Å²	67.2	58%	0.577	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	133.3	173.4	-171.3	-179.8	-70.9	-179.3	-2.5	110.4	G525 H526 Q617	R523-G525 PolarHBondContact O-N 2.75Å; R523-H526 WeakPolarHBondContact O-CB 3.18Å; R523-H526 PolarHBondContact O-N 3.06Å; R523-H526 VanDerWaalsContact O-N 3.13Å; R523-Q617 HydrophobicContact CG-CB 4.5Å
524	G	87.3	Confident	89.8	Confident	30 Å²	30	65.9 Å²	65.9	31%	0.309	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	137.6	170.6	0	0	0	0	0	111	V588 Q617	G524-V588 CarbonylContact C-O 3.51Å; G524-V588 WeakPolarHBondContact CA-O 3.32Å; G524-Q617 PolarHBondContact N-O 2.86Å
525	G	87.3	Confident	90.3	Very high	52 Å²	52	63 Å²	63	54%	0.536	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.9	-0.7	-170.9	0	0	0	0	0	115.3	R523 V588	R523-G525 PolarHBondContact O-N 2.75Å; G525-V588 PolarHBondContact N-O 2.82Å
526	H	88.6	Confident	90.7	Very high	99 Å²	99	60.4 Å²	60.4	46%	0.458	33%	0.331	S	S	.	.			trans	-70.3	128.4	172.5	-169.7	94.4	0	0	0	111.3	I522 R523 A587 V588	I522-H526 HydrophobicContact CD1-CB 3.97Å; I522-H526 HydrophobicContact CG1-CB 3.87Å; R523-H526 WeakPolarHBondContact O-CB 3.18Å; R523-H526 PolarHBondContact O-N 3.06Å; R523-H526 VanDerWaalsContact O-N 3.13Å; H526-A587 CarbonylContact O-C 3.53Å; H526-A587 VanDerWaalsContact O-CA 3.3Å; H526-A587 WeakPolarHBondContact O-CA 3.48Å; H526-V588 WeakPolarHBondContact O-CG2 3.46Å; H526-V588 PolarHBondContact O-N 3.23Å
527	S	88.2	Confident	90.8	Very high	91 Å²	91	59.4 Å²	59.4	64%	0.636	33%	0.326	S	S	*	.	B	Isolated β-bridge	trans	-100.8	134.1	-174.5	58.5	0	0	0	0	113.4
528	G	84.6	Confident	90.7	Very high	38 Å²	38	52.3 Å²	52.3	39%	0.392	30%	0.3	S	S	.	.	S	Bend	trans	81.2	20.3	170.2	0	0	0	0	0	115.5
529	Y	91	Very high	90.8	Very high	22 Å²	22	47.9 Å²	47.9	9%	0.086	29%	0.287	C	S	.	.			trans	-56.4	146.9	170.7	-179	-127.1	0	0	0	111.5	E520 I522 W584 V588 L614	E520-Y529 WeakPolarHBondContact OE2-CE2 3.11Å; E520-Y529 PolarHBondContact OE2-OH 3.4Å; I522-Y529 HydrophobicContact CD1-CD1 3.95Å; I522-Y529 HydrophobicContact CD1-CD2 3.54Å; I522-Y529 HydrophobicContact CD1-CE1 4.33Å; I522-Y529 HydrophobicContact CD1-CE2 3.96Å; I522-Y529 HydrophobicContact CD1-CG 3.54Å; Y529-W584 AromaticContact CD1-CD2 3.71Å; Y529-W584 HydrophobicContact CD1-CD2 3.71Å; Y529-W584 AromaticContact CD1-CE2 3.79Å; Y529-W584 AromaticContact CD1-CE3 3.52Å; Y529-W584 HydrophobicContact CD1-CE3 3.52Å; Y529-W584 AromaticContact CD1-CH2 3.63Å; Y529-W584 HydrophobicContact CD1-CH2 3.63Å; Y529-W584 AromaticContact CD1-CZ2 3.76Å; Y529-W584 HydrophobicContact CD1-CZ2 3.76Å; Y529-W584 AromaticContact CD1-CZ3 3.51Å; Y529-W584 HydrophobicContact CD1-CZ3 3.51Å; Y529-W584 HydrophobicContact CE1-CE3 4.19Å; Y529-W584 AromaticContact CE1-CH2 3.48Å; Y529-W584 HydrophobicContact CE1-CH2 3.48Å; Y529-W584 VanDerWaalsContact CE1-CH2 3.48Å; Y529-W584 AromaticContact CE1-CZ2 3.81Å; Y529-W584 HydrophobicContact CE1-CZ2 3.81Å; Y529-W584 AromaticContact CE1-CZ3 3.68Å; Y529-W584 HydrophobicContact CE1-CZ3 3.68Å; Y529-W584 HydrophobicContact CG-CD2 4.5Å; Y529-W584 HydrophobicContact CG-CE3 4.22Å; Y529-W584 HydrophobicContact CG-CZ3 4.44Å; Y529-W584 PolarHBondContact O-N 2.04Å; Y529-V588 HydrophobicContact CD1-CG2 4.1Å; Y529-V588 HydrophobicContact CG-CG2 4.37Å; Y529-L614 HydrophobicContact CE1-CD1 3.96Å; Y529-L614 HydrophobicContact CE1-CD2 3.82Å
530	S	91.8	Very high	90.8	Very high	65 Å²	65	47.1 Å²	47.1	46%	0.455	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	139.3	-179.8	61.1	0	0	0	0	112.9	L582	S530-L582 CarbonylContact C-O 3.56Å; S530-L582 WeakPolarHBondContact CA-O 2.96Å
531	L	93.4	Very high	90.9	Very high	11 Å²	11	45.3 Å²	45.3	6%	0.058	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	156.1	168.6	-60.8	177.9	0	0	0	110.8	L516 W545 S581 L582 W584 Y596 M612	L516-L531 HydrophobicContact CD2-CB 4.44Å; L531-W545 HydrophobicContact CB-CH2 3.63Å; L531-W545 HydrophobicContact CB-CZ3 3.76Å; L531-W545 HydrophobicContact CD1-CZ3 4.04Å; L531-S581 CarbonylContact O-C 3.58Å; L531-S581 WeakPolarHBondContact O-CA 3.05Å; L531-S581 VanDerWaalsContact O-CB 3.27Å; L531-S581 WeakPolarHBondContact O-CB 3.44Å; L531-L582 HydrophobicContact CB-CB 4.47Å; L531-L582 HydrophobicContact CD1-CD2 4.44Å; L531-L582 PolarHBondContact N-O 2.86Å; L531-L582 PolarHBondContact O-N 2.87Å; L531-W584 HydrophobicContact CD1-CH2 4.3Å; L531-W584 HydrophobicContact CD1-CZ3 4.48Å; L531-W584 HydrophobicContact CG-CH2 4.41Å; L531-W584 HydrophobicContact CG-CZ3 4.19Å; L531-Y596 HydrophobicContact CD1-CG 4.12Å; L531-M612 HydrophobicContact CD1-CE 3.76Å; L531-M612 HydrophobicContact CD2-CE 3.8Å; L531-M612 HydrophobicContact CD2-SD 3.89Å; L531-M612 HydrophobicContact CG-CE 4.38Å
532	S	93	Very high	91	Very high	81 Å²	81	46.8 Å²	46.8	57%	0.566	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.8	147	175.1	54.6	0	0	0	0	111.2	L516 S580	L516-S532 WeakPolarHBondContact CD2-O 3.21Å; S532-S580 WeakPolarHBondContact CA-O 3.38Å
533	C	93.5	Very high	91	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	142.1	-178.1	-172.8	0	0	0	0	108.8	W545 S580 C598	C533-W545 HydrophobicContact CB-CH2 3.76Å; C533-W545 HydrophobicContact CB-CZ2 3.62Å; C533-S580 PolarHBondContact N-O 3.24Å; C533-S580 PolarHBondContact O-N 3.07Å; C533-S580 VanDerWaalsContact O-O 3.1Å; C533-C598 HydrophobicContact CB-CB 3.69Å; C533-C598 WeakPolarHBondContact CB-SG 3.47Å; C533-C598 WeakPolarHBondContact SG-CB 3.25Å; C533-C598 CovalentContact SG-SG 2.03Å; C533-C598 PolarHBondContact SG-SG 3.14Å
534	T	94.5	Very high	91.1	Very high	16 Å²	16	41 Å²	41	10%	0.098	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	145	176.9	74.5	0	0	0	0	110.3	L512 G513 T514 V578 S579	L512-T534 CarbonylContact C-O 3.57Å; L512-T534 WeakPolarHBondContact CA-O 3.34Å; G513-T534 PolarHBondContact N-O 3.47Å; T514-T534 HydrophobicContact CG2-CG2 4.23Å; T514-T534 PolarHBondContact N-OG1 3.13Å; T514-T534 VanDerWaalsContact N-OG1 3.12Å; T514-T534 PolarHBondContact OG1-N 2.93Å; T514-T534 VanDerWaalsContact OG1-N 3.11Å; T514-T534 PolarHBondContact OG1-OG1 3.12Å; T534-V578 CarbonylContact C-O 3.57Å; T534-V578 VanDerWaalsContact CA-O 3.28Å; T534-V578 WeakPolarHBondContact CA-O 3.5Å; T534-S579 WeakPolarHBondContact CG2-OG 3.48Å
535	A	94.2	Very high	91.4	Very high	0 Å²	0	40 Å²	40	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	152.1	-179.1	0	0	0	0	0	111.2	H511 L512 P541 I543 K577 V578 A600	H511-A535 CarbonylContact O-C 3.52Å; H511-A535 VanDerWaalsContact O-CA 3.29Å; H511-A535 WeakPolarHBondContact O-CA 3.44Å; L512-A535 HydrophobicContact CD2-CB 3.99Å; A535-P541 HydrophobicContact CB-CB 4.03Å; A535-P541 HydrophobicContact CB-CG 4.23Å; A535-I543 HydrophobicContact CB-CD1 3.9Å; A535-I543 HydrophobicContact CB-CG1 4.01Å; A535-K577 WeakPolarHBondContact O-CA 3.26Å; A535-V578 HydrophobicContact CB-CG1 3.88Å; A535-V578 PolarHBondContact N-O 2.84Å; A535-V578 PolarHBondContact O-N 2.76Å; A535-A600 HydrophobicContact CB-CB 3.44Å; A535-A600 VanDerWaalsContact CB-CB 3.44Å
536	H	93.3	Very high	91.6	Very high	49 Å²	49	39.7 Å²	39.7	23%	0.227	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	144.2	-178.8	-69.2	-111.5	0	0	0	109.4	A510 H511 F576	A510-H536 CarbonylContact C-O 3.4Å; A510-H536 VanDerWaalsContact CA-O 3.3Å; A510-H536 WeakPolarHBondContact CA-O 3.35Å; H511-H536 WeakPolarHBondContact CE1-CB 3.38Å; H511-H536 PolarHBondContact N-O 3.44Å; H511-H536 PolarHBondContact ND1-O 3.25Å; H511-H536 WeakPolarHBondContact NE2-CB 3.37Å; H511-H536 PolarHBondContact O-N 2.03Å; H536-F576 CarbonylContact C-O 3.46Å; H536-F576 VanDerWaalsContact CA-O 3.29Å; H536-F576 WeakPolarHBondContact CA-O 3.41Å
537	G	92.2	Very high	91.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.3	172.6	178.1	0	0	0	0	0	114.4	E508 P539 F576	E508-G537 VanDerWaalsContact OE2-C 3.25Å; E508-G537 WeakPolarHBondContact OE2-CA 3.29Å; E508-G537 PolarHBondContact OE2-N 3Å; G537-P539 CarbonylContact C-O 3.48Å; G537-P539 VanDerWaalsContact C-O 3.24Å; G537-F576 PolarHBondContact N-O 2.81Å; G537-F576 WeakPolarHBondContact O-CB 3.45Å; G537-F576 PolarHBondContact O-N 3.21Å
538	N	90.9	Very high	91.3	Very high	18 Å²	18	34 Å²	34	10%	0.096	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	110.8	170.9	-168	-15.6	0	0	0	109.6	L480 R507 E508 P571 C574 F576 N602	L480-N538 HydrophobicContact CD2-CB 4.25Å; R507-N538 CarbonylContact C-O 3.59Å; R507-N538 VanDerWaalsContact CA-O 3.32Å; R507-N538 WeakPolarHBondContact CA-O 3.38Å; R507-N538 WeakPolarHBondContact CB-O 3.42Å; E508-N538 HydrophobicContact CB-CB 4Å; E508-N538 PolarHBondContact N-O 3.49Å; E508-N538 PolarHBondContact O-N 3.49Å; N538-P571 PolarHBondContact ND2-O 2.7Å; N538-P571 VanDerWaalsContact ND2-O 3.13Å; N538-C574 WeakPolarHBondContact CB-O 3.37Å; N538-C574 PolarHBondContact ND2-O 2.03Å; N538-F576 HydrophobicContact CB-CD2 4.22Å; N538-N602 PolarHBondContact N-ND2 3.28Å
539	P	90.7	Very high	91.2	Very high	54 Å²	54	38.4 Å²	38.4	35%	0.351	21%	0.213	S	C	.	.	S	Bend	cis	-62.6	166.4	5.5	-24.1	35.9	0	0	0	114.9	G537 P541 N602	G537-P539 CarbonylContact C-O 3.48Å; G537-P539 VanDerWaalsContact C-O 3.24Å; P539-P541 WeakPolarHBondContact O-CD 3.35Å; P539-N602 VanDerWaalsContact O-CB 3.28Å; P539-N602 WeakPolarHBondContact O-CB 3.21Å; P539-N602 PolarHBondContact O-ND2 2.76Å
540	L	89.6	Confident	90.8	Very high	78 Å²	78	41.5 Å²	41.5	41%	0.408	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-50.7	124.4	176.1	177.3	74.8	0	0	0	111	P563 F576 V578	L540-P563 HydrophobicContact CD1-CB 4.08Å; L540-P563 HydrophobicContact CD2-CB 3.96Å; L540-F576 HydrophobicContact CB-CB 4.25Å; L540-F576 HydrophobicContact CD1-CB 3.73Å; L540-V578 HydrophobicContact CD1-CB 4.14Å
541	P	92.3	Very high	90.4	Very high	4 Å²	4	42.4 Å²	42.4	3%	0.026	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-65.2	144.8	178.2	-22	33.1	0	0	0	114	A510 A535 P539 V578 A600 D601	A510-P541 HydrophobicContact CB-CB 4.04Å; A510-P541 HydrophobicContact CB-CG 4.02Å; A535-P541 HydrophobicContact CB-CB 4.03Å; A535-P541 HydrophobicContact CB-CG 4.23Å; P539-P541 WeakPolarHBondContact O-CD 3.35Å; P541-V578 HydrophobicContact CB-CG1 3.96Å; P541-V578 HydrophobicContact CG-CG1 4.4Å; P541-V578 WeakPolarHBondContact O-CG1 3.37Å; P541-A600 HydrophobicContact CB-CB 4.46Å; P541-D601 CarbonylContact C-O 3.57Å; P541-D601 WeakPolarHBondContact CA-O 3.2Å
542	N	92.6	Very high	90	Very high	103 Å²	103	43.3 Å²	43.3	55%	0.551	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	123.2	163.3	-176.2	24.2	0	0	0	108.7	A600 D601	N542-A600 WeakPolarHBondContact O-CA 3.41Å; N542-D601 PolarHBondContact N-O 2.68Å; N542-D601 PolarHBondContact O-N 2.67Å; N542-D601 VanDerWaalsContact O-N 3.07Å
543	I	92.7	Very high	88.6	Confident	6 Å²	6	43.6 Å²	43.6	3%	0.031	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	122.7	172.6	-66.9	173.5	0	0	0	109.3	A535 V578 C598 S599 A600	A535-I543 HydrophobicContact CB-CD1 3.9Å; A535-I543 HydrophobicContact CB-CG1 4.01Å; I543-V578 HydrophobicContact CD1-CG1 3.76Å; I543-V578 HydrophobicContact CD1-CG2 4.41Å; I543-V578 HydrophobicContact CG1-CG1 3.93Å; I543-C598 VanDerWaalsContact CG2-SG 3.51Å; I543-S599 WeakPolarHBondContact CA-O 3.38Å; I543-A600 HydrophobicContact CG1-CB 4.11Å
544	T	92.4	Very high	87.2	Confident	43 Å²	43	48.6 Å²	48.6	26%	0.264	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	147.7	173	54.4	0	0	0	0	110.4	Y546 S599	T544-Y546 VanDerWaalsContact OG1-CE2 3.3Å; T544-Y546 WeakPolarHBondContact OG1-CE2 3.5Å; T544-S599 PolarHBondContact N-O 2.89Å; T544-S599 PolarHBondContact O-N 2.88Å; T544-S599 PolarHBondContact OG1-O 3.31Å
545	W	92.6	Very high	85.9	Confident	11 Å²	11	52.8 Å²	52.8	4%	0.042	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	134.7	179.9	-67.4	85.8	0	0	0	110.5	L516 L531 C533 I552 S580 L582 T597 C598	L516-W545 HydrophobicContact CD1-CZ3 4.03Å; L516-W545 HydrophobicContact CD2-CH2 4.01Å; L516-W545 HydrophobicContact CD2-CZ3 4.1Å; L531-W545 HydrophobicContact CB-CH2 3.63Å; L531-W545 HydrophobicContact CB-CZ3 3.76Å; L531-W545 HydrophobicContact CD1-CZ3 4.04Å; C533-W545 HydrophobicContact CB-CH2 3.76Å; C533-W545 HydrophobicContact CB-CZ2 3.62Å; W545-I552 HydrophobicContact CB-CD1 3.91Å; W545-I552 HydrophobicContact CB-CG1 4.45Å; W545-I552 PolarHBondContact O-N 2.82Å; W545-S580 PolarHBondContact NE1-OG 2.77Å; W545-L582 HydrophobicContact CB-CD1 4.44Å; W545-L582 HydrophobicContact CD2-CB 3.73Å; W545-L582 HydrophobicContact CD2-CD2 4.22Å; W545-L582 HydrophobicContact CD2-CG 4.45Å; W545-L582 HydrophobicContact CE3-CB 3.91Å; W545-L582 HydrophobicContact CE3-CD2 3.82Å; W545-L582 HydrophobicContact CE3-CG 4.46Å; W545-L582 HydrophobicContact CG-CB 4.22Å; W545-L582 HydrophobicContact CG-CD1 4.47Å; W545-L582 HydrophobicContact CH2-CB 4.21Å; W545-L582 HydrophobicContact CZ2-CB 4.05Å; W545-L582 HydrophobicContact CZ3-CB 4.14Å; W545-L582 HydrophobicContact CZ3-CD2 4.33Å; W545-T597 WeakPolarHBondContact CA-O 3.29Å; W545-C598 HydrophobicContact CD2-CB 4.48Å; W545-C598 HydrophobicContact CE3-CB 4.17Å; W545-C598 HydrophobicContact CH2-CB 4.27Å; W545-C598 HydrophobicContact CZ3-CB 4.07Å
546	Y	91.4	Very high	85.1	Confident	44 Å²	44	54.9 Å²	54.9	17%	0.173	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	149.6	179.3	-58.9	-100.7	0	0	0	110.9	T544 E550 P551 Y596 T597	T544-Y546 VanDerWaalsContact OG1-CE2 3.3Å; T544-Y546 WeakPolarHBondContact OG1-CE2 3.5Å; Y546-E550 CarbonylContact C-O 3.58Å; Y546-E550 WeakPolarHBondContact CA-O 3.46Å; Y546-E550 WeakPolarHBondContact CB-O 3.42Å; Y546-P551 HydrophobicContact CD1-CG 4.2Å; Y546-P551 HydrophobicContact CE1-CB 4.44Å; Y546-P551 HydrophobicContact CE1-CG 3.9Å; Y546-Y596 WeakPolarHBondContact O-CA 3.33Å; Y546-T597 PolarHBondContact N-O 3.07Å; Y546-T597 PolarHBondContact O-N 3.49Å
547	F	87.8	Confident	84.7	Confident	49 Å²	49	53.5 Å²	53.5	22%	0.215	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	118	170.4	176.1	-108.3	0	0	0	108.3	N549 E550 I552 K593 F595 Y596	F547-N549 PolarHBondContact O-N 2.86Å; F547-E550 PolarHBondContact N-O 3.42Å; F547-E550 PolarHBondContact O-N 3.14Å; F547-I552 HydrophobicContact CB-CD1 4.1Å; F547-I552 HydrophobicContact CB-CG1 3.79Å; F547-K593 WeakPolarHBondContact CZ-O 3.3Å; F547-F595 CarbonylContact C-O 3.56Å; F547-F595 WeakPolarHBondContact CA-O 3.23Å; F547-Y596 HydrophobicContact CB-CE1 4.25Å; F547-Y596 HydrophobicContact CD2-CD1 4.1Å; F547-Y596 HydrophobicContact CD2-CD2 4.15Å; F547-Y596 AromaticContact CD2-CE1 3.59Å; F547-Y596 HydrophobicContact CD2-CE1 3.59Å; F547-Y596 AromaticContact CD2-CE2 3.64Å; F547-Y596 HydrophobicContact CD2-CE2 3.64Å; F547-Y596 HydrophobicContact CD2-CG 4.36Å; F547-Y596 AromaticContact CD2-CZ 3.33Å; F547-Y596 HydrophobicContact CE2-CD2 4.48Å; F547-Y596 HydrophobicContact CE2-CE1 4.34Å; F547-Y596 AromaticContact CE2-CE2 3.71Å; F547-Y596 HydrophobicContact CE2-CE2 3.71Å; F547-Y596 AromaticContact CE2-CZ 3.62Å; F547-Y596 HydrophobicContact CG-CE1 4.27Å
548	D	82.7	Confident	84.4	Confident	23 Å²	23	58.2 Å²	58.2	12%	0.123	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.4	44.5	-172.2	-58.4	-30.3	0	0	0	113.4	E550 F595 F782	D548-E550 PolarHBondContact O-N 2.66Å; D548-F595 PolarHBondContact N-O 2.72Å; D548-F595 PolarHBondContact OD1-N 3.21Å; D548-F782 WeakPolarHBondContact OD1-CE2 3.49Å; D548-F782 WeakPolarHBondContact OD2-CD2 3.21Å; D548-F782 WeakPolarHBondContact OD2-CE2 3.5Å
549	N	82.5	Confident	84.3	Confident	130 Å²	130	60.4 Å²	60.4	70%	0.695	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	3.4	-176.9	-50.7	-28.2	0	0	0	115.7	F547	F547-N549 PolarHBondContact O-N 2.86Å
550	E	82	Confident	84.1	Confident	86 Å²	86	60.5 Å²	60.5	40%	0.402	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	142.1	169.4	-50.3	-63.8	168.8	0	0	110.7	Y546 F547 D548 I552 R779 K781	Y546-E550 CarbonylContact C-O 3.58Å; Y546-E550 WeakPolarHBondContact CA-O 3.46Å; Y546-E550 WeakPolarHBondContact CB-O 3.42Å; F547-E550 PolarHBondContact N-O 3.42Å; F547-E550 PolarHBondContact O-N 3.14Å; D548-E550 PolarHBondContact O-N 2.66Å; E550-I552 PolarHBondContact O-N 3.38Å; E550-R779 IonicContact OE1-NH1 2.79Å; E550-K781 IonicContact OE1-NZ 3.15Å; E550-K781 PolarHBondContact OE1-NZ 2.78Å
551	P	84.3	Confident	84	Confident	84 Å²	84	59.4 Å²	59.4	55%	0.545	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	134.8	171.9	-21.9	32.4	0	0	0	111.9	Y546 S553	Y546-P551 HydrophobicContact CD1-CG 4.2Å; Y546-P551 HydrophobicContact CE1-CB 4.44Å; Y546-P551 HydrophobicContact CE1-CG 3.9Å; P551-S553 PolarHBondContact O-N 2.89Å
552	I	84.1	Confident	83.8	Confident	31 Å²	31	63.1 Å²	63.1	16%	0.159	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-70.7	121.3	-176.9	-65.2	-178.2	0	0	0	111.5	W545 F547 E550 F557 L582 Y596	W545-I552 HydrophobicContact CB-CD1 3.91Å; W545-I552 HydrophobicContact CB-CG1 4.45Å; W545-I552 PolarHBondContact O-N 2.82Å; F547-I552 HydrophobicContact CB-CD1 4.1Å; F547-I552 HydrophobicContact CB-CG1 3.79Å; E550-I552 PolarHBondContact O-N 3.38Å; I552-F557 HydrophobicContact CG2-CB 3.79Å; I552-F557 HydrophobicContact CG2-CD2 3.33Å; I552-F557 HydrophobicContact CG2-CE2 4.07Å; I552-F557 HydrophobicContact CG2-CG 3.69Å; I552-L582 HydrophobicContact CD1-CD1 3.77Å; I552-L582 HydrophobicContact CD1-CD2 3.54Å; I552-L582 HydrophobicContact CD1-CG 4.33Å; I552-L582 HydrophobicContact CG2-CD1 4.19Å; I552-Y596 HydrophobicContact CD1-CD1 3.86Å; I552-Y596 HydrophobicContact CD1-CE1 3.91Å
553	S	65.4	Low	83.6	Confident	87 Å²	87	62.1 Å²	62.1	61%	0.608	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-80.6	139.8	172.9	-172	0	0	0	0	111.9	P551 S555	P551-S553 PolarHBondContact O-N 2.89Å; S553-S555 VanDerWaalsContact C-N 3.27Å; S553-S555 PolarHBondContact O-N 3.38Å; S553-S555 VanDerWaalsContact O-N 3.14Å
554	S	62.3	Low	83.1	Confident	104 Å²	104	65.8 Å²	65.8	73%	0.727	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	6.3	-164.7	55.7	0	0	0	0	116.3	F557	S554-F557 WeakPolarHBondContact CA-O 3.39Å
555	S	68.9	Low	81.9	Confident	105 Å²	105	69 Å²	69	73%	0.734	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-31.7	-178	56.1	0	0	0	0	113.6	S553	S553-S555 VanDerWaalsContact C-N 3.27Å; S553-S555 PolarHBondContact O-N 3.38Å; S553-S555 VanDerWaalsContact O-N 3.14Å
556	H	76.9	Confident	80.8	Confident	43 Å²	43	73.3 Å²	73.3	20%	0.199	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	-12.6	-178.7	-165.2	-108.2	0	0	0	113.7	W584 T585 S586 D592	H556-W584 AromaticContact CE1-CD1 3.06Å; H556-W584 AromaticContact CE1-NE1 3.45Å; H556-W584 PolarHBondContact CE1-NE1 2.62Å; H556-T585 PolarHBondContact O-N 2.79Å; H556-T585 PolarHBondContact O-OG1 3.3Å; H556-S586 WeakPolarHBondContact NE2-CB 3.25Å; H556-S586 PolarHBondContact NE2-OG 3.07Å; H556-D592 IonicContact CE1-OD1 3.21Å; H556-D592 PolarHBondContact CE1-OD1 2.84Å; H556-D592 IonicContact CE1-OD2 2.75Å; H556-D592 PolarHBondContact CE1-OD2 2.9Å; H556-D592 IonicContact ND1-OD1 3.81Å
557	F	85.3	Confident	79.7	Confident	21 Å²	21	77.4 Å²	77.4	9%	0.092	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	135.4	-174.8	-50.4	-89.4	0	0	0	111.7	I552 S554 L582 K583 W584 Y596	I552-F557 HydrophobicContact CG2-CB 3.79Å; I552-F557 HydrophobicContact CG2-CD2 3.33Å; I552-F557 HydrophobicContact CG2-CE2 4.07Å; I552-F557 HydrophobicContact CG2-CG 3.69Å; S554-F557 WeakPolarHBondContact CA-O 3.39Å; F557-L582 HydrophobicContact CB-CD1 3.67Å; F557-L582 HydrophobicContact CD1-CD1 4.12Å; F557-L582 HydrophobicContact CD1-CG 4.33Å; F557-L582 HydrophobicContact CG-CD1 4.09Å; F557-K583 CarbonylContact C-O 3.53Å; F557-K583 WeakPolarHBondContact CA-O 2.85Å; F557-W584 HydrophobicContact CD1-CD2 4.11Å; F557-W584 HydrophobicContact CD1-CE3 4.36Å; F557-W584 HydrophobicContact CD1-CG 4.44Å; F557-W584 AromaticContact CE1-CD2 3.92Å; F557-W584 HydrophobicContact CE1-CD2 3.92Å; F557-W584 AromaticContact CE1-CE2 3.57Å; F557-W584 HydrophobicContact CE1-CE3 4.45Å; F557-W584 HydrophobicContact CE1-CG 4.29Å; F557-W584 HydrophobicContact CE1-CH2 4.37Å; F557-W584 AromaticContact CE1-CZ2 3.85Å; F557-W584 HydrophobicContact CE1-CZ2 3.85Å; F557-W584 AromaticContact CE1-NE1 3.72Å; F557-Y596 HydrophobicContact CE1-CE1 4.09Å; F557-Y596 HydrophobicContact CZ-CE1 4.35Å; F557-Y596 WeakPolarHBondContact CZ-OH 3.28Å
558	I	85.4	Confident	79	Confident	98 Å²	98	77.2 Å²	77.2	50%	0.503	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	116.1	164.7	-68.5	163.3	0	0	0	107.4	K583 T585	I558-K583 PolarHBondContact N-O 2.87Å; I558-K583 PolarHBondContact O-N 3.16Å; I558-T585 HydrophobicContact CD1-CG2 3.93Å; I558-T585 HydrophobicContact CG1-CG2 3.76Å
559	V	87.6	Confident	78.9	Confident	65 Å²	65	85.2 Å²	85.2	39%	0.394	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	132	163.3	178.8	0	0	0	0	108	S581 L582	V559-S581 WeakPolarHBondContact CA-O 3.38Å; V559-L582 HydrophobicContact CG2-CD1 3.66Å
560	S	86.8	Confident	78.9	Confident	55 Å²	55	82.6 Å²	82.6	39%	0.385	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	122.7	169	53.5	0	0	0	0	110.4	S580 S581	S560-S580 CarbonylContact O-C 3.56Å; S560-S580 VanDerWaalsContact O-CA 3.31Å; S560-S580 WeakPolarHBondContact O-CA 3.11Å; S560-S580 PolarHBondContact O-OG 3.1Å; S560-S581 PolarHBondContact N-O 2.85Å; S560-S581 PolarHBondContact O-N 3.39Å; S560-S581 PolarHBondContact OG-OG 2.94Å
561	S	87.6	Confident	78.9	Confident	55 Å²	55	82.3 Å²	82.3	39%	0.385	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	125.3	178.2	-62.1	0	0	0	0	109.7	S580	S561-S580 WeakPolarHBondContact OG-CB 3.21Å; S561-S580 PolarHBondContact OG-OG 3.23Å
562	T	89.4	Confident	78.9	Confident	82 Å²	82	80.9 Å²	80.9	50%	0.503	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	119.3	-178.2	52.8	0	0	0	0	110	S579	T562-S579 PolarHBondContact N-O 3.38Å; T562-S579 PolarHBondContact O-N 3.23Å; T562-S579 PolarHBondContact OG1-O 3.43Å
563	P	87	Confident	79.1	Confident	83 Å²	83	84 Å²	84	54%	0.539	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	141.8	165.8	28.7	-32.7	0	0	0	109.8	L540	L540-P563 HydrophobicContact CD1-CB 4.08Å; L540-P563 HydrophobicContact CD2-CB 3.96Å
564	E	82.7	Confident	80.2	Confident	82 Å²	82	80 Å²	80	38%	0.383	47%	0.471	S	S	.	.			trans	-85.7	133.4	176.1	-77.1	175	-140.4	0	0	110.7	Q566 K577 S579	E564-Q566 PolarHBondContact O-N 2.94Å; E564-K577 PolarHBondContact N-O 3.1Å; E564-K577 WeakPolarHBondContact OE1-CE 3.44Å; E564-K577 IonicContact OE1-NZ 2.77Å; E564-K577 PolarHBondContact OE1-NZ 2.86Å; E564-K577 WeakPolarHBondContact OE2-CD 3.2Å; E564-K577 IonicContact OE2-NZ 2.67Å; E564-K577 PolarHBondContact OE2-NZ 3.39Å; E564-S579 PolarHBondContact OE1-OG 2.93Å
565	A	67.1	Low	81.5	Confident	112 Å²	112	76.5 Å²	76.5	93%	0.926	45%	0.446	S	S	*	.			trans	-73.8	93.2	-173.5	0	0	0	0	0	111.4
566	Q	68.7	Low	82.6	Confident	100 Å²	100	74 Å²	74	47%	0.467	42%	0.423	S	S	.	.			trans	-100.9	117.3	-177	-169.8	166.9	-26.6	0	0	111.2	E564 C568 S575	E564-Q566 PolarHBondContact O-N 2.94Å; Q566-C568 PolarHBondContact O-N 2.88Å; Q566-C568 VanDerWaalsContact O-N 3.13Å; Q566-S575 PolarHBondContact NE2-O 3.1Å; Q566-S575 PolarHBondContact OE1-O 2.85Å; Q566-S575 VanDerWaalsContact OE1-O 3.08Å
567	S	68.8	Low	83.3	Confident	130 Å²	130	74.4 Å²	74.4	91%	0.909	42%	0.423	S	S	*	.			trans	-73.6	102.2	175.7	-175.7	0	0	0	0	110
568	C	74.2	Confident	83.6	Confident	46 Å²	46	73.7 Å²	73.7	31%	0.311	42%	0.421	S	S	.	.			trans	-138.8	120.8	-179	-178.3	0	0	0	0	109	Q566 I570 C574	Q566-C568 PolarHBondContact O-N 2.88Å; Q566-C568 VanDerWaalsContact O-N 3.13Å; C568-I570 VanDerWaalsContact C-N 3.34Å; C568-I570 PolarHBondContact O-N 2.84Å; C568-C574 HydrophobicContact CB-CB 3.94Å; C568-C574 WeakPolarHBondContact CB-SG 3.08Å; C568-C574 WeakPolarHBondContact SG-CB 3.47Å; C568-C574 CovalentContact SG-SG 2.03Å; C568-C574 PolarHBondContact SG-SG 2.6Å
569	E	79.7	Confident	84	Confident	191 Å²	191	70.1 Å²	70.1	89%	0.893	41%	0.405	S	S	*	.	S	Bend	trans	-72.6	-24.8	-167.9	-61.4	179.7	163.5	0	0	113.8
570	I	82.3	Confident	84.3	Confident	75 Å²	75	67.3 Å²	67.3	39%	0.385	39%	0.388	S	S	.	.			trans	-128.5	98.4	-177.2	-56.2	172.7	0	0	0	108	C568 E572 R573 C574	C568-I570 VanDerWaalsContact C-N 3.34Å; C568-I570 PolarHBondContact O-N 2.84Å; I570-E572 HydrophobicContact CG2-CB 4.48Å; I570-E572 PolarHBondContact O-N 2.92Å; I570-R573 HydrophobicContact CB-CB 4.34Å; I570-R573 HydrophobicContact CB-CG 4.2Å; I570-R573 HydrophobicContact CG2-CB 4.37Å; I570-R573 HydrophobicContact CG2-CG 3.8Å; I570-R573 PolarHBondContact O-N 3.09Å; I570-C574 PolarHBondContact O-SG 2.94Å
571	P	83.5	Confident	84.5	Confident	80 Å²	80	66.3 Å²	66.3	52%	0.519	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-50.3	-34.1	-175.1	-33.2	38	0	0	0	115.7	N538 R573 C574 F576	N538-P571 PolarHBondContact ND2-O 2.7Å; N538-P571 VanDerWaalsContact ND2-O 3.13Å; P571-R573 PolarHBondContact O-N 2.98Å; P571-C574 WeakPolarHBondContact CA-SG 3.33Å; P571-C574 PolarHBondContact O-N 2.86Å; P571-C574 PolarHBondContact O-SG 2.88Å; P571-F576 HydrophobicContact CB-CZ 4.18Å; P571-F576 WeakPolarHBondContact O-CE2 3.01Å; P571-F576 WeakPolarHBondContact O-CZ 3.43Å
572	E	83.4	Confident	84.8	Confident	54 Å²	54	63.7 Å²	63.7	25%	0.252	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-69.8	-11.5	178.5	-69.1	146.9	-145.8	0	0	113.9	A483 K503 I570	A483-E572 HydrophobicContact CB-CB 4.11Å; K503-E572 VanDerWaalsContact CE-CD 3.44Å; K503-E572 WeakPolarHBondContact CE-OE1 3.32Å; K503-E572 WeakPolarHBondContact CE-OE2 3.41Å; K503-E572 IonicContact NZ-OE1 3.64Å; K503-E572 PolarHBondContact NZ-OE1 2.93Å; K503-E572 IonicContact NZ-OE2 2.59Å; K503-E572 PolarHBondContact NZ-OE2 2.96Å; K503-E572 VanDerWaalsContact NZ-OE2 3.14Å; I570-E572 HydrophobicContact CG2-CB 4.48Å; I570-E572 PolarHBondContact O-N 2.92Å
573	R	88.4	Confident	84.9	Confident	96 Å²	96	64.7 Å²	64.7	36%	0.362	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-109.7	3.4	-178.2	-59.6	-171.4	169.8	-175.8	-7.4	113.6	L480 S481 A483 I570 P571	L480-R573 WeakPolarHBondContact O-CG 3.37Å; S481-R573 PolarHBondContact O-NH2 3.44Å; A483-R573 HydrophobicContact CB-CG 4.39Å; A483-R573 VanDerWaalsContact O-CZ 3.25Å; A483-R573 PolarHBondContact O-NE 3.45Å; A483-R573 PolarHBondContact O-NH2 2.75Å; I570-R573 HydrophobicContact CB-CB 4.34Å; I570-R573 HydrophobicContact CB-CG 4.2Å; I570-R573 HydrophobicContact CG2-CB 4.37Å; I570-R573 HydrophobicContact CG2-CG 3.8Å; I570-R573 PolarHBondContact O-N 3.09Å; P571-R573 PolarHBondContact O-N 2.98Å
574	C	88.1	Confident	85.1	Confident	3 Å²	3	60.9 Å²	60.9	2%	0.02	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-94.8	147.4	-176.4	-39.2	0	0	0	0	111.7	L480 N538 C568 I570 P571 F576	L480-C574 WeakPolarHBondContact CD1-O 3.26Å; N538-C574 WeakPolarHBondContact CB-O 3.37Å; N538-C574 PolarHBondContact ND2-O 2.03Å; C568-C574 HydrophobicContact CB-CB 3.94Å; C568-C574 WeakPolarHBondContact CB-SG 3.08Å; C568-C574 WeakPolarHBondContact SG-CB 3.47Å; C568-C574 CovalentContact SG-SG 2.03Å; C568-C574 PolarHBondContact SG-SG 2.6Å; I570-C574 PolarHBondContact O-SG 2.94Å; P571-C574 WeakPolarHBondContact CA-SG 3.33Å; P571-C574 PolarHBondContact O-N 2.86Å; P571-C574 PolarHBondContact O-SG 2.88Å; C574-F576 HydrophobicContact CB-CD1 4.3Å; C574-F576 HydrophobicContact CB-CD2 4.47Å; C574-F576 HydrophobicContact CB-CE1 3.88Å; C574-F576 HydrophobicContact CB-CE2 4.07Å; C574-F576 HydrophobicContact CB-CZ 3.75Å
575	S	90.4	Very high	85.2	Confident	30 Å²	30	60.6 Å²	60.6	21%	0.21	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-91.7	122.8	153.5	177.8	0	0	0	0	107.3	E508 Q566	E508-S575 VanDerWaalsContact CD-OG 3.29Å; E508-S575 PolarHBondContact OE1-OG 3Å; E508-S575 WeakPolarHBondContact OE2-CA 3.47Å; E508-S575 WeakPolarHBondContact OE2-CB 3.45Å; E508-S575 PolarHBondContact OE2-OG 3.13Å; Q566-S575 PolarHBondContact NE2-O 3.1Å; Q566-S575 PolarHBondContact OE1-O 2.85Å; Q566-S575 VanDerWaalsContact OE1-O 3.08Å
576	F	90.7	Very high	86.1	Confident	54 Å²	54	57.3 Å²	57.3	24%	0.237	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	137.7	-179	-60.7	-78.3	0	0	0	111.2	H536 G537 N538 L540 P571 C574	H536-F576 CarbonylContact C-O 3.46Å; H536-F576 VanDerWaalsContact CA-O 3.29Å; H536-F576 WeakPolarHBondContact CA-O 3.41Å; G537-F576 PolarHBondContact N-O 2.81Å; G537-F576 WeakPolarHBondContact O-CB 3.45Å; G537-F576 PolarHBondContact O-N 3.21Å; N538-F576 HydrophobicContact CB-CD2 4.22Å; L540-F576 HydrophobicContact CB-CB 4.25Å; L540-F576 HydrophobicContact CD1-CB 3.73Å; P571-F576 HydrophobicContact CB-CZ 4.18Å; P571-F576 WeakPolarHBondContact O-CE2 3.01Å; P571-F576 WeakPolarHBondContact O-CZ 3.43Å; C574-F576 HydrophobicContact CB-CD1 4.3Å; C574-F576 HydrophobicContact CB-CD2 4.47Å; C574-F576 HydrophobicContact CB-CE1 3.88Å; C574-F576 HydrophobicContact CB-CE2 4.07Å; C574-F576 HydrophobicContact CB-CZ 3.75Å
577	K	92.2	Very high	87.1	Confident	50 Å²	50	54 Å²	54	22%	0.217	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	136.7	179.4	-173.3	-175.8	173.3	-148.2	0	112.2	A535 E564	A535-K577 WeakPolarHBondContact O-CA 3.26Å; E564-K577 PolarHBondContact N-O 3.1Å; E564-K577 WeakPolarHBondContact OE1-CE 3.44Å; E564-K577 IonicContact OE1-NZ 2.77Å; E564-K577 PolarHBondContact OE1-NZ 2.86Å; E564-K577 WeakPolarHBondContact OE2-CD 3.2Å; E564-K577 IonicContact OE2-NZ 2.67Å; E564-K577 PolarHBondContact OE2-NZ 3.39Å
578	V	92.6	Very high	88.1	Confident	6 Å²	6	47.8 Å²	47.8	4%	0.036	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	140.4	169.4	59.7	0	0	0	0	110.3	T534 A535 L540 P541 I543	T534-V578 CarbonylContact C-O 3.57Å; T534-V578 VanDerWaalsContact CA-O 3.28Å; T534-V578 WeakPolarHBondContact CA-O 3.5Å; A535-V578 HydrophobicContact CB-CG1 3.88Å; A535-V578 PolarHBondContact N-O 2.84Å; A535-V578 PolarHBondContact O-N 2.76Å; L540-V578 HydrophobicContact CD1-CB 4.14Å; P541-V578 HydrophobicContact CB-CG1 3.96Å; P541-V578 HydrophobicContact CG-CG1 4.4Å; P541-V578 WeakPolarHBondContact O-CG1 3.37Å; I543-V578 HydrophobicContact CD1-CG1 3.76Å; I543-V578 HydrophobicContact CD1-CG2 4.41Å; I543-V578 HydrophobicContact CG1-CG1 3.93Å
579	S	93.2	Very high	88.8	Confident	24 Å²	24	49.4 Å²	49.4	17%	0.168	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	128.8	173.6	-76	0	0	0	0	109.2	T534 T562 E564	T534-S579 WeakPolarHBondContact CG2-OG 3.48Å; T562-S579 PolarHBondContact N-O 3.38Å; T562-S579 PolarHBondContact O-N 3.23Å; T562-S579 PolarHBondContact OG1-O 3.43Å; E564-S579 PolarHBondContact OE1-OG 2.93Å
580	S	93.3	Very high	89.1	Confident	5 Å²	5	42.7 Å²	42.7	4%	0.035	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	148.5	-178.5	-170.1	0	0	0	0	111.4	S532 C533 W545 S560 S561	S532-S580 WeakPolarHBondContact CA-O 3.38Å; C533-S580 PolarHBondContact N-O 3.24Å; C533-S580 PolarHBondContact O-N 3.07Å; C533-S580 VanDerWaalsContact O-O 3.1Å; W545-S580 PolarHBondContact NE1-OG 2.77Å; S560-S580 CarbonylContact O-C 3.56Å; S560-S580 VanDerWaalsContact O-CA 3.31Å; S560-S580 WeakPolarHBondContact O-CA 3.11Å; S560-S580 PolarHBondContact O-OG 3.1Å; S561-S580 WeakPolarHBondContact OG-CB 3.21Å; S561-S580 PolarHBondContact OG-OG 3.23Å
581	S	92.3	Very high	89.2	Confident	35 Å²	35	42.4 Å²	42.4	25%	0.245	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	145.5	172.5	62.4	0	0	0	0	112.2	L531 V559 S560	L531-S581 CarbonylContact O-C 3.58Å; L531-S581 WeakPolarHBondContact O-CA 3.05Å; L531-S581 VanDerWaalsContact O-CB 3.27Å; L531-S581 WeakPolarHBondContact O-CB 3.44Å; V559-S581 WeakPolarHBondContact CA-O 3.38Å; S560-S581 PolarHBondContact N-O 2.85Å; S560-S581 PolarHBondContact O-N 3.39Å; S560-S581 PolarHBondContact OG-OG 2.94Å
582	L	92.2	Very high	89.3	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	115.4	176.3	175.2	74.4	0	0	0	107.6	S530 L531 W545 I552 F557 V559 W584 Y596	S530-L582 CarbonylContact C-O 3.56Å; S530-L582 WeakPolarHBondContact CA-O 2.96Å; L531-L582 HydrophobicContact CB-CB 4.47Å; L531-L582 HydrophobicContact CD1-CD2 4.44Å; L531-L582 PolarHBondContact N-O 2.86Å; L531-L582 PolarHBondContact O-N 2.87Å; W545-L582 HydrophobicContact CB-CD1 4.44Å; W545-L582 HydrophobicContact CD2-CB 3.73Å; W545-L582 HydrophobicContact CD2-CD2 4.22Å; W545-L582 HydrophobicContact CD2-CG 4.45Å; W545-L582 HydrophobicContact CE3-CB 3.91Å; W545-L582 HydrophobicContact CE3-CD2 3.82Å; W545-L582 HydrophobicContact CE3-CG 4.46Å; W545-L582 HydrophobicContact CG-CB 4.22Å; W545-L582 HydrophobicContact CG-CD1 4.47Å; W545-L582 HydrophobicContact CH2-CB 4.21Å; W545-L582 HydrophobicContact CZ2-CB 4.05Å; W545-L582 HydrophobicContact CZ3-CB 4.14Å; W545-L582 HydrophobicContact CZ3-CD2 4.33Å; I552-L582 HydrophobicContact CD1-CD1 3.77Å; I552-L582 HydrophobicContact CD1-CD2 3.54Å; I552-L582 HydrophobicContact CD1-CG 4.33Å; I552-L582 HydrophobicContact CG2-CD1 4.19Å; F557-L582 HydrophobicContact CB-CD1 3.67Å; F557-L582 HydrophobicContact CD1-CD1 4.12Å; F557-L582 HydrophobicContact CD1-CG 4.33Å; F557-L582 HydrophobicContact CG-CD1 4.09Å; V559-L582 HydrophobicContact CG2-CD1 3.66Å; L582-W584 HydrophobicContact CD2-CH2 4.41Å; L582-W584 HydrophobicContact CD2-CZ3 4.27Å; L582-W584 HydrophobicContact CG-CZ3 4.38Å; L582-Y596 HydrophobicContact CD2-CD1 3.55Å; L582-Y596 HydrophobicContact CD2-CE1 3.84Å
583	K	91.5	Very high	89.5	Confident	102 Å²	102	36.5 Å²	36.5	44%	0.443	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	132.6	-174	-177.8	174.2	-177.9	179.3	0	112.1	F557 I558	F557-K583 CarbonylContact C-O 3.53Å; F557-K583 WeakPolarHBondContact CA-O 2.85Å; I558-K583 PolarHBondContact N-O 2.87Å; I558-K583 PolarHBondContact O-N 3.16Å
584	W	90.9	Very high	89.4	Confident	4 Å²	4	32 Å²	32	2%	0.015	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	132	175.5	-80.6	-114.2	0	0	0	110.8	Y529 L531 H556 F557 L582 V588 D592 Y596 L614	Y529-W584 AromaticContact CD1-CD2 3.71Å; Y529-W584 HydrophobicContact CD1-CD2 3.71Å; Y529-W584 AromaticContact CD1-CE2 3.79Å; Y529-W584 AromaticContact CD1-CE3 3.52Å; Y529-W584 HydrophobicContact CD1-CE3 3.52Å; Y529-W584 AromaticContact CD1-CH2 3.63Å; Y529-W584 HydrophobicContact CD1-CH2 3.63Å; Y529-W584 AromaticContact CD1-CZ2 3.76Å; Y529-W584 HydrophobicContact CD1-CZ2 3.76Å; Y529-W584 AromaticContact CD1-CZ3 3.51Å; Y529-W584 HydrophobicContact CD1-CZ3 3.51Å; Y529-W584 HydrophobicContact CE1-CE3 4.19Å; Y529-W584 AromaticContact CE1-CH2 3.48Å; Y529-W584 HydrophobicContact CE1-CH2 3.48Å; Y529-W584 VanDerWaalsContact CE1-CH2 3.48Å; Y529-W584 AromaticContact CE1-CZ2 3.81Å; Y529-W584 HydrophobicContact CE1-CZ2 3.81Å; Y529-W584 AromaticContact CE1-CZ3 3.68Å; Y529-W584 HydrophobicContact CE1-CZ3 3.68Å; Y529-W584 HydrophobicContact CG-CD2 4.5Å; Y529-W584 HydrophobicContact CG-CE3 4.22Å; Y529-W584 HydrophobicContact CG-CZ3 4.44Å; Y529-W584 PolarHBondContact O-N 2.04Å; L531-W584 HydrophobicContact CD1-CH2 4.3Å; L531-W584 HydrophobicContact CD1-CZ3 4.48Å; L531-W584 HydrophobicContact CG-CH2 4.41Å; L531-W584 HydrophobicContact CG-CZ3 4.19Å; H556-W584 AromaticContact CE1-CD1 3.06Å; H556-W584 AromaticContact CE1-NE1 3.45Å; H556-W584 PolarHBondContact CE1-NE1 2.62Å; F557-W584 HydrophobicContact CD1-CD2 4.11Å; F557-W584 HydrophobicContact CD1-CE3 4.36Å; F557-W584 HydrophobicContact CD1-CG 4.44Å; F557-W584 AromaticContact CE1-CD2 3.92Å; F557-W584 HydrophobicContact CE1-CD2 3.92Å; F557-W584 AromaticContact CE1-CE2 3.57Å; F557-W584 HydrophobicContact CE1-CE3 4.45Å; F557-W584 HydrophobicContact CE1-CG 4.29Å; F557-W584 HydrophobicContact CE1-CH2 4.37Å; F557-W584 AromaticContact CE1-CZ2 3.85Å; F557-W584 HydrophobicContact CE1-CZ2 3.85Å; F557-W584 AromaticContact CE1-NE1 3.72Å; L582-W584 HydrophobicContact CD2-CH2 4.41Å; L582-W584 HydrophobicContact CD2-CZ3 4.27Å; L582-W584 HydrophobicContact CG-CZ3 4.38Å; W584-V588 HydrophobicContact CG-CG2 4.16Å; W584-D592 VanDerWaalsContact CD1-OD2 3.29Å; W584-D592 PolarHBondContact NE1-OD2 3.27Å; W584-Y596 HydrophobicContact CH2-CD1 4.39Å; W584-Y596 AromaticContact CH2-CE1 3.93Å; W584-Y596 HydrophobicContact CH2-CE1 3.93Å; W584-Y596 HydrophobicContact CH2-CE2 4.1Å; W584-Y596 AromaticContact CH2-CZ 3.77Å; W584-Y596 HydrophobicContact CZ2-CE1 4.05Å; W584-Y596 AromaticContact CZ2-CE2 3.93Å; W584-Y596 HydrophobicContact CZ2-CE2 3.93Å; W584-Y596 AromaticContact CZ2-CZ 3.5Å; W584-Y596 VanDerWaalsContact CZ2-OH 3.32Å; W584-Y596 WeakPolarHBondContact CZ2-OH 3.44Å; W584-L614 HydrophobicContact CH2-CD2 4.17Å; W584-L614 HydrophobicContact CZ2-CD2 3.63Å
585	T	86.5	Confident	89.5	Confident	75 Å²	75	34.6 Å²	34.6	46%	0.46	18%	0.184	S	C	.	.	S	Bend	trans	-81.2	-30.8	175.9	62.7	0	0	0	0	112.5	H556 I558	H556-T585 PolarHBondContact O-N 2.79Å; H556-T585 PolarHBondContact O-OG1 3.3Å; I558-T585 HydrophobicContact CD1-CG2 3.93Å; I558-T585 HydrophobicContact CG1-CG2 3.76Å
586	S	85.8	Confident	89.6	Confident	43 Å²	43	33.2 Å²	33.2	30%	0.301	17%	0.174	S	C	.	.	S	Bend	trans	-107.9	-171.9	175.6	86	0	0	0	0	112.4	H556	H556-S586 WeakPolarHBondContact NE2-CB 3.25Å; H556-S586 PolarHBondContact NE2-OG 3.07Å
587	A	89.4	Confident	89.8	Confident	31 Å²	31	30.9 Å²	30.9	26%	0.256	17%	0.165	S	C	.	.	B	Isolated β-bridge	trans	-73.8	141.4	163.9	0	0	0	0	0	110.6	H526 Q589	H526-A587 CarbonylContact O-C 3.53Å; H526-A587 VanDerWaalsContact O-CA 3.3Å; H526-A587 WeakPolarHBondContact O-CA 3.48Å; A587-Q589 PolarHBondContact O-N 2.78Å; A587-Q589 PolarHBondContact O-NE2 2.79Å
588	V	89.8	Confident	89.9	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.154	C	C	.	.	P	Polyproline II helix	trans	-57.7	128.6	-176	177.7	0	0	0	0	111	I522 G524 G525 H526 Y529 W584 D592 V616	I522-V588 HydrophobicContact CD1-CG2 4.17Å; I522-V588 HydrophobicContact CG2-CG1 3.92Å; G524-V588 CarbonylContact C-O 3.51Å; G524-V588 WeakPolarHBondContact CA-O 3.32Å; G525-V588 PolarHBondContact N-O 2.82Å; H526-V588 WeakPolarHBondContact O-CG2 3.46Å; H526-V588 PolarHBondContact O-N 3.23Å; Y529-V588 HydrophobicContact CD1-CG2 4.1Å; Y529-V588 HydrophobicContact CG-CG2 4.37Å; W584-V588 HydrophobicContact CG-CG2 4.16Å; V588-D592 VanDerWaalsContact CA-OD2 3.26Å; V588-D592 WeakPolarHBondContact CA-OD2 3.38Å; V588-D592 HydrophobicContact CG1-CB 4Å; V588-V616 HydrophobicContact CG1-CG1 4.21Å; V588-V616 HydrophobicContact CG1-CG2 3.81Å
589	Q	88.1	Confident	90	Very high	80 Å²	80	28.5 Å²	28.5	37%	0.374	15%	0.154	S	C	.	.	P	Polyproline II helix	trans	-99.4	162.8	-179.7	-61.2	-54.9	-53	0	0	112.1	A587 N591 D592	A587-Q589 PolarHBondContact O-N 2.78Å; A587-Q589 PolarHBondContact O-NE2 2.79Å; Q589-N591 VanDerWaalsContact CB-OD1 3.26Å; Q589-N591 WeakPolarHBondContact CB-OD1 3.34Å; Q589-N591 PolarHBondContact O-N 2.79Å; Q589-D592 PolarHBondContact N-OD2 3.17Å; Q589-D592 WeakPolarHBondContact O-CB 3.36Å; Q589-D592 PolarHBondContact O-N 2.83Å; Q589-D592 VanDerWaalsContact O-N 3.08Å
590	W	86	Confident	90.1	Very high	49 Å²	49	27.3 Å²	27.3	19%	0.186	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-62.1	-24.6	179.7	66.9	-92.1	0	0	0	113.6	K593 H618 V621 I623 T646 F782	W590-K593 VanDerWaalsContact O-CD 3.27Å; W590-K593 WeakPolarHBondContact O-CD 3.39Å; W590-K593 WeakPolarHBondContact O-CE 3.26Å; W590-K593 WeakPolarHBondContact O-CG 3.33Å; W590-H618 HydrophobicContact CB-CB 3.76Å; W590-H618 VanDerWaalsContact CB-CG 3.43Å; W590-V621 HydrophobicContact CD2-CG2 4.15Å; W590-V621 HydrophobicContact CG-CG2 4.19Å; W590-V621 HydrophobicContact CH2-CG1 4.15Å; W590-V621 HydrophobicContact CZ2-CB 4.46Å; W590-V621 HydrophobicContact CZ2-CG1 3.76Å; W590-I623 HydrophobicContact CH2-CG2 4.22Å; W590-I623 HydrophobicContact CZ3-CG2 4.41Å; W590-T646 HydrophobicContact CD2-CG2 4.46Å; W590-T646 HydrophobicContact CE3-CG2 3.55Å; W590-T646 HydrophobicContact CH2-CG2 4.19Å; W590-T646 HydrophobicContact CZ3-CG2 3.39Å; W590-F782 WeakPolarHBondContact CZ3-O 3.01Å
591	N	84.7	Confident	90.1	Very high	70 Å²	70	30.2 Å²	30.2	37%	0.374	16%	0.161	S	C	.	.	G	3₁₀ helix	trans	-95	6	178.3	65.1	-69.4	0	0	0	113.6	Q589 K593 F782	Q589-N591 VanDerWaalsContact CB-OD1 3.26Å; Q589-N591 WeakPolarHBondContact CB-OD1 3.34Å; Q589-N591 PolarHBondContact O-N 2.79Å; N591-K593 VanDerWaalsContact C-N 3.26Å; N591-F782 WeakPolarHBondContact CA-O 3.33Å; N591-F782 WeakPolarHBondContact CB-O 3.38Å
592	D	86.8	Confident	90.1	Very high	7 Å²	7	29.6 Å²	29.6	4%	0.037	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-82.3	-6.6	165.4	-62.8	-20.8	0	0	0	111.7	H556 W584 V588 Q589 Y596	H556-D592 IonicContact CE1-OD1 3.21Å; H556-D592 PolarHBondContact CE1-OD1 2.84Å; H556-D592 IonicContact CE1-OD2 2.75Å; H556-D592 PolarHBondContact CE1-OD2 2.9Å; H556-D592 IonicContact ND1-OD1 3.81Å; W584-D592 VanDerWaalsContact CD1-OD2 3.29Å; W584-D592 PolarHBondContact NE1-OD2 3.27Å; V588-D592 VanDerWaalsContact CA-OD2 3.26Å; V588-D592 WeakPolarHBondContact CA-OD2 3.38Å; V588-D592 HydrophobicContact CG1-CB 4Å; Q589-D592 PolarHBondContact N-OD2 3.17Å; Q589-D592 WeakPolarHBondContact O-CB 3.36Å; Q589-D592 PolarHBondContact O-N 2.83Å; Q589-D592 VanDerWaalsContact O-N 3.08Å; D592-Y596 WeakPolarHBondContact O-CE2 3.14Å; D592-Y596 PolarHBondContact O-OH 2.8Å
593	K	86.7	Confident	89.8	Confident	3 Å²	3	32 Å²	32	1%	0.013	18%	0.179	C	C	.	.			trans	-66.1	138.2	172.7	69.7	-176.2	174.6	140.7	0	109.2	F547 W590 N591 L614 V616 T646 F679 F782	F547-K593 WeakPolarHBondContact CZ-O 3.3Å; W590-K593 VanDerWaalsContact O-CD 3.27Å; W590-K593 WeakPolarHBondContact O-CD 3.39Å; W590-K593 WeakPolarHBondContact O-CE 3.26Å; W590-K593 WeakPolarHBondContact O-CG 3.33Å; N591-K593 VanDerWaalsContact C-N 3.26Å; K593-L614 WeakPolarHBondContact CA-O 3.46Å; K593-L614 VanDerWaalsContact CB-O 3.26Å; K593-L614 WeakPolarHBondContact CB-O 3.46Å; K593-V616 HydrophobicContact CB-CB 4.22Å; K593-V616 HydrophobicContact CB-CG2 3.9Å; K593-T646 WeakPolarHBondContact CE-OG1 3.4Å; K593-T646 PolarHBondContact NZ-OG1 2.8Å; K593-F679 PolarHBondContact NZ-O 2.82Å; K593-F782 HydrophobicContact CD-CD1 3.9Å; K593-F782 HydrophobicContact CG-CB 4Å; K593-F782 HydrophobicContact CG-CD1 3.48Å; K593-F782 VanDerWaalsContact CG-CD1 3.48Å; K593-F782 HydrophobicContact CG-CE1 4.1Å; K593-F782 HydrophobicContact CG-CG 3.95Å; K593-F782 WeakPolarHBondContact O-CB 3.34Å; K593-F782 VanDerWaalsContact O-CD2 3.26Å; K593-F782 WeakPolarHBondContact O-CD2 3.33Å; K593-F782 WeakPolarHBondContact O-CG 3.46Å
594	G	86.7	Confident	89.5	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	155.9	-174.9	-174	0	0	0	0	0	113.2	F613 L614	G594-F613 WeakPolarHBondContact O-CD2 3.49Å; G594-L614 PolarHBondContact N-O 3.37Å; G594-L614 VanDerWaalsContact N-O 3.14Å; G594-L614 PolarHBondContact O-N 3.04Å
595	F	90.4	Very high	89.2	Confident	59 Å²	59	29.2 Å²	29.2	26%	0.259	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	115.5	179.2	-67.1	-81	0	0	0	111.3	F547 D548 T611 M612 F613 F679	F547-F595 CarbonylContact C-O 3.56Å; F547-F595 WeakPolarHBondContact CA-O 3.23Å; D548-F595 PolarHBondContact N-O 2.72Å; D548-F595 PolarHBondContact OD1-N 3.21Å; F595-T611 HydrophobicContact CB-CG2 4.02Å; F595-T611 HydrophobicContact CD1-CG2 3.99Å; F595-T611 HydrophobicContact CG-CG2 4.45Å; F595-M612 WeakPolarHBondContact CA-O 3.48Å; F595-F613 HydrophobicContact CD1-CB 3.95Å; F595-F613 AromaticContact CD1-CD2 3.99Å; F595-F613 HydrophobicContact CD1-CD2 3.99Å; F595-F613 HydrophobicContact CD1-CG 4.38Å; F595-F613 HydrophobicContact CD2-CD2 4.29Å; F595-F613 HydrophobicContact CE1-CB 3.78Å; F595-F613 AromaticContact CE1-CD2 3.86Å; F595-F613 HydrophobicContact CE1-CD2 3.86Å; F595-F613 HydrophobicContact CE1-CG 4.04Å; F595-F613 HydrophobicContact CE2-CD2 4.17Å; F595-F613 HydrophobicContact CG-CD2 4.22Å; F595-F613 AromaticContact CZ-CD2 3.95Å; F595-F613 HydrophobicContact CZ-CD2 3.95Å; F595-F613 HydrophobicContact CZ-CG 4.39Å; F595-F679 AromaticContact CE2-CE1 3.57Å; F595-F679 HydrophobicContact CE2-CE1 3.57Å; F595-F679 AromaticContact CE2-CZ 3.82Å; F595-F679 HydrophobicContact CE2-CZ 3.82Å; F595-F679 AromaticContact CZ-CE1 3.97Å; F595-F679 HydrophobicContact CZ-CE1 3.97Å; F595-F679 HydrophobicContact CZ-CZ 4.37Å
596	Y	92.4	Very high	89.3	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	118.8	172.8	-72.3	-87.5	0	0	0	110.2	L516 L531 Y546 F547 I552 F557 L582 W584 D592 T611 M612 L614	L516-Y596 WeakPolarHBondContact CD1-O 3.08Å; L531-Y596 HydrophobicContact CD1-CG 4.12Å; Y546-Y596 WeakPolarHBondContact O-CA 3.33Å; F547-Y596 HydrophobicContact CB-CE1 4.25Å; F547-Y596 HydrophobicContact CD2-CD1 4.1Å; F547-Y596 HydrophobicContact CD2-CD2 4.15Å; F547-Y596 AromaticContact CD2-CE1 3.59Å; F547-Y596 HydrophobicContact CD2-CE1 3.59Å; F547-Y596 AromaticContact CD2-CE2 3.64Å; F547-Y596 HydrophobicContact CD2-CE2 3.64Å; F547-Y596 HydrophobicContact CD2-CG 4.36Å; F547-Y596 AromaticContact CD2-CZ 3.33Å; F547-Y596 HydrophobicContact CE2-CD2 4.48Å; F547-Y596 HydrophobicContact CE2-CE1 4.34Å; F547-Y596 AromaticContact CE2-CE2 3.71Å; F547-Y596 HydrophobicContact CE2-CE2 3.71Å; F547-Y596 AromaticContact CE2-CZ 3.62Å; F547-Y596 HydrophobicContact CG-CE1 4.27Å; I552-Y596 HydrophobicContact CD1-CD1 3.86Å; I552-Y596 HydrophobicContact CD1-CE1 3.91Å; F557-Y596 HydrophobicContact CE1-CE1 4.09Å; F557-Y596 HydrophobicContact CZ-CE1 4.35Å; F557-Y596 WeakPolarHBondContact CZ-OH 3.28Å; L582-Y596 HydrophobicContact CD2-CD1 3.55Å; L582-Y596 HydrophobicContact CD2-CE1 3.84Å; W584-Y596 HydrophobicContact CH2-CD1 4.39Å; W584-Y596 AromaticContact CH2-CE1 3.93Å; W584-Y596 HydrophobicContact CH2-CE1 3.93Å; W584-Y596 HydrophobicContact CH2-CE2 4.1Å; W584-Y596 AromaticContact CH2-CZ 3.77Å; W584-Y596 HydrophobicContact CZ2-CE1 4.05Å; W584-Y596 AromaticContact CZ2-CE2 3.93Å; W584-Y596 HydrophobicContact CZ2-CE2 3.93Å; W584-Y596 AromaticContact CZ2-CZ 3.5Å; W584-Y596 VanDerWaalsContact CZ2-OH 3.32Å; W584-Y596 WeakPolarHBondContact CZ2-OH 3.44Å; D592-Y596 WeakPolarHBondContact O-CE2 3.14Å; D592-Y596 PolarHBondContact O-OH 2.8Å; Y596-T611 CarbonylContact O-C 3.56Å; Y596-T611 WeakPolarHBondContact O-CA 3.1Å; Y596-M612 PolarHBondContact N-O 3.34Å; Y596-M612 PolarHBondContact O-N 3.07Å; Y596-L614 HydrophobicContact CD2-CB 3.95Å; Y596-L614 HydrophobicContact CD2-CD2 4.36Å; Y596-L614 HydrophobicContact CE2-CB 3.91Å; Y596-L614 HydrophobicContact CE2-CD2 3.71Å; Y596-L614 HydrophobicContact CE2-CG 4.47Å
597	T	94.5	Very high	89.5	Confident	6 Å²	6	37.2 Å²	37.2	4%	0.037	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	126.6	176.7	-59.5	0	0	0	0	110.4	W545 Y546 E609 S610 T611	W545-T597 WeakPolarHBondContact CA-O 3.29Å; Y546-T597 PolarHBondContact N-O 3.07Å; Y546-T597 PolarHBondContact O-N 3.49Å; T597-E609 HydrophobicContact CG2-CB 4.17Å; T597-S610 WeakPolarHBondContact CA-O 3.19Å; T597-T611 WeakPolarHBondContact OG1-CG2 3.22Å; T597-T611 PolarHBondContact OG1-OG1 3.38Å
598	C	94.6	Very high	89.7	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	127.2	159.5	173.1	0	0	0	0	108.5	L516 C533 I543 W545 E609 S610	L516-C598 HydrophobicContact CD1-CB 4.39Å; C533-C598 HydrophobicContact CB-CB 3.69Å; C533-C598 WeakPolarHBondContact CB-SG 3.47Å; C533-C598 WeakPolarHBondContact SG-CB 3.25Å; C533-C598 CovalentContact SG-SG 2.03Å; C533-C598 PolarHBondContact SG-SG 3.14Å; I543-C598 VanDerWaalsContact CG2-SG 3.51Å; W545-C598 HydrophobicContact CD2-CB 4.48Å; W545-C598 HydrophobicContact CE3-CB 4.17Å; W545-C598 HydrophobicContact CH2-CB 4.27Å; W545-C598 HydrophobicContact CZ3-CB 4.07Å; C598-E609 CarbonylContact O-C 3.53Å; C598-E609 VanDerWaalsContact O-CA 3.3Å; C598-E609 WeakPolarHBondContact O-CA 3.36Å; C598-S610 PolarHBondContact N-O 3.26Å; C598-S610 PolarHBondContact O-N 2.53Å
599	S	94.9	Very high	89.9	Confident	5 Å²	5	43 Å²	43	4%	0.035	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	126.1	176	-172.6	0	0	0	0	109.8	I543 T544 E609	I543-S599 WeakPolarHBondContact CA-O 3.38Å; T544-S599 PolarHBondContact N-O 2.89Å; T544-S599 PolarHBondContact O-N 2.88Å; T544-S599 PolarHBondContact OG1-O 3.31Å; S599-E609 WeakPolarHBondContact CB-OE1 3.49Å; S599-E609 WeakPolarHBondContact OG-CG 3.47Å; S599-E609 PolarHBondContact OG-OE1 2.99Å
600	A	94.7	Very high	90.3	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	124.7	179.9	0	0	0	0	0	111	A510 L512 A535 P541 N542 I543 P607 S608	A510-A600 HydrophobicContact CB-CB 4.31Å; A510-A600 WeakPolarHBondContact CB-O 3.41Å; L512-A600 HydrophobicContact CD2-CB 3.64Å; A535-A600 HydrophobicContact CB-CB 3.44Å; A535-A600 VanDerWaalsContact CB-CB 3.44Å; P541-A600 HydrophobicContact CB-CB 4.46Å; N542-A600 WeakPolarHBondContact O-CA 3.41Å; I543-A600 HydrophobicContact CG1-CB 4.11Å; A600-P607 CarbonylContact O-C 3.35Å; A600-P607 VanDerWaalsContact O-CA 3.3Å; A600-P607 WeakPolarHBondContact O-CA 3.34Å; A600-S608 PolarHBondContact N-O 2.86Å; A600-S608 PolarHBondContact O-N 3.05Å
601	D	93.9	Very high	90.6	Very high	66 Å²	66	40.5 Å²	40.5	35%	0.353	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	149.8	179.6	-175.8	25.3	0	0	0	111.8	P541 N542 G603 P607	P541-D601 CarbonylContact C-O 3.57Å; P541-D601 WeakPolarHBondContact CA-O 3.2Å; N542-D601 PolarHBondContact N-O 2.68Å; N542-D601 PolarHBondContact O-N 2.67Å; N542-D601 VanDerWaalsContact O-N 3.07Å; D601-G603 PolarHBondContact OD1-N 3.32Å; D601-P607 HydrophobicContact CB-CB 4.16Å; D601-P607 HydrophobicContact CB-CG 4.05Å
602	N	90.9	Very high	91.1	Very high	22 Å²	22	37.2 Å²	37.2	12%	0.118	21%	0.209	C	C	.	.			trans	-141.2	8.9	173.4	68.3	-8.5	0	0	0	113.7	E508 A510 N538 P539 A604	E508-N602 PolarHBondContact O-ND2 3.37Å; A510-N602 PolarHBondContact N-OD1 2.87Å; N538-N602 PolarHBondContact N-ND2 3.28Å; P539-N602 VanDerWaalsContact O-CB 3.28Å; P539-N602 WeakPolarHBondContact O-CB 3.21Å; P539-N602 PolarHBondContact O-ND2 2.76Å; N602-A604 PolarHBondContact O-N 2.91Å; N602-A604 WeakPolarHBondContact OD1-CB 3.41Å; N602-A604 PolarHBondContact OD1-N 3.31Å; N602-A604 VanDerWaalsContact OD1-N 3.14Å
603	G	87	Confident	91.2	Very high	49 Å²	49	38.2 Å²	38.2	51%	0.505	21%	0.212	S	C	.	.	S	Bend	trans	65.4	14.4	-178.7	0	0	0	0	0	115	D601	D601-G603 PolarHBondContact OD1-N 3.32Å
604	A	85.2	Confident	91.4	Very high	6 Å²	6	38 Å²	38	5%	0.05	21%	0.212	C	C	.	.	S	Bend	trans	-96.1	-4.4	173.2	0	0	0	0	0	113.5	R507 N602	R507-A604 HydrophobicContact CB-CB 3.61Å; R507-A604 HydrophobicContact CG-CB 4.42Å; N602-A604 PolarHBondContact O-N 2.91Å; N602-A604 WeakPolarHBondContact OD1-CB 3.41Å; N602-A604 PolarHBondContact OD1-N 3.31Å; N602-A604 VanDerWaalsContact OD1-N 3.14Å
605	G	84.7	Confident	91.5	Very high	43 Å²	43	40.7 Å²	40.7	44%	0.443	22%	0.223	S	C	.	.	S	Bend	trans	-173.8	-149.1	-177.4	0	0	0	0	0	111.4
606	R	88.1	Confident	91.5	Very high	223 Å²	223	37.9 Å²	37.9	84%	0.842	21%	0.211	S	C	*	.	S	Bend	trans	-85	147.5	169.9	-64.2	-178	-179.8	-174.5	-0.9	109.9
607	P	90.3	Very high	91.5	Very high	63 Å²	63	41.1 Å²	41.1	41%	0.409	23%	0.226	S	C	.	.			trans	-55.5	147.9	169.6	-24.7	34	0	0	0	112.4	A600 D601	A600-P607 CarbonylContact O-C 3.35Å; A600-P607 VanDerWaalsContact O-CA 3.3Å; A600-P607 WeakPolarHBondContact O-CA 3.34Å; D601-P607 HydrophobicContact CB-CB 4.16Å; D601-P607 HydrophobicContact CB-CG 4.05Å
608	S	93.9	Very high	91.4	Very high	35 Å²	35	41.4 Å²	41.4	25%	0.245	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	122.4	176.4	-168.3	0	0	0	0	109.8	A510 L512 A600	A510-S608 VanDerWaalsContact O-CB 3.23Å; A510-S608 WeakPolarHBondContact O-CB 3.29Å; L512-S608 PolarHBondContact N-OG 3.06Å; A600-S608 PolarHBondContact N-O 2.86Å; A600-S608 PolarHBondContact O-N 3.05Å
609	E	94.5	Very high	91.3	Very high	117 Å²	117	45.6 Å²	45.6	55%	0.547	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	149.6	-165.5	-51.2	-156.9	133.7	0	0	113.5	L512 T597 C598 S599	L512-E609 VanDerWaalsContact CD1-C 3.45Å; T597-E609 HydrophobicContact CG2-CB 4.17Å; C598-E609 CarbonylContact O-C 3.53Å; C598-E609 VanDerWaalsContact O-CA 3.3Å; C598-E609 WeakPolarHBondContact O-CA 3.36Å; S599-E609 WeakPolarHBondContact CB-OE1 3.49Å; S599-E609 WeakPolarHBondContact OG-CG 3.47Å; S599-E609 PolarHBondContact OG-OE1 2.99Å
610	S	94.9	Very high	91.2	Very high	14 Å²	14	45.3 Å²	45.3	10%	0.098	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	125	174	-175.9	0	0	0	0	110.6	L512 V515 L516 T597 C598	L512-S610 VanDerWaalsContact CD1-CB 3.47Å; V515-S610 WeakPolarHBondContact CB-OG 3.31Å; L516-S610 WeakPolarHBondContact CD1-O 3.5Å; L516-S610 PolarHBondContact N-OG 2.98Å; T597-S610 WeakPolarHBondContact CA-O 3.19Å; C598-S610 PolarHBondContact N-O 3.26Å; C598-S610 PolarHBondContact O-N 2.53Å
611	T	93.9	Very high	91.1	Very high	63 Å²	63	46.3 Å²	46.3	39%	0.387	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	138.2	-173.4	-52.3	0	0	0	0	111.7	F595 Y596 T597	F595-T611 HydrophobicContact CB-CG2 4.02Å; F595-T611 HydrophobicContact CD1-CG2 3.99Å; F595-T611 HydrophobicContact CG-CG2 4.45Å; Y596-T611 CarbonylContact O-C 3.56Å; Y596-T611 WeakPolarHBondContact O-CA 3.1Å; T597-T611 WeakPolarHBondContact OG1-CG2 3.22Å; T597-T611 PolarHBondContact OG1-OG1 3.38Å
612	M	93.3	Very high	91	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	135	174.8	-176	-171.4	81	0	0	110.7	L516 R517 E520 L531 F595 Y596 L614	L516-M612 HydrophobicContact CB-CB 3.95Å; L516-M612 HydrophobicContact CD1-CB 4.07Å; R517-M612 HydrophobicContact CB-CG 4.39Å; R517-M612 HydrophobicContact CB-SD 4.34Å; R517-M612 VanDerWaalsContact O-CA 3.26Å; R517-M612 WeakPolarHBondContact O-CA 3.24Å; R517-M612 WeakPolarHBondContact O-CB 3.45Å; R517-M612 WeakPolarHBondContact O-CG 3.22Å; E520-M612 HydrophobicContact CB-CE 4.11Å; E520-M612 HydrophobicContact CB-CG 4.45Å; E520-M612 HydrophobicContact CB-SD 3.65Å; L531-M612 HydrophobicContact CD1-CE 3.76Å; L531-M612 HydrophobicContact CD2-CE 3.8Å; L531-M612 HydrophobicContact CD2-SD 3.89Å; L531-M612 HydrophobicContact CG-CE 4.38Å; F595-M612 WeakPolarHBondContact CA-O 3.48Å; Y596-M612 PolarHBondContact N-O 3.34Å; Y596-M612 PolarHBondContact O-N 3.07Å; M612-L614 HydrophobicContact CE-CB 4.01Å; M612-L614 HydrophobicContact CE-CD1 4.13Å
613	F	90.4	Very high	90.9	Very high	27 Å²	27	43.2 Å²	43.2	12%	0.118	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	121.2	165.9	-174.4	-125.4	0	0	0	111.2	K518 E519 E520 G594 F595 K615 F679 F782	K518-F613 PolarHBondContact O-N 2.83Å; E519-F613 CarbonylContact C-O 3.56Å; E519-F613 VanDerWaalsContact CA-O 3.28Å; E519-F613 WeakPolarHBondContact CA-O 3.5Å; E519-F613 HydrophobicContact CG-CD1 4.38Å; E520-F613 PolarHBondContact N-O 3.13Å; G594-F613 WeakPolarHBondContact O-CD2 3.49Å; F595-F613 HydrophobicContact CD1-CB 3.95Å; F595-F613 AromaticContact CD1-CD2 3.99Å; F595-F613 HydrophobicContact CD1-CD2 3.99Å; F595-F613 HydrophobicContact CD1-CG 4.38Å; F595-F613 HydrophobicContact CD2-CD2 4.29Å; F595-F613 HydrophobicContact CE1-CB 3.78Å; F595-F613 AromaticContact CE1-CD2 3.86Å; F595-F613 HydrophobicContact CE1-CD2 3.86Å; F595-F613 HydrophobicContact CE1-CG 4.04Å; F595-F613 HydrophobicContact CE2-CD2 4.17Å; F595-F613 HydrophobicContact CG-CD2 4.22Å; F595-F613 AromaticContact CZ-CD2 3.95Å; F595-F613 HydrophobicContact CZ-CD2 3.95Å; F595-F613 HydrophobicContact CZ-CG 4.39Å; F613-K615 HydrophobicContact CD1-CG 3.87Å; F613-K615 HydrophobicContact CE1-CD 4.16Å; F613-K615 HydrophobicContact CE1-CG 3.44Å; F613-K615 VanDerWaalsContact CE1-CG 3.44Å; F613-K615 HydrophobicContact CZ-CG 4.23Å; F613-F679 AromaticContact CE2-CD1 3.83Å; F613-F679 HydrophobicContact CE2-CD1 3.83Å; F613-F679 HydrophobicContact CE2-CE1 4.01Å; F613-F679 AromaticContact CZ-CD1 3.75Å; F613-F679 HydrophobicContact CZ-CD1 3.75Å; F613-F679 HydrophobicContact CZ-CE1 4.24Å; F613-F782 HydrophobicContact CE2-CE1 4.09Å; F613-F782 AromaticContact CE2-CZ 3.97Å; F613-F782 HydrophobicContact CE2-CZ 3.97Å; F613-F782 HydrophobicContact CZ-CE1 4.42Å
614	L	90.7	Very high	90.9	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	118.7	173.8	-173.8	60.1	0	0	0	110.4	E520 I522 Y529 W584 K593 G594 Y596 M612 V616	E520-L614 HydrophobicContact CB-CD1 4.24Å; E520-L614 HydrophobicContact CG-CD1 4.4Å; I522-L614 HydrophobicContact CB-CD1 4.46Å; I522-L614 HydrophobicContact CG2-CD1 3.82Å; I522-L614 HydrophobicContact CG2-CG 4.34Å; Y529-L614 HydrophobicContact CE1-CD1 3.96Å; Y529-L614 HydrophobicContact CE1-CD2 3.82Å; W584-L614 HydrophobicContact CH2-CD2 4.17Å; W584-L614 HydrophobicContact CZ2-CD2 3.63Å; K593-L614 WeakPolarHBondContact CA-O 3.46Å; K593-L614 VanDerWaalsContact CB-O 3.26Å; K593-L614 WeakPolarHBondContact CB-O 3.46Å; G594-L614 PolarHBondContact N-O 3.37Å; G594-L614 VanDerWaalsContact N-O 3.14Å; G594-L614 PolarHBondContact O-N 3.04Å; Y596-L614 HydrophobicContact CD2-CB 3.95Å; Y596-L614 HydrophobicContact CD2-CD2 4.36Å; Y596-L614 HydrophobicContact CE2-CB 3.91Å; Y596-L614 HydrophobicContact CE2-CD2 3.71Å; Y596-L614 HydrophobicContact CE2-CG 4.47Å; M612-L614 HydrophobicContact CE-CB 4.01Å; M612-L614 HydrophobicContact CE-CD1 4.13Å; L614-V616 HydrophobicContact CG-CG2 4.35Å
615	K	88.5	Confident	90.8	Very high	56 Å²	56	42.3 Å²	42.3	24%	0.243	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	134.3	167.5	-69.8	178	-179.9	162.9	0	110.1	E519 E520 T521 I522 F613	E519-K615 HydrophobicContact CG-CD 4.35Å; E519-K615 WeakPolarHBondContact OE1-CE 3.47Å; E519-K615 IonicContact OE1-NZ 3.56Å; E519-K615 PolarHBondContact OE1-NZ 3.01Å; E519-K615 WeakPolarHBondContact OE2-CE 3.34Å; E519-K615 IonicContact OE2-NZ 2.85Å; E519-K615 PolarHBondContact OE2-NZ 2.96Å; E520-K615 PolarHBondContact O-N 3.08Å; T521-K615 WeakPolarHBondContact CA-O 3.38Å; T521-K615 HydrophobicContact CG2-CB 4.18Å; I522-K615 PolarHBondContact N-O 3.5Å; F613-K615 HydrophobicContact CD1-CG 3.87Å; F613-K615 HydrophobicContact CE1-CD 4.16Å; F613-K615 HydrophobicContact CE1-CG 3.44Å; F613-K615 VanDerWaalsContact CE1-CG 3.44Å; F613-K615 HydrophobicContact CZ-CG 4.23Å
616	V	90.5	Very high	90.6	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	122.7	175.5	-177.1	0	0	0	0	109.3	I522 V588 K593 L614 H618 S648	I522-V616 HydrophobicContact CG2-CG2 3.97Å; I522-V616 CarbonylContact O-C 3.5Å; I522-V616 WeakPolarHBondContact O-CA 3.13Å; V588-V616 HydrophobicContact CG1-CG1 4.21Å; V588-V616 HydrophobicContact CG1-CG2 3.81Å; K593-V616 HydrophobicContact CB-CB 4.22Å; K593-V616 HydrophobicContact CB-CG2 3.9Å; L614-V616 HydrophobicContact CG-CG2 4.35Å; V616-H618 PolarHBondContact O-CD2 3.15Å; V616-H618 VanDerWaalsContact O-CD2 3.28Å; V616-S648 WeakPolarHBondContact O-CB 3.44Å
617	Q	91.9	Very high	90	Very high	67 Å²	67	38.7 Å²	38.7	31%	0.313	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	124	171.9	-70.4	-174.6	-13.9	0	0	110.5	T521 I522 R523 G524 S648 F707	T521-Q617 HydrophobicContact CG2-CG 4.07Å; I522-Q617 PolarHBondContact O-N 2.59Å; R523-Q617 HydrophobicContact CG-CB 4.5Å; G524-Q617 PolarHBondContact N-O 2.86Å; Q617-S648 CarbonylContact C-O 3.51Å; Q617-S648 WeakPolarHBondContact CA-O 3.32Å; Q617-F707 HydrophobicContact CB-CE2 3.77Å; Q617-F707 HydrophobicContact CB-CZ 4.02Å
618	H	91.7	Very high	89.4	Confident	13 Å²	13	38.1 Å²	38.1	6%	0.06	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	157.8	-172.1	74	91.9	0	0	0	113.9	W590 V616 T646 S648 N705	W590-H618 HydrophobicContact CB-CB 3.76Å; W590-H618 VanDerWaalsContact CB-CG 3.43Å; V616-H618 PolarHBondContact O-CD2 3.15Å; V616-H618 VanDerWaalsContact O-CD2 3.28Å; H618-T646 VanDerWaalsContact CE1-C 3.43Å; H618-T646 PolarHBondContact CE1-O 3.31Å; H618-T646 PolarHBondContact CE1-OG1 2.62Å; H618-T646 PolarHBondContact NE2-OG1 3.02Å; H618-S648 PolarHBondContact N-O 2.95Å; H618-S648 PolarHBondContact O-N 2.78Å; H618-N705 PolarHBondContact O-ND2 2.98Å
619	K	93.3	Very high	89.1	Confident	87 Å²	87	38.3 Å²	38.3	38%	0.378	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	157.4	170.6	75.3	139.3	-154.4	160.6	0	110.8	F707 E709 D710	K619-F707 HydrophobicContact CB-CB 3.87Å; K619-F707 WeakPolarHBondContact CB-O 3.49Å; K619-E709 PolarHBondContact NZ-O 2.83Å; K619-D710 IonicContact NZ-OD1 2.68Å
620	P	93.1	Very high	88.8	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	146.3	-179.8	-22.5	36.6	0	0	0	111.9	V645 T646 A647 P651 A703 N705 G708 D710	P620-V645 HydrophobicContact CB-CG1 3.81Å; P620-T646 CarbonylContact C-O 3.51Å; P620-T646 WeakPolarHBondContact CA-O 3.39Å; P620-A647 HydrophobicContact CB-CB 4.02Å; P620-A647 HydrophobicContact CG-CB 4.03Å; P620-P651 HydrophobicContact CB-CB 4.41Å; P620-P651 HydrophobicContact CG-CB 4.03Å; P620-A703 HydrophobicContact CB-CB 3.97Å; P620-N705 WeakPolarHBondContact CD-OD1 3.3Å; P620-N705 HydrophobicContact CG-CB 4.06Å; P620-G708 WeakPolarHBondContact CD-O 3.43Å; P620-D710 HydrophobicContact CB-CB 4.49Å; P620-D710 WeakPolarHBondContact O-CB 3.33Å
621	V	92.1	Very high	88.6	Confident	21 Å²	21	35.3 Å²	35.3	13%	0.127	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	120.7	171.2	-178.6	0	0	0	0	107.2	W590 V645 T646 D710	W590-V621 HydrophobicContact CD2-CG2 4.15Å; W590-V621 HydrophobicContact CG-CG2 4.19Å; W590-V621 HydrophobicContact CH2-CG1 4.15Å; W590-V621 HydrophobicContact CZ2-CB 4.46Å; W590-V621 HydrophobicContact CZ2-CG1 3.76Å; V621-V645 WeakPolarHBondContact O-CA 3.43Å; V621-T646 HydrophobicContact CB-CG2 3.98Å; V621-T646 PolarHBondContact N-O 2.91Å; V621-T646 PolarHBondContact O-N 3.41Å; V621-D710 WeakPolarHBondContact CA-OD2 3.35Å
622	I	91.2	Very high	88.6	Confident	10 Å²	10	33.1 Å²	33.1	5%	0.051	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	123.9	176.1	-64.2	157.9	0	0	0	108	N624 K644 V645 D710 H712	I622-N624 HydrophobicContact CG2-CB 4.27Å; I622-N624 WeakPolarHBondContact CG2-OD1 3.32Å; I622-K644 CarbonylContact C-O 3.52Å; I622-K644 WeakPolarHBondContact CA-O 3.27Å; I622-V645 HydrophobicContact CB-CG2 4.48Å; I622-V645 HydrophobicContact CG1-CG2 3.74Å; I622-D710 HydrophobicContact CD1-CB 4.25Å; I622-D710 HydrophobicContact CG1-CB 4.4Å; I622-D710 PolarHBondContact N-OD2 2.91Å; I622-H712 HydrophobicContact CB-CB 4.08Å; I622-H712 HydrophobicContact CD1-CB 3.55Å; I622-H712 VanDerWaalsContact CD1-N 3.26Å; I622-H712 HydrophobicContact CG1-CB 4.34Å; I622-H712 HydrophobicContact CG2-CB 3.6Å
623	I	89	Confident	88.6	Confident	12 Å²	12	33.2 Å²	33.2	6%	0.062	17%	0.171	C	C	.	.			trans	-102.5	7.8	-172.1	59.9	168.8	0	0	0	113.5	W590 K644 T646 V681 G783 E785	W590-I623 HydrophobicContact CH2-CG2 4.22Å; W590-I623 HydrophobicContact CZ3-CG2 4.41Å; I623-K644 HydrophobicContact CD1-CB 4.25Å; I623-K644 HydrophobicContact CG1-CB 3.73Å; I623-K644 WeakPolarHBondContact CG1-O 3.47Å; I623-K644 PolarHBondContact N-O 3.38Å; I623-T646 HydrophobicContact CG2-CG2 3.6Å; I623-V681 HydrophobicContact CD1-CG1 3.98Å; I623-V681 HydrophobicContact CD1-CG2 4.49Å; I623-G783 WeakPolarHBondContact CB-O 3.31Å; I623-G783 WeakPolarHBondContact CG2-O 3.44Å; I623-E785 WeakPolarHBondContact O-CA 3.43Å; I623-E785 WeakPolarHBondContact O-CB 3.37Å; I623-E785 WeakPolarHBondContact O-CG 3.47Å; I623-E785 PolarHBondContact O-N 3.4Å
624	N	88.6	Confident	88.7	Confident	18 Å²	18	33.5 Å²	33.5	10%	0.096	17%	0.174	C	C	.	.	S	Bend	trans	-62.5	148.2	171.5	-66.9	95.5	0	0	0	112.2	I622 P626 V642 C643 K644 F714	I622-N624 HydrophobicContact CG2-CB 4.27Å; I622-N624 WeakPolarHBondContact CG2-OD1 3.32Å; N624-P626 VanDerWaalsContact O-CD 3.23Å; N624-P626 WeakPolarHBondContact O-CD 3.4Å; N624-P626 VanDerWaalsContact O-N 3.13Å; N624-V642 PolarHBondContact ND2-O 3.41Å; N624-C643 WeakPolarHBondContact OD1-CA 3.33Å; N624-K644 PolarHBondContact OD1-N 3.42Å; N624-F714 HydrophobicContact CB-CE1 3.97Å; N624-F714 HydrophobicContact CB-CZ 4.13Å; N624-F714 WeakPolarHBondContact OD1-CZ 3.45Å
625	D	81.5	Confident	88.8	Confident	19 Å²	19	38.4 Å²	38.4	10%	0.102	20%	0.195	C	C	.	.			trans	-59.2	110.3	178	-173.2	-25	0	0	0	111.5	E627 R628 E785 A787	D625-E627 PolarHBondContact O-N 2.8Å; D625-E627 WeakPolarHBondContact OD1-CA 3.17Å; D625-E627 WeakPolarHBondContact OD1-CB 3.19Å; D625-E627 PolarHBondContact OD1-N 2.86Å; D625-R628 HydrophobicContact CB-CB 4.16Å; D625-R628 HydrophobicContact CB-CG 4.37Å; D625-R628 CarbonylContact O-C 3.59Å; D625-R628 PolarHBondContact O-N 3.3Å; D625-R628 PolarHBondContact OD1-N 3.28Å; D625-R628 WeakPolarHBondContact OD2-CD 3.27Å; D625-R628 IonicContact OD2-CZ 3.14Å; D625-R628 IonicContact OD2-NE 2.72Å; D625-R628 PolarHBondContact OD2-NE 3.14Å; D625-E785 WeakPolarHBondContact CA-O 3.28Å; D625-E785 VanDerWaalsContact CB-O 3.25Å; D625-E785 WeakPolarHBondContact CB-O 3.49Å; D625-E785 PolarHBondContact N-O 3.47Å; D625-A787 PolarHBondContact OD2-N 3.13Å
626	P	81.1	Confident	89	Confident	77 Å²	77	38 Å²	38	50%	0.5	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-8.8	-175.4	33.3	-36.6	0	0	0	113.5	N624 I784	N624-P626 VanDerWaalsContact O-CD 3.23Å; N624-P626 WeakPolarHBondContact O-CD 3.4Å; N624-P626 VanDerWaalsContact O-N 3.13Å; P626-I784 HydrophobicContact CG-CG2 4.36Å
627	E	76.2	Confident	89.1	Confident	112 Å²	112	41.4 Å²	41.4	52%	0.523	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-10.2	167.4	-63.4	-171.1	-145.8	0	0	112.5	D625 K726	D625-E627 PolarHBondContact O-N 2.8Å; D625-E627 WeakPolarHBondContact OD1-CA 3.17Å; D625-E627 WeakPolarHBondContact OD1-CB 3.19Å; D625-E627 PolarHBondContact OD1-N 2.86Å; E627-K726 IonicContact OE2-NZ 2.7Å; E627-K726 PolarHBondContact OE2-NZ 3.15Å
628	R	78	Confident	89	Confident	51 Å²	51	43.2 Å²	43.2	19%	0.192	23%	0.234	C	C	.	.			trans	-125.6	54.6	178	-53.6	172.4	-157.4	-98.6	-18.5	113.3	D625 V630 P744 G745	D625-R628 HydrophobicContact CB-CB 4.16Å; D625-R628 HydrophobicContact CB-CG 4.37Å; D625-R628 CarbonylContact O-C 3.59Å; D625-R628 PolarHBondContact O-N 3.3Å; D625-R628 PolarHBondContact OD1-N 3.28Å; D625-R628 WeakPolarHBondContact OD2-CD 3.27Å; D625-R628 IonicContact OD2-CZ 3.14Å; D625-R628 IonicContact OD2-NE 2.72Å; D625-R628 PolarHBondContact OD2-NE 3.14Å; R628-V630 HydrophobicContact CB-CG2 4.4Å; R628-V630 PolarHBondContact O-N 2.66Å; R628-P744 VanDerWaalsContact CZ-O 3.24Å; R628-P744 PolarHBondContact NH1-O 2.88Å; R628-P744 PolarHBondContact NH2-O 3.34Å; R628-G745 VanDerWaalsContact NH1-C 3.32Å; R628-G745 PolarHBondContact NH1-O 2.8Å
629	P	86.5	Confident	89	Confident	39 Å²	39	42.7 Å²	42.7	25%	0.253	23%	0.233	S	C	.	.			trans	-74.2	47.8	173	34.4	-37.2	0	0	0	111.6	I713 F714 K715	P629-I713 WeakPolarHBondContact CB-O 3.04Å; P629-F714 CarbonylContact O-C 3.59Å; P629-K715 WeakPolarHBondContact O-CB 3.32Å; P629-K715 PolarHBondContact O-N 3.04Å
630	V	88.7	Confident	88.9	Confident	38 Å²	38	43.9 Å²	43.9	23%	0.23	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	134.9	-170	-76.7	0	0	0	0	112.1	R628 K715 L717 F746	R628-V630 HydrophobicContact CB-CG2 4.4Å; R628-V630 PolarHBondContact O-N 2.66Å; V630-K715 WeakPolarHBondContact CA-O 3.17Å; V630-K715 HydrophobicContact CG1-CB 4.41Å; V630-L717 HydrophobicContact CB-CD1 4.28Å; V630-L717 HydrophobicContact CG1-CD1 3.77Å; V630-F746 HydrophobicContact CB-CD2 4.46Å; V630-F746 HydrophobicContact CB-CE1 4.43Å; V630-F746 HydrophobicContact CB-CE2 4.23Å; V630-F746 HydrophobicContact CB-CZ 4.2Å; V630-F746 HydrophobicContact CG2-CB 4.32Å; V630-F746 HydrophobicContact CG2-CD1 4.11Å; V630-F746 HydrophobicContact CG2-CD2 3.52Å; V630-F746 HydrophobicContact CG2-CE1 4.29Å; V630-F746 HydrophobicContact CG2-CE2 3.74Å; V630-F746 HydrophobicContact CG2-CG 3.72Å; V630-F746 HydrophobicContact CG2-CZ 4.12Å
631	V	91.4	Very high	88.8	Confident	31 Å²	31	43.9 Å²	43.9	19%	0.188	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	140.8	173.7	177.4	0	0	0	0	107.3	I641 K715 L716 L717	V631-I641 HydrophobicContact CB-CG1 4.43Å; V631-I641 HydrophobicContact CG1-CG1 4.47Å; V631-I641 HydrophobicContact CG2-CB 4.49Å; V631-I641 HydrophobicContact CG2-CG1 4.21Å; V631-I641 HydrophobicContact CG2-CG2 4.26Å; V631-K715 PolarHBondContact N-O 3.05Å; V631-L716 HydrophobicContact CB-CD1 4.29Å; V631-L716 HydrophobicContact CG1-CD1 4.07Å; V631-L716 WeakPolarHBondContact O-CA 3.42Å; V631-L717 PolarHBondContact O-N 2.9Å
632	A	92.6	Very high	88.7	Confident	17 Å²	17	44.8 Å²	44.8	14%	0.14	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	129.9	-178.4	0	0	0	0	0	112.9	L717 K719 F746	A632-L717 VanDerWaalsContact CA-O 3.3Å; A632-L717 WeakPolarHBondContact CA-O 3.14Å; A632-K719 HydrophobicContact CB-CG 4.12Å; A632-F746 HydrophobicContact CB-CE1 4.1Å; A632-F746 HydrophobicContact CB-CZ 3.7Å
633	S	93.3	Very high	88.7	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.021	24%	0.243	C	C	.	.			trans	-145.8	148.6	178.5	-170	0	0	0	0	110.3	E637 M696 L717 R718	S633-E637 WeakPolarHBondContact OG-CB 3.47Å; S633-E637 PolarHBondContact OG-OE2 2.95Å; S633-E637 VanDerWaalsContact OG-OE2 3.09Å; S633-M696 WeakPolarHBondContact O-CE 3.49Å; S633-L717 PolarHBondContact N-O 3.22Å; S633-R718 WeakPolarHBondContact O-CA 3.2Å
634	D	93.2	Very high	88.7	Confident	32 Å²	32	44.8 Å²	44.8	17%	0.171	24%	0.244	C	C	.	.			trans	-89.9	163.9	174.4	-102.3	-68.8	0	0	0	112	G636 E637 R718 K719	D634-G636 PolarHBondContact O-N 3.39Å; D634-E637 HydrophobicContact CB-CG 4.04Å; D634-E637 PolarHBondContact N-OE2 3.36Å; D634-E637 WeakPolarHBondContact O-CB 3.3Å; D634-E637 PolarHBondContact O-N 3.03Å; D634-R718 IonicContact OD1-CZ 2.63Å; D634-R718 IonicContact OD1-NE 2.72Å; D634-R718 PolarHBondContact OD1-NE 3.03Å; D634-R718 IonicContact OD1-NH2 3.6Å; D634-R718 PolarHBondContact OD1-NH2 2.81Å; D634-K719 WeakPolarHBondContact OD2-CB 3.43Å
635	F	93.2	Very high	88.8	Confident	103 Å²	103	44 Å²	44	45%	0.452	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	136.3	-179.9	-55.5	-46.4	0	0	0	111.4	E637 V691 K693 M696	F635-E637 VanDerWaalsContact C-N 3.3Å; F635-V691 CarbonylContact C-O 3.55Å; F635-V691 WeakPolarHBondContact CA-O 3.38Å; F635-K693 VanDerWaalsContact CE1-CA 3.47Å; F635-K693 HydrophobicContact CE1-CB 4.04Å; F635-K693 HydrophobicContact CZ-CB 3.98Å; F635-K693 HydrophobicContact CZ-CG 4.33Å; F635-M696 HydrophobicContact CD1-CE 3.98Å; F635-M696 HydrophobicContact CE1-CE 3.61Å; F635-M696 HydrophobicContact CE1-CG 4Å
636	G	91.1	Very high	89.2	Confident	49 Å²	49	43.1 Å²	43.1	51%	0.505	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.4	-3	-174.1	0	0	0	0	0	115.2	D634 D690 V691	D634-G636 PolarHBondContact O-N 3.39Å; G636-D690 WeakPolarHBondContact CA-OD1 3.25Å; G636-V691 PolarHBondContact N-O 2.85Å
637	E	92.4	Very high	89.5	Confident	70 Å²	70	39.4 Å²	39.4	33%	0.327	21%	0.211	S	C	.	.	S	Bend	trans	-83.3	-178	171.9	-62.9	-172.2	153.2	0	0	112	S633 D634 F635 D690 V691 K719	S633-E637 WeakPolarHBondContact OG-CB 3.47Å; S633-E637 PolarHBondContact OG-OE2 2.95Å; S633-E637 VanDerWaalsContact OG-OE2 3.09Å; D634-E637 HydrophobicContact CB-CG 4.04Å; D634-E637 PolarHBondContact N-OE2 3.36Å; D634-E637 WeakPolarHBondContact O-CB 3.3Å; D634-E637 PolarHBondContact O-N 3.03Å; F635-E637 VanDerWaalsContact C-N 3.3Å; E637-D690 WeakPolarHBondContact O-CA 3.49Å; E637-D690 PolarHBondContact O-N 3.35Å; E637-V691 WeakPolarHBondContact O-CG2 3.21Å; E637-V691 PolarHBondContact O-N 3.01Å; E637-K719 IonicContact OE1-NZ 2.69Å; E637-K719 PolarHBondContact OE1-NZ 3.31Å; E637-K719 WeakPolarHBondContact OE2-CE 3.42Å; E637-K719 IonicContact OE2-NZ 3.77Å; E637-K719 PolarHBondContact OE2-NZ 3.19Å
638	I	91.1	Very high	90.1	Very high	105 Å²	105	34.9 Å²	34.9	54%	0.538	19%	0.192	S	C	.	.			trans	-104.9	122.6	166.6	-60.1	172.4	0	0	0	107.9	I687 I688	I638-I687 HydrophobicContact CG2-CG2 3.68Å; I638-I688 CarbonylContact C-O 3.54Å; I638-I688 WeakPolarHBondContact CA-O 3.13Å
639	A	91.2	Very high	90.6	Very high	3 Å²	3	35.1 Å²	35.1	3%	0.025	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	145.2	169.3	0	0	0	0	0	110.7	I687 I688 V691 L716	A639-I687 WeakPolarHBondContact O-CA 2.99Å; A639-I688 HydrophobicContact CB-CB 4.3Å; A639-I688 PolarHBondContact N-O 3.26Å; A639-I688 PolarHBondContact O-N 2.82Å; A639-V691 HydrophobicContact CB-CG2 3.69Å; A639-L716 HydrophobicContact CB-CD1 3.68Å; A639-L716 HydrophobicContact CB-CD2 4.07Å
640	Q	90.6	Very high	90.7	Very high	111 Å²	111	36.7 Å²	36.7	52%	0.519	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	119.9	175.3	-173.3	-179.6	-1.7	0	0	109.5	V642 A685 L686 I687	Q640-V642 HydrophobicContact CG-CG2 4.01Å; Q640-A685 HydrophobicContact CG-CB 3.94Å; Q640-L686 CarbonylContact C-O 3.59Å; Q640-L686 WeakPolarHBondContact CA-O 3.39Å; Q640-I687 HydrophobicContact CG-CG1 4.26Å
641	I	91.9	Very high	90.8	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	108.2	178.2	-50.8	-179.4	0	0	0	107.7	V631 W655 A685 L686 I688 Y699 F714	V631-I641 HydrophobicContact CB-CG1 4.43Å; V631-I641 HydrophobicContact CG1-CG1 4.47Å; V631-I641 HydrophobicContact CG2-CB 4.49Å; V631-I641 HydrophobicContact CG2-CG1 4.21Å; V631-I641 HydrophobicContact CG2-CG2 4.26Å; I641-W655 HydrophobicContact CB-CH2 4.1Å; I641-W655 HydrophobicContact CB-CZ3 4.34Å; I641-W655 HydrophobicContact CG2-CH2 3.73Å; I641-W655 HydrophobicContact CG2-CZ3 3.86Å; I641-W655 WeakPolarHBondContact O-CH2 3.32Å; I641-W655 WeakPolarHBondContact O-CZ2 3.32Å; I641-A685 CarbonylContact O-C 3.52Å; I641-A685 WeakPolarHBondContact O-CA 3.06Å; I641-L686 HydrophobicContact CB-CB 4.46Å; I641-L686 PolarHBondContact N-O 2.93Å; I641-L686 PolarHBondContact O-N 2.75Å; I641-I688 HydrophobicContact CD1-CD1 4.08Å; I641-Y699 HydrophobicContact CD1-CD2 3.63Å; I641-Y699 HydrophobicContact CD1-CE2 4.33Å; I641-Y699 HydrophobicContact CD1-CG 3.8Å; I641-F714 HydrophobicContact CG2-CB 3.52Å; I641-F714 HydrophobicContact CG2-CD1 3.85Å; I641-F714 HydrophobicContact CG2-CD2 3.58Å; I641-F714 HydrophobicContact CG2-CE1 4.44Å; I641-F714 HydrophobicContact CG2-CE2 4.2Å; I641-F714 HydrophobicContact CG2-CG 3.37Å
642	V	90	Very high	90.7	Very high	41 Å²	41	37.9 Å²	37.9	25%	0.248	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	115	-174.3	-173.3	0	0	0	0	110.7	N624 Q640 K644 A685	N624-V642 PolarHBondContact ND2-O 3.41Å; Q640-V642 HydrophobicContact CG-CG2 4.01Å; V642-K644 HydrophobicContact CG1-CG 4.06Å; V642-A685 HydrophobicContact CG2-CB 4.06Å
643	C	90.7	Very high	90.7	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	120.1	171.4	-176.3	0	0	0	0	110.2	N624 W655 E683 N684 C701 F714	N624-C643 WeakPolarHBondContact OD1-CA 3.33Å; C643-W655 HydrophobicContact CB-CH2 3.73Å; C643-W655 HydrophobicContact CB-CZ2 3.61Å; C643-E683 WeakPolarHBondContact O-CA 3.36Å; C643-N684 WeakPolarHBondContact CB-O 3Å; C643-N684 PolarHBondContact N-O 3.32Å; C643-N684 PolarHBondContact O-N 2.89Å; C643-C701 HydrophobicContact CB-CB 3.5Å; C643-C701 WeakPolarHBondContact CB-SG 3.46Å; C643-C701 WeakPolarHBondContact SG-CB 3.38Å; C643-C701 CovalentContact SG-SG 2.03Å; C643-C701 PolarHBondContact SG-SG 2.93Å; C643-F714 HydrophobicContact CB-CE2 4.2Å; C643-F714 HydrophobicContact CB-CZ 4.29Å
644	K	89.7	Confident	90.6	Very high	22 Å²	22	42.8 Å²	42.8	10%	0.096	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	133.2	179.1	-59.4	-175.8	-179.3	168.6	0	109.7	I622 I623 N624 V642 E683 E785	I622-K644 CarbonylContact C-O 3.52Å; I622-K644 WeakPolarHBondContact CA-O 3.27Å; I623-K644 HydrophobicContact CD1-CB 4.25Å; I623-K644 HydrophobicContact CG1-CB 3.73Å; I623-K644 WeakPolarHBondContact CG1-O 3.47Å; I623-K644 PolarHBondContact N-O 3.38Å; N624-K644 PolarHBondContact OD1-N 3.42Å; V642-K644 HydrophobicContact CG1-CG 4.06Å; K644-E683 VanDerWaalsContact CD-OE1 3.29Å; K644-E683 WeakPolarHBondContact CD-OE1 3.43Å; K644-E683 WeakPolarHBondContact CE-OE1 3.22Å; K644-E683 HydrophobicContact CG-CG 3.98Å; K644-E683 WeakPolarHBondContact CG-OE1 3.48Å; K644-E785 VanDerWaalsContact CD-OE1 3.31Å; K644-E785 WeakPolarHBondContact CD-OE1 3.48Å; K644-E785 WeakPolarHBondContact CD-OE2 3.3Å; K644-E785 IonicContact NZ-OE1 3.02Å; K644-E785 PolarHBondContact NZ-OE1 3.32Å; K644-E785 IonicContact NZ-OE2 3.74Å; K644-E785 PolarHBondContact NZ-OE2 2.66Å
645	V	89.3	Confident	90.6	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	132	-168.7	179.1	0	0	0	0	110.1	P620 V621 I622 A647 P651 F653 V681 Y682 A703	P620-V645 HydrophobicContact CB-CG1 3.81Å; V621-V645 WeakPolarHBondContact O-CA 3.43Å; I622-V645 HydrophobicContact CB-CG2 4.48Å; I622-V645 HydrophobicContact CG1-CG2 3.74Å; V645-A647 HydrophobicContact CG1-CB 4.22Å; V645-P651 HydrophobicContact CG1-CG 4.05Å; V645-F653 HydrophobicContact CB-CE1 4.14Å; V645-F653 HydrophobicContact CB-CZ 3.96Å; V645-F653 HydrophobicContact CG2-CE1 3.49Å; V645-F653 VanDerWaalsContact CG2-CE1 3.49Å; V645-F653 HydrophobicContact CG2-CZ 3.84Å; V645-V681 CarbonylContact O-C 3.58Å; V645-V681 WeakPolarHBondContact O-CA 3.05Å; V645-Y682 PolarHBondContact N-O 2.86Å; V645-Y682 PolarHBondContact O-N 2.79Å; V645-A703 HydrophobicContact CB-CB 4.49Å; V645-A703 HydrophobicContact CG1-CB 3.92Å; V645-A703 HydrophobicContact CG2-CB 3.86Å
646	T	89.9	Confident	90.5	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	134.2	160	176.6	0	0	0	0	109.8	W590 K593 H618 P620 V621 I623 D680	W590-T646 HydrophobicContact CD2-CG2 4.46Å; W590-T646 HydrophobicContact CE3-CG2 3.55Å; W590-T646 HydrophobicContact CH2-CG2 4.19Å; W590-T646 HydrophobicContact CZ3-CG2 3.39Å; K593-T646 WeakPolarHBondContact CE-OG1 3.4Å; K593-T646 PolarHBondContact NZ-OG1 2.8Å; H618-T646 VanDerWaalsContact CE1-C 3.43Å; H618-T646 PolarHBondContact CE1-O 3.31Å; H618-T646 PolarHBondContact CE1-OG1 2.62Å; H618-T646 PolarHBondContact NE2-OG1 3.02Å; P620-T646 CarbonylContact C-O 3.51Å; P620-T646 WeakPolarHBondContact CA-O 3.39Å; V621-T646 HydrophobicContact CB-CG2 3.98Å; V621-T646 PolarHBondContact N-O 2.91Å; V621-T646 PolarHBondContact O-N 3.41Å; I623-T646 HydrophobicContact CG2-CG2 3.6Å; T646-D680 VanDerWaalsContact CA-O 3.28Å; T646-D680 WeakPolarHBondContact CA-O 3.12Å; T646-D680 PolarHBondContact OG1-O 2.85Å
647	A	89.1	Confident	90.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	138	178	0	0	0	0	0	110.4	P620 V645 P649 P651 D680 Y682	P620-A647 HydrophobicContact CB-CB 4.02Å; P620-A647 HydrophobicContact CG-CB 4.03Å; V645-A647 HydrophobicContact CG1-CB 4.22Å; A647-P649 CarbonylContact C-O 3.58Å; A647-P649 VanDerWaalsContact C-O 3.26Å; A647-P649 WeakPolarHBondContact CB-O 2.92Å; A647-P649 CarbonylContact O-C 3.51Å; A647-P651 HydrophobicContact CB-CB 3.84Å; A647-P651 HydrophobicContact CB-CG 3.77Å; A647-D680 PolarHBondContact N-O 3.17Å; A647-Y682 VanDerWaalsContact O-CE2 3.24Å; A647-Y682 WeakPolarHBondContact O-CE2 3.43Å
648	S	88.9	Confident	90.1	Very high	16 Å²	16	41.6 Å²	41.6	11%	0.112	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	103.4	178.4	-165.5	0	0	0	0	110.1	V616 Q617 H618 D680 F707	V616-S648 WeakPolarHBondContact O-CB 3.44Å; Q617-S648 CarbonylContact C-O 3.51Å; Q617-S648 WeakPolarHBondContact CA-O 3.32Å; H618-S648 PolarHBondContact N-O 2.95Å; H618-S648 PolarHBondContact O-N 2.78Å; S648-D680 WeakPolarHBondContact CB-OD2 3.43Å; S648-D680 PolarHBondContact OG-OD2 2.93Å; S648-F707 WeakPolarHBondContact O-CE2 3.44Å
649	P	88.7	Confident	89.7	Confident	56 Å²	56	39.9 Å²	39.9	36%	0.364	22%	0.217	S	C	.	.	S	Bend	cis	-72.6	177.1	6.3	-20	34.4	0	0	0	116.8	A647 N705 L706	A647-P649 CarbonylContact C-O 3.58Å; A647-P649 VanDerWaalsContact C-O 3.26Å; A647-P649 WeakPolarHBondContact CB-O 2.92Å; A647-P649 CarbonylContact O-C 3.51Å; P649-N705 PolarHBondContact O-ND2 2.87Å; P649-L706 HydrophobicContact CG-CD2 3.91Å
650	E	86.8	Confident	89.5	Confident	73 Å²	73	47.1 Å²	47.1	34%	0.341	25%	0.25	S	S	.	.			trans	-40.7	137.1	173.8	178.6	165.8	-109.7	0	0	114.3	R675 Y682	E650-R675 WeakPolarHBondContact OE1-CD 3.38Å; E650-R675 IonicContact OE1-CZ 2.76Å; E650-R675 IonicContact OE1-NE 3.71Å; E650-R675 IonicContact OE1-NH1 3.6Å; E650-R675 PolarHBondContact OE1-NH1 2.9Å; E650-R675 IonicContact OE2-CZ 2.66Å; E650-R675 IonicContact OE2-NH1 2.69Å; E650-R675 PolarHBondContact OE2-NH1 2.97Å; E650-Y682 HydrophobicContact CB-CE1 3.75Å; E650-Y682 HydrophobicContact CG-CD1 3.98Å; E650-Y682 HydrophobicContact CG-CE1 3.53Å; E650-Y682 WeakPolarHBondContact OE1-CE1 3.35Å
651	P	90.7	Very high	89.5	Confident	5 Å²	5	45.3 Å²	45.3	3%	0.032	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-99.1	151	-177.8	37.3	-30.1	0	0	0	113.4	P620 V645 A647 F653 Y682 A703 A704	P620-P651 HydrophobicContact CB-CB 4.41Å; P620-P651 HydrophobicContact CG-CB 4.03Å; V645-P651 HydrophobicContact CG1-CG 4.05Å; A647-P651 HydrophobicContact CB-CB 3.84Å; A647-P651 HydrophobicContact CB-CG 3.77Å; P651-F653 HydrophobicContact CG-CE2 3.81Å; P651-F653 HydrophobicContact CG-CZ 4.17Å; P651-Y682 VanDerWaalsContact CD-CD2 3.5Å; P651-Y682 VanDerWaalsContact CD-CG 3.49Å; P651-Y682 HydrophobicContact CG-CD2 4.11Å; P651-Y682 HydrophobicContact CG-CG 4.05Å; P651-A703 HydrophobicContact CB-CB 4.22Å; P651-A704 CarbonylContact C-O 3.6Å; P651-A704 WeakPolarHBondContact CA-O 3.5Å
652	V	91.1	Very high	89.3	Confident	89 Å²	89	46.5 Å²	46.5	54%	0.539	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	124.6	167.5	-178.9	0	0	0	0	109.5	A703 A704	V652-A703 WeakPolarHBondContact O-CA 3.01Å; V652-A704 PolarHBondContact N-O 2.9Å; V652-A704 PolarHBondContact O-N 2.88Å
653	F	91	Very high	88.5	Confident	29 Å²	29	49.8 Å²	49.8	13%	0.127	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	148.4	178.6	-69.8	-97.1	0	0	0	112.7	V645 P651 H673 N684 K702 A703	V645-F653 HydrophobicContact CB-CE1 4.14Å; V645-F653 HydrophobicContact CB-CZ 3.96Å; V645-F653 HydrophobicContact CG2-CE1 3.49Å; V645-F653 VanDerWaalsContact CG2-CE1 3.49Å; V645-F653 HydrophobicContact CG2-CZ 3.84Å; P651-F653 HydrophobicContact CG-CE2 3.81Å; P651-F653 HydrophobicContact CG-CZ 4.17Å; F653-H673 AromaticContact CE2-CE1 3.77Å; F653-N684 HydrophobicContact CB-CB 4.08Å; F653-N684 HydrophobicContact CD1-CB 3.35Å; F653-N684 HydrophobicContact CD2-CB 3.98Å; F653-N684 HydrophobicContact CE1-CB 3.58Å; F653-N684 HydrophobicContact CE2-CB 4.2Å; F653-N684 HydrophobicContact CG-CB 3.54Å; F653-N684 HydrophobicContact CZ-CB 4.01Å; F653-K702 CarbonylContact C-O 3.56Å; F653-K702 WeakPolarHBondContact CA-O 3.5Å; F653-A703 HydrophobicContact CD1-CB 4.44Å; F653-A703 HydrophobicContact CE1-CB 4.49Å
654	R	91.5	Very high	87.2	Confident	94 Å²	94	56 Å²	56	36%	0.355	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	147.5	168.2	-70.2	178.8	167.5	87.3	0.4	110.2	Y656 E661 K702	R654-Y656 HydrophobicContact CB-CE2 3.79Å; R654-Y656 VanDerWaalsContact CD-OH 3.26Å; R654-Y656 WeakPolarHBondContact CD-OH 3.49Å; R654-E661 WeakPolarHBondContact CD-OE1 3.5Å; R654-E661 IonicContact NE-OE1 2.66Å; R654-E661 PolarHBondContact NE-OE1 3.16Å; R654-E661 IonicContact NE-OE2 3.14Å; R654-K702 HydrophobicContact CB-CB 4.42Å; R654-K702 PolarHBondContact N-O 3.43Å; R654-K702 PolarHBondContact O-N 3.48Å
655	W	92.7	Very high	86.2	Confident	1 Å²	1	59.6 Å²	59.6	0%	0.004	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	142.2	171.3	-71.1	95.8	0	0	0	111.1	I641 C643 L662 N684 L686 S700 C701 F714	I641-W655 HydrophobicContact CB-CH2 4.1Å; I641-W655 HydrophobicContact CB-CZ3 4.34Å; I641-W655 HydrophobicContact CG2-CH2 3.73Å; I641-W655 HydrophobicContact CG2-CZ3 3.86Å; I641-W655 WeakPolarHBondContact O-CH2 3.32Å; I641-W655 WeakPolarHBondContact O-CZ2 3.32Å; C643-W655 HydrophobicContact CB-CH2 3.73Å; C643-W655 HydrophobicContact CB-CZ2 3.61Å; W655-L662 HydrophobicContact CB-CB 4.3Å; W655-L662 HydrophobicContact CB-CD1 4.09Å; W655-L662 HydrophobicContact CB-CG 4.49Å; W655-L662 PolarHBondContact O-N 3.3Å; W655-N684 PolarHBondContact NE1-OD1 2.78Å; W655-L686 HydrophobicContact CB-CD2 4.44Å; W655-L686 HydrophobicContact CD2-CB 3.65Å; W655-L686 HydrophobicContact CD2-CD2 4.05Å; W655-L686 HydrophobicContact CD2-CG 4.35Å; W655-L686 HydrophobicContact CE3-CB 4.03Å; W655-L686 HydrophobicContact CE3-CD2 3.92Å; W655-L686 HydrophobicContact CG-CB 4.07Å; W655-L686 HydrophobicContact CG-CD1 4.35Å; W655-L686 HydrophobicContact CG-CD2 4.27Å; W655-L686 HydrophobicContact CG-CG 4.47Å; W655-L686 HydrophobicContact CH2-CB 4.14Å; W655-L686 HydrophobicContact CZ2-CB 3.78Å; W655-L686 HydrophobicContact CZ3-CB 4.25Å; W655-L686 HydrophobicContact CZ3-CD2 4.48Å; W655-S700 CarbonylContact C-O 3.51Å; W655-S700 WeakPolarHBondContact CA-O 3.45Å; W655-C701 HydrophobicContact CD2-CB 4.39Å; W655-C701 HydrophobicContact CE3-CB 4.05Å; W655-C701 HydrophobicContact CH2-CB 3.81Å; W655-C701 HydrophobicContact CZ2-CB 4.13Å; W655-C701 HydrophobicContact CZ3-CB 3.76Å; W655-F714 HydrophobicContact CH2-CD2 4.09Å; W655-F714 AromaticContact CH2-CE2 3.9Å; W655-F714 HydrophobicContact CH2-CE2 3.9Å; W655-F714 AromaticContact CZ3-CD2 3.83Å; W655-F714 HydrophobicContact CZ3-CD2 3.83Å; W655-F714 HydrophobicContact CZ3-CE2 4.02Å
656	Y	92.7	Very high	85	Confident	43 Å²	43	61.5 Å²	61.5	17%	0.169	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	151.2	171.8	-57.4	-103.4	0	0	0	109.8	R654 Q660 E661 Y699 S700 K702	R654-Y656 HydrophobicContact CB-CE2 3.79Å; R654-Y656 VanDerWaalsContact CD-OH 3.26Å; R654-Y656 WeakPolarHBondContact CD-OH 3.49Å; Y656-Q660 CarbonylContact C-O 3.56Å; Y656-Q660 WeakPolarHBondContact CA-O 3.44Å; Y656-Q660 WeakPolarHBondContact CB-O 3.18Å; Y656-E661 VanDerWaalsContact CD1-CA 3.47Å; Y656-E661 HydrophobicContact CD1-CB 3.8Å; Y656-E661 HydrophobicContact CD1-CG 4.27Å; Y656-E661 HydrophobicContact CE1-CB 3.5Å; Y656-E661 HydrophobicContact CE1-CG 3.76Å; Y656-E661 WeakPolarHBondContact CE1-OE2 3.48Å; Y656-E661 VanDerWaalsContact CZ-OE2 3.24Å; Y656-E661 PolarHBondContact OH-OE2 3.45Å; Y656-Y699 CarbonylContact O-C 3.58Å; Y656-Y699 WeakPolarHBondContact O-CA 3.41Å; Y656-S700 PolarHBondContact N-O 3.47Å; Y656-S700 PolarHBondContact O-N 3.26Å; Y656-K702 HydrophobicContact CD2-CB 4.31Å; Y656-K702 HydrophobicContact CE2-CB 3.8Å; Y656-K702 HydrophobicContact CE2-CD 4Å; Y656-K702 HydrophobicContact CE2-CG 4.45Å
657	R	90.6	Very high	84	Confident	58 Å²	58	67 Å²	67	22%	0.219	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	130.9	170.9	173.2	180	162.9	166.7	-9.1	108	G659 Q660 L662 G694 D695 Y699	R657-G659 PolarHBondContact O-N 3.35Å; R657-Q660 PolarHBondContact N-O 2.96Å; R657-Q660 PolarHBondContact O-N 3.08Å; R657-L662 HydrophobicContact CB-CD1 4.38Å; R657-L662 HydrophobicContact CB-CD2 3.96Å; R657-L662 HydrophobicContact CB-CG 4.25Å; R657-G694 PolarHBondContact NH2-O 3.01Å; R657-D695 IonicContact CZ-OD1 2.83Å; R657-D695 IonicContact NH1-OD1 3.65Å; R657-D695 PolarHBondContact NH1-OD1 3.31Å; R657-Y699 HydrophobicContact CB-CD1 3.99Å; R657-Y699 HydrophobicContact CB-CE1 4.01Å; R657-Y699 HydrophobicContact CG-CD1 4.3Å; R657-Y699 HydrophobicContact CG-CE1 3.98Å; R657-Y699 PolarHBondContact NH1-OH 2.86Å; R657-Y699 VanDerWaalsContact NH1-OH 3.12Å
658	D	83.1	Confident	83.7	Confident	126 Å²	126	69 Å²	69	67%	0.674	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	26	-179.7	-55.3	-52.2	0	0	0	114.1
659	G	83.2	Confident	83.5	Confident	70 Å²	70	69.7 Å²	69.7	72%	0.722	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.7	-9.5	-177.8	0	0	0	0	0	116.1	R657	R657-G659 PolarHBondContact O-N 3.35Å
660	Q	88.3	Confident	83.2	Confident	155 Å²	155	69.1 Å²	69.1	72%	0.724	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.7	139	179.3	-176.5	171.6	-12.4	0	0	111.7	Y656 R657	Y656-Q660 CarbonylContact C-O 3.56Å; Y656-Q660 WeakPolarHBondContact CA-O 3.44Å; Y656-Q660 WeakPolarHBondContact CB-O 3.18Å; R657-Q660 PolarHBondContact N-O 2.96Å; R657-Q660 PolarHBondContact O-N 3.08Å
661	E	89.6	Confident	82.8	Confident	73 Å²	73	67.4 Å²	67.4	34%	0.341	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	131.9	179.5	-160.5	161.9	144.1	0	0	110.8	R654 Y656 V663	R654-E661 WeakPolarHBondContact CD-OE1 3.5Å; R654-E661 IonicContact NE-OE1 2.66Å; R654-E661 PolarHBondContact NE-OE1 3.16Å; R654-E661 IonicContact NE-OE2 3.14Å; Y656-E661 VanDerWaalsContact CD1-CA 3.47Å; Y656-E661 HydrophobicContact CD1-CB 3.8Å; Y656-E661 HydrophobicContact CD1-CG 4.27Å; Y656-E661 HydrophobicContact CE1-CB 3.5Å; Y656-E661 HydrophobicContact CE1-CG 3.76Å; Y656-E661 WeakPolarHBondContact CE1-OE2 3.48Å; Y656-E661 VanDerWaalsContact CZ-OE2 3.24Å; Y656-E661 PolarHBondContact OH-OE2 3.45Å; E661-V663 HydrophobicContact CB-CG2 4.05Å; E661-V663 HydrophobicContact CG-CG2 4.1Å; E661-V663 PolarHBondContact O-N 3.13Å; E661-V663 VanDerWaalsContact O-N 3.11Å
662	L	87.4	Confident	82	Confident	24 Å²	24	71.2 Å²	71.2	13%	0.126	39%	0.392	C	S	.	.			trans	-79	90.7	172.7	-65.3	-178.1	0	0	0	108.7	W655 R657 Y665 F669 L686 Y699	W655-L662 HydrophobicContact CB-CB 4.3Å; W655-L662 HydrophobicContact CB-CD1 4.09Å; W655-L662 HydrophobicContact CB-CG 4.49Å; W655-L662 PolarHBondContact O-N 3.3Å; R657-L662 HydrophobicContact CB-CD1 4.38Å; R657-L662 HydrophobicContact CB-CD2 3.96Å; R657-L662 HydrophobicContact CB-CG 4.25Å; L662-Y665 VanDerWaalsContact O-CE2 3.26Å; L662-Y665 WeakPolarHBondContact O-CE2 3.35Å; L662-Y665 VanDerWaalsContact O-CZ 3.28Å; L662-Y665 PolarHBondContact O-OH 2.85Å; L662-Y665 VanDerWaalsContact O-OH 3.11Å; L662-F669 HydrophobicContact CD1-CD1 4.3Å; L662-F669 HydrophobicContact CD2-CE2 4.47Å; L662-L686 HydrophobicContact CD1-CD1 3.99Å; L662-L686 HydrophobicContact CD1-CD2 3.8Å; L662-Y699 HydrophobicContact CD1-CD1 4.17Å; L662-Y699 HydrophobicContact CD1-CE1 4.3Å
663	V	73.1	Confident	80.9	Confident	111 Å²	111	70.4 Å²	70.4	67%	0.673	38%	0.382	S	S	*	.			trans	-94.5	-26.7	178.8	-171.2	0	0	0	0	111.9	E661 Y665	E661-V663 HydrophobicContact CB-CG2 4.05Å; E661-V663 HydrophobicContact CG-CG2 4.1Å; E661-V663 PolarHBondContact O-N 3.13Å; E661-V663 VanDerWaalsContact O-N 3.11Å; V663-Y665 PolarHBondContact O-N 2.85Å
664	D	63.6	Low	79.6	Confident	131 Å²	131	72.7 Å²	72.7	70%	0.701	40%	0.399	S	S	*	.			trans	-89.3	84.2	-178	-172.1	12	0	0	0	111.6	G666	D664-G666 PolarHBondContact O-N 2.87Å; D664-G666 PolarHBondContact OD1-N 2.69Å
665	Y	68.5	Low	78.1	Confident	97 Å²	97	75 Å²	75	38%	0.38	41%	0.407	S	S	.	.			trans	-78.4	60	170.3	-63.7	-75.9	0	0	0	111.1	L662 V663 F669 S671	L662-Y665 VanDerWaalsContact O-CE2 3.26Å; L662-Y665 WeakPolarHBondContact O-CE2 3.35Å; L662-Y665 VanDerWaalsContact O-CZ 3.28Å; L662-Y665 PolarHBondContact O-OH 2.85Å; L662-Y665 VanDerWaalsContact O-OH 3.11Å; V663-Y665 PolarHBondContact O-N 2.85Å; Y665-F669 CarbonylContact C-O 3.53Å; Y665-F669 VanDerWaalsContact C-O 3.3Å; Y665-F669 VanDerWaalsContact CA-O 3.23Å; Y665-F669 WeakPolarHBondContact CA-O 3.31Å; Y665-S671 WeakPolarHBondContact CE1-OG 3.27Å
666	G	64.2	Low	76.3	Confident	39 Å²	39	78.8 Å²	78.8	40%	0.402	43%	0.428	S	S	.	.	S	Bend	trans	-84.3	-143.9	179.1	0	0	0	0	0	113.4	D664 K668	D664-G666 PolarHBondContact O-N 2.87Å; D664-G666 PolarHBondContact OD1-N 2.69Å; G666-K668 VanDerWaalsContact C-N 3.28Å; G666-K668 PolarHBondContact O-N 3Å
667	S	69.8	Low	74.6	Confident	116 Å²	116	82.7 Å²	82.7	81%	0.811	45%	0.447	S	S	*	.	S	Bend	trans	-72.8	-17	179.2	53.6	0	0	0	0	114.6	R689	S667-R689 WeakPolarHBondContact O-CD 3.37Å
668	K	82.9	Confident	73.2	Confident	43 Å²	43	81.9 Å²	81.9	19%	0.187	45%	0.45	C	S	.	.	S	Bend	trans	-96.2	-46.3	-173.7	-171.8	76	-174.8	-169.6	0	113.1	G666 R689 D690 E692 D695	G666-K668 VanDerWaalsContact C-N 3.28Å; G666-K668 PolarHBondContact O-N 3Å; K668-R689 WeakPolarHBondContact CD-O 3.4Å; K668-R689 WeakPolarHBondContact CE-O 3.43Å; K668-R689 PolarHBondContact O-N 2.91Å; K668-D690 PolarHBondContact NZ-O 2.9Å; K668-E692 IonicContact NZ-OE1 3.53Å; K668-E692 PolarHBondContact NZ-OE1 3.35Å; K668-D695 WeakPolarHBondContact CE-OD2 3.46Å; K668-D695 IonicContact NZ-OD2 3.18Å; K668-D695 PolarHBondContact NZ-OD2 3.12Å
669	F	84.1	Confident	72.4	Confident	31 Å²	31	78.2 Å²	78.2	14%	0.136	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	138.3	-177.4	-59.1	-71.1	0	0	0	110.4	L662 Y665 L686 I687 I688 Y699	L662-F669 HydrophobicContact CD1-CD1 4.3Å; L662-F669 HydrophobicContact CD2-CE2 4.47Å; Y665-F669 CarbonylContact C-O 3.53Å; Y665-F669 VanDerWaalsContact C-O 3.3Å; Y665-F669 VanDerWaalsContact CA-O 3.23Å; Y665-F669 WeakPolarHBondContact CA-O 3.31Å; F669-L686 HydrophobicContact CB-CD1 4.43Å; F669-L686 HydrophobicContact CD1-CD1 4.34Å; F669-I687 WeakPolarHBondContact CA-O 3.45Å; F669-I688 HydrophobicContact CD1-CG1 3.98Å; F669-I688 HydrophobicContact CD1-CG2 4.33Å; F669-I688 HydrophobicContact CE1-CB 4.48Å; F669-I688 HydrophobicContact CE1-CG1 3.98Å; F669-I688 HydrophobicContact CE1-CG2 3.93Å; F669-Y699 HydrophobicContact CE1-CE1 4.15Å
670	D	81.4	Confident	72.2	Confident	43 Å²	43	76.5 Å²	76.5	23%	0.23	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	151.7	-178.9	179.3	7.6	0	0	0	107.8	I687 R689	D670-I687 HydrophobicContact CB-CB 4.09Å; D670-I687 HydrophobicContact CB-CG2 4.4Å; D670-I687 PolarHBondContact N-O 3.02Å; D670-I687 PolarHBondContact O-N 2.96Å; D670-R689 IonicContact OD2-CZ 3.44Å; D670-R689 IonicContact OD2-NE 2.76Å; D670-R689 IonicContact OD2-NH2 2.75Å; D670-R689 PolarHBondContact OD2-NH2 2.76Å
671	S	78.5	Confident	72	Confident	37 Å²	37	69.9 Å²	69.9	26%	0.259	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	115.3	178.5	69.9	0	0	0	0	112.7	Y665 A685	Y665-S671 WeakPolarHBondContact CE1-OG 3.27Å; S671-A685 WeakPolarHBondContact CA-O 3.43Å
672	N	74.8	Confident	71.8	Confident	86 Å²	86	67.4 Å²	67.4	46%	0.46	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	117.3	176.1	-81.6	-50.1	0	0	0	110.4	N684 A685 I687	N672-N684 WeakPolarHBondContact O-CA 3.47Å; N672-A685 PolarHBondContact N-O 3.01Å; N672-A685 VanDerWaalsContact N-O 3.07Å; N672-A685 PolarHBondContact O-N 3.07Å; N672-I687 HydrophobicContact CB-CD1 4.45Å; N672-I687 WeakPolarHBondContact ND2-CD1 3.28Å
673	H	68.7	Low	71.8	Confident	71 Å²	71	68.3 Å²	68.3	33%	0.329	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	111.7	169.5	-176.8	18.9	0	0	0	109.6	F653 E683	F653-H673 AromaticContact CE2-CE1 3.77Å; H673-E683 CarbonylContact C-O 3.55Å; H673-E683 PolarHBondContact ND1-O 2.87Å
674	V	63.3	Low	72.6	Confident	78 Å²	78	63.5 Å²	63.5	47%	0.473	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	107.1	173.7	-177.7	0	0	0	0	108.1	N676 E683	V674-N676 VanDerWaalsContact C-N 3.34Å; V674-N676 PolarHBondContact O-N 3.16Å; V674-E683 HydrophobicContact CB-CB 4.3Å; V674-E683 PolarHBondContact N-O 2.84Å; V674-E683 PolarHBondContact O-N 2.93Å; V674-E683 VanDerWaalsContact O-N 3.12Å
675	R	58.8	Low	73.8	Confident	142 Å²	142	57.5 Å²	57.5	54%	0.536	30%	0.303	S	S	.	.			trans	-77.9	83.6	171.6	-75.3	-166.5	-137.6	-132.7	4.1	110.3	E650 H677	E650-R675 WeakPolarHBondContact OE1-CD 3.38Å; E650-R675 IonicContact OE1-CZ 2.76Å; E650-R675 IonicContact OE1-NE 3.71Å; E650-R675 IonicContact OE1-NH1 3.6Å; E650-R675 PolarHBondContact OE1-NH1 2.9Å; E650-R675 IonicContact OE2-CZ 2.66Å; E650-R675 IonicContact OE2-NH1 2.69Å; E650-R675 PolarHBondContact OE2-NH1 2.97Å; R675-H677 VanDerWaalsContact CD-NE2 3.3Å; R675-H677 WeakPolarHBondContact CD-NE2 3.48Å; R675-H677 PolarHBondContact O-N 3.03Å
676	N	55.9	Low	74.9	Confident	81 Å²	81	52.9 Å²	52.9	43%	0.433	29%	0.285	S	S	.	.			trans	-88.1	79	171.3	-168.6	5.6	0	0	0	110.1	V674 S678	V674-N676 VanDerWaalsContact C-N 3.34Å; V674-N676 PolarHBondContact O-N 3.16Å; N676-S678 PolarHBondContact O-N 3.1Å; N676-S678 PolarHBondContact O-OG 2.8Å; N676-S678 PolarHBondContact OD1-OG 3.11Å
677	H	56.5	Low	76.2	Confident	124 Å²	124	51.8 Å²	51.8	57%	0.574	27%	0.27	S	S	*	.			trans	-60.2	5.6	-171.2	-71.1	173.3	0	0	0	116.5	R675 F679	R675-H677 VanDerWaalsContact CD-NE2 3.3Å; R675-H677 WeakPolarHBondContact CD-NE2 3.48Å; R675-H677 PolarHBondContact O-N 3.03Å; H677-F679 PolarHBondContact O-N 3.37Å; H677-F679 VanDerWaalsContact O-N 3.16Å
678	S	60.8	Low	77.3	Confident	41 Å²	41	46.3 Å²	46.3	29%	0.287	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-56.8	119	165	58.8	0	0	0	0	110.2	N676 D680 V681	N676-S678 PolarHBondContact O-N 3.1Å; N676-S678 PolarHBondContact O-OG 2.8Å; N676-S678 PolarHBondContact OD1-OG 3.11Å; S678-D680 PolarHBondContact O-N 2.93Å; S678-V681 WeakPolarHBondContact O-CB 3.3Å; S678-V681 PolarHBondContact O-N 2.91Å
679	F	66.9	Low	77.6	Confident	50 Å²	50	49 Å²	49	22%	0.219	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	62.4	34.7	160	-58.1	-54.3	0	0	0	117.1	K593 F595 F613 H677 V681 F782	K593-F679 PolarHBondContact NZ-O 2.82Å; F595-F679 AromaticContact CE2-CE1 3.57Å; F595-F679 HydrophobicContact CE2-CE1 3.57Å; F595-F679 AromaticContact CE2-CZ 3.82Å; F595-F679 HydrophobicContact CE2-CZ 3.82Å; F595-F679 AromaticContact CZ-CE1 3.97Å; F595-F679 HydrophobicContact CZ-CE1 3.97Å; F595-F679 HydrophobicContact CZ-CZ 4.37Å; F613-F679 AromaticContact CE2-CD1 3.83Å; F613-F679 HydrophobicContact CE2-CD1 3.83Å; F613-F679 HydrophobicContact CE2-CE1 4.01Å; F613-F679 AromaticContact CZ-CD1 3.75Å; F613-F679 HydrophobicContact CZ-CD1 3.75Å; F613-F679 HydrophobicContact CZ-CE1 4.24Å; H677-F679 PolarHBondContact O-N 3.37Å; H677-F679 VanDerWaalsContact O-N 3.16Å; F679-V681 PolarHBondContact O-N 2.81Å; F679-F782 HydrophobicContact CB-CD1 4.06Å; F679-F782 HydrophobicContact CB-CE1 3.47Å; F679-F782 VanDerWaalsContact CB-CE1 3.47Å; F679-F782 HydrophobicContact CB-CZ 4.25Å; F679-F782 AromaticContact CD1-CE1 3.42Å; F679-F782 HydrophobicContact CD1-CE1 3.42Å; F679-F782 VanDerWaalsContact CD1-CE1 3.42Å; F679-F782 AromaticContact CD1-CZ 3.46Å; F679-F782 HydrophobicContact CD1-CZ 3.46Å; F679-F782 VanDerWaalsContact CD1-CZ 3.46Å; F679-F782 HydrophobicContact CD2-CE1 4.41Å; F679-F782 HydrophobicContact CD2-CZ 4.41Å; F679-F782 HydrophobicContact CE1-CE1 4.29Å; F679-F782 AromaticContact CE1-CZ 3.88Å; F679-F782 HydrophobicContact CE1-CZ 3.88Å; F679-F782 HydrophobicContact CG-CD1 4.44Å; F679-F782 AromaticContact CG-CE1 3.49Å; F679-F782 HydrophobicContact CG-CE1 3.49Å; F679-F782 VanDerWaalsContact CG-CE1 3.49Å; F679-F782 AromaticContact CG-CZ 3.77Å; F679-F782 HydrophobicContact CG-CZ 3.77Å
680	D	79.2	Confident	78	Confident	33 Å²	33	52.5 Å²	52.5	18%	0.176	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	56.7	32.4	-176.3	-67.5	-9.3	0	0	0	113	T646 A647 S648 S678 Y682	T646-D680 VanDerWaalsContact CA-O 3.28Å; T646-D680 WeakPolarHBondContact CA-O 3.12Å; T646-D680 PolarHBondContact OG1-O 2.85Å; A647-D680 PolarHBondContact N-O 3.17Å; S648-D680 WeakPolarHBondContact CB-OD2 3.43Å; S648-D680 PolarHBondContact OG-OD2 2.93Å; S678-D680 PolarHBondContact O-N 2.93Å; D680-Y682 WeakPolarHBondContact O-CD2 3.33Å; D680-Y682 WeakPolarHBondContact O-CE2 3.28Å
681	V	83.5	Confident	78.5	Confident	16 Å²	16	50.5 Å²	50.5	10%	0.097	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	144.6	172.9	-175.5	0	0	0	0	110.6	I623 V645 S678 F679	I623-V681 HydrophobicContact CD1-CG1 3.98Å; I623-V681 HydrophobicContact CD1-CG2 4.49Å; V645-V681 CarbonylContact O-C 3.58Å; V645-V681 WeakPolarHBondContact O-CA 3.05Å; S678-V681 WeakPolarHBondContact O-CB 3.3Å; S678-V681 PolarHBondContact O-N 2.91Å; F679-V681 PolarHBondContact O-N 2.81Å
682	Y	85.3	Confident	79.2	Confident	21 Å²	21	53.8 Å²	53.8	8%	0.082	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	135.3	-175.1	-61.2	-92	0	0	0	109.2	V645 A647 E650 P651 D680	V645-Y682 PolarHBondContact N-O 2.86Å; V645-Y682 PolarHBondContact O-N 2.79Å; A647-Y682 VanDerWaalsContact O-CE2 3.24Å; A647-Y682 WeakPolarHBondContact O-CE2 3.43Å; E650-Y682 HydrophobicContact CB-CE1 3.75Å; E650-Y682 HydrophobicContact CG-CD1 3.98Å; E650-Y682 HydrophobicContact CG-CE1 3.53Å; E650-Y682 WeakPolarHBondContact OE1-CE1 3.35Å; P651-Y682 VanDerWaalsContact CD-CD2 3.5Å; P651-Y682 VanDerWaalsContact CD-CG 3.49Å; P651-Y682 HydrophobicContact CG-CD2 4.11Å; P651-Y682 HydrophobicContact CG-CG 4.05Å; D680-Y682 WeakPolarHBondContact O-CD2 3.33Å; D680-Y682 WeakPolarHBondContact O-CE2 3.28Å
683	E	88.1	Confident	80	Confident	43 Å²	43	58 Å²	58	20%	0.201	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	141.8	179.3	-52.1	-164.3	153.6	0	0	111.5	C643 K644 H673 V674	C643-E683 WeakPolarHBondContact O-CA 3.36Å; K644-E683 VanDerWaalsContact CD-OE1 3.29Å; K644-E683 WeakPolarHBondContact CD-OE1 3.43Å; K644-E683 WeakPolarHBondContact CE-OE1 3.22Å; K644-E683 HydrophobicContact CG-CG 3.98Å; K644-E683 WeakPolarHBondContact CG-OE1 3.48Å; H673-E683 CarbonylContact C-O 3.55Å; H673-E683 PolarHBondContact ND1-O 2.87Å; V674-E683 HydrophobicContact CB-CB 4.3Å; V674-E683 PolarHBondContact N-O 2.84Å; V674-E683 PolarHBondContact O-N 2.93Å; V674-E683 VanDerWaalsContact O-N 3.12Å
684	N	89	Confident	81	Confident	11 Å²	11	56.8 Å²	56.8	6%	0.059	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	128.4	171.2	-170.3	-76.6	0	0	0	109.3	C643 F653 W655 N672	C643-N684 WeakPolarHBondContact CB-O 3Å; C643-N684 PolarHBondContact N-O 3.32Å; C643-N684 PolarHBondContact O-N 2.89Å; F653-N684 HydrophobicContact CB-CB 4.08Å; F653-N684 HydrophobicContact CD1-CB 3.35Å; F653-N684 HydrophobicContact CD2-CB 3.98Å; F653-N684 HydrophobicContact CE1-CB 3.58Å; F653-N684 HydrophobicContact CE2-CB 4.2Å; F653-N684 HydrophobicContact CG-CB 3.54Å; F653-N684 HydrophobicContact CZ-CB 4.01Å; W655-N684 PolarHBondContact NE1-OD1 2.78Å; N672-N684 WeakPolarHBondContact O-CA 3.47Å
685	A	89.9	Confident	82.3	Confident	4 Å²	4	53.6 Å²	53.6	3%	0.033	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	118.1	-177.5	0	0	0	0	0	111.3	Q640 I641 V642 S671 N672	Q640-A685 HydrophobicContact CG-CB 3.94Å; I641-A685 CarbonylContact O-C 3.52Å; I641-A685 WeakPolarHBondContact O-CA 3.06Å; V642-A685 HydrophobicContact CG2-CB 4.06Å; S671-A685 WeakPolarHBondContact CA-O 3.43Å; N672-A685 PolarHBondContact N-O 3.01Å; N672-A685 VanDerWaalsContact N-O 3.07Å; N672-A685 PolarHBondContact O-N 3.07Å
686	L	92.1	Very high	83.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	123.6	166	177.7	66.4	0	0	0	108.9	Q640 I641 W655 L662 F669 I688 Y699	Q640-L686 CarbonylContact C-O 3.59Å; Q640-L686 WeakPolarHBondContact CA-O 3.39Å; I641-L686 HydrophobicContact CB-CB 4.46Å; I641-L686 PolarHBondContact N-O 2.93Å; I641-L686 PolarHBondContact O-N 2.75Å; W655-L686 HydrophobicContact CB-CD2 4.44Å; W655-L686 HydrophobicContact CD2-CB 3.65Å; W655-L686 HydrophobicContact CD2-CD2 4.05Å; W655-L686 HydrophobicContact CD2-CG 4.35Å; W655-L686 HydrophobicContact CE3-CB 4.03Å; W655-L686 HydrophobicContact CE3-CD2 3.92Å; W655-L686 HydrophobicContact CG-CB 4.07Å; W655-L686 HydrophobicContact CG-CD1 4.35Å; W655-L686 HydrophobicContact CG-CD2 4.27Å; W655-L686 HydrophobicContact CG-CG 4.47Å; W655-L686 HydrophobicContact CH2-CB 4.14Å; W655-L686 HydrophobicContact CZ2-CB 3.78Å; W655-L686 HydrophobicContact CZ3-CB 4.25Å; W655-L686 HydrophobicContact CZ3-CD2 4.48Å; L662-L686 HydrophobicContact CD1-CD1 3.99Å; L662-L686 HydrophobicContact CD1-CD2 3.8Å; F669-L686 HydrophobicContact CB-CD1 4.43Å; F669-L686 HydrophobicContact CD1-CD1 4.34Å; L686-I688 HydrophobicContact CD2-CD1 4.44Å; L686-I688 HydrophobicContact CD2-CG1 4.39Å; L686-I688 HydrophobicContact CG-CG1 4.22Å; L686-Y699 HydrophobicContact CD2-CD1 3.46Å; L686-Y699 VanDerWaalsContact CD2-CD1 3.46Å; L686-Y699 HydrophobicContact CD2-CE1 4.01Å; L686-Y699 HydrophobicContact CD2-CG 4.12Å
687	I	90.9	Very high	85.6	Confident	17 Å²	17	46.5 Å²	46.5	9%	0.087	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	125.7	177.6	-66.3	164.3	0	0	0	107.5	I638 A639 Q640 F669 D670 N672 R689	I638-I687 HydrophobicContact CG2-CG2 3.68Å; A639-I687 WeakPolarHBondContact O-CA 2.99Å; Q640-I687 HydrophobicContact CG-CG1 4.26Å; F669-I687 WeakPolarHBondContact CA-O 3.45Å; D670-I687 HydrophobicContact CB-CB 4.09Å; D670-I687 HydrophobicContact CB-CG2 4.4Å; D670-I687 PolarHBondContact N-O 3.02Å; D670-I687 PolarHBondContact O-N 2.96Å; N672-I687 HydrophobicContact CB-CD1 4.45Å; N672-I687 WeakPolarHBondContact ND2-CD1 3.28Å; I687-R689 HydrophobicContact CG2-CG 4.08Å
688	I	92	Very high	87.3	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	113.5	178.1	-51.9	166.4	0	0	0	106.7	I638 A639 I641 F669 L686 V691 D695 Y699 L716	I638-I688 CarbonylContact C-O 3.54Å; I638-I688 WeakPolarHBondContact CA-O 3.13Å; A639-I688 HydrophobicContact CB-CB 4.3Å; A639-I688 PolarHBondContact N-O 3.26Å; A639-I688 PolarHBondContact O-N 2.82Å; I641-I688 HydrophobicContact CD1-CD1 4.08Å; F669-I688 HydrophobicContact CD1-CG1 3.98Å; F669-I688 HydrophobicContact CD1-CG2 4.33Å; F669-I688 HydrophobicContact CE1-CB 4.48Å; F669-I688 HydrophobicContact CE1-CG1 3.98Å; F669-I688 HydrophobicContact CE1-CG2 3.93Å; L686-I688 HydrophobicContact CD2-CD1 4.44Å; L686-I688 HydrophobicContact CD2-CG1 4.39Å; L686-I688 HydrophobicContact CG-CG1 4.22Å; I688-V691 HydrophobicContact CB-CG2 4.38Å; I688-V691 HydrophobicContact CG2-CG2 4.15Å; I688-D695 HydrophobicContact CG2-CB 4.28Å; I688-Y699 HydrophobicContact CD1-CD1 4.46Å; I688-Y699 HydrophobicContact CD1-CD2 4.47Å; I688-Y699 HydrophobicContact CD1-CE1 3.84Å; I688-Y699 HydrophobicContact CD1-CE2 3.87Å; I688-L716 HydrophobicContact CD1-CD2 3.93Å
689	R	90.7	Very high	88.9	Confident	99 Å²	99	40.5 Å²	40.5	37%	0.374	21%	0.214	S	C	.	.	S	Bend	trans	-92.4	143.1	-175.6	-59.6	174.2	179.7	-84.5	0.9	110	S667 K668 D670 I687	S667-R689 WeakPolarHBondContact O-CD 3.37Å; K668-R689 WeakPolarHBondContact CD-O 3.4Å; K668-R689 WeakPolarHBondContact CE-O 3.43Å; K668-R689 PolarHBondContact O-N 2.91Å; D670-R689 IonicContact OD2-CZ 3.44Å; D670-R689 IonicContact OD2-NE 2.76Å; D670-R689 IonicContact OD2-NH2 2.75Å; D670-R689 PolarHBondContact OD2-NH2 2.76Å; I687-R689 HydrophobicContact CG2-CG 4.08Å
690	D	90.7	Very high	90.2	Very high	106 Å²	106	39.2 Å²	39.2	57%	0.567	21%	0.211	S	C	*	.	S	Bend	trans	51.3	63.3	179	-168.4	16.7	0	0	0	111.6	G636 E637 K668 E692	G636-D690 WeakPolarHBondContact CA-OD1 3.25Å; E637-D690 WeakPolarHBondContact O-CA 3.49Å; E637-D690 PolarHBondContact O-N 3.35Å; K668-D690 PolarHBondContact NZ-O 2.9Å; D690-E692 PolarHBondContact O-N 2.8Å
691	V	92.7	Very high	90.9	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.006	20%	0.202	C	C	.	.			trans	-59.4	123.5	-169.6	171.2	0	0	0	0	111.2	F635 G636 E637 A639 I688 M696 L716	F635-V691 CarbonylContact C-O 3.55Å; F635-V691 WeakPolarHBondContact CA-O 3.38Å; G636-V691 PolarHBondContact N-O 2.85Å; E637-V691 WeakPolarHBondContact O-CG2 3.21Å; E637-V691 PolarHBondContact O-N 3.01Å; A639-V691 HydrophobicContact CB-CG2 3.69Å; I688-V691 HydrophobicContact CB-CG2 4.38Å; I688-V691 HydrophobicContact CG2-CG2 4.15Å; V691-M696 HydrophobicContact CG1-CE 3.62Å; V691-L716 HydrophobicContact CG1-CD2 4.14Å
692	E	92.6	Very high	91.4	Very high	106 Å²	106	38.8 Å²	38.8	50%	0.495	21%	0.206	S	C	.	.			trans	-102.6	166.9	178.7	-70.6	170.7	-110.7	0	0	112.1	K668 D690 G694 D695	K668-E692 IonicContact NZ-OE1 3.53Å; K668-E692 PolarHBondContact NZ-OE1 3.35Å; D690-E692 PolarHBondContact O-N 2.8Å; E692-G694 PolarHBondContact O-N 2.77Å; E692-G694 VanDerWaalsContact O-N 3.16Å; E692-D695 WeakPolarHBondContact CB-OD2 3.33Å; E692-D695 PolarHBondContact N-OD2 2.72Å; E692-D695 PolarHBondContact O-N 2.8Å
693	K	91.6	Very high	91.8	Very high	175 Å²	175	37.8 Å²	37.8	76%	0.761	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	-55.5	-29.8	167.2	-177.2	179.4	174.9	-173.4	0	112.2	F635 D695	F635-K693 VanDerWaalsContact CE1-CA 3.47Å; F635-K693 HydrophobicContact CE1-CB 4.04Å; F635-K693 HydrophobicContact CZ-CB 3.98Å; F635-K693 HydrophobicContact CZ-CG 4.33Å; K693-D695 VanDerWaalsContact C-N 3.28Å; K693-D695 PolarHBondContact O-N 3.35Å
694	G	89.7	Confident	92.1	Very high	45 Å²	45	36.7 Å²	36.7	46%	0.464	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-67.9	-22.8	175.3	0	0	0	0	0	114	R657 E692	R657-G694 PolarHBondContact NH2-O 3.01Å; E692-G694 PolarHBondContact O-N 2.77Å; E692-G694 VanDerWaalsContact O-N 3.16Å
695	D	91	Very high	92.3	Very high	11 Å²	11	37.3 Å²	37.3	6%	0.059	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-90.8	-10.6	-173.6	-58.6	-48.4	0	0	0	114.2	R657 K668 I688 E692 K693 G697 Y699	R657-D695 IonicContact CZ-OD1 2.83Å; R657-D695 IonicContact NH1-OD1 3.65Å; R657-D695 PolarHBondContact NH1-OD1 3.31Å; K668-D695 WeakPolarHBondContact CE-OD2 3.46Å; K668-D695 IonicContact NZ-OD2 3.18Å; K668-D695 PolarHBondContact NZ-OD2 3.12Å; I688-D695 HydrophobicContact CG2-CB 4.28Å; E692-D695 WeakPolarHBondContact CB-OD2 3.33Å; E692-D695 PolarHBondContact N-OD2 2.72Å; E692-D695 PolarHBondContact O-N 2.8Å; K693-D695 VanDerWaalsContact C-N 3.28Å; K693-D695 PolarHBondContact O-N 3.35Å; D695-G697 PolarHBondContact O-N 3.1Å; D695-Y699 VanDerWaalsContact O-CE2 3.25Å; D695-Y699 WeakPolarHBondContact O-CE2 3.43Å; D695-Y699 PolarHBondContact O-OH 2.87Å
696	M	92.7	Very high	92.4	Very high	51 Å²	51	43.3 Å²	43.3	25%	0.251	24%	0.235	S	C	.	.			trans	-68	118.2	174.1	-63.4	-67.4	164.1	0	0	110	S633 F635 V691 L716 R718	S633-M696 WeakPolarHBondContact O-CE 3.49Å; F635-M696 HydrophobicContact CD1-CE 3.98Å; F635-M696 HydrophobicContact CE1-CE 3.61Å; F635-M696 HydrophobicContact CE1-CG 4Å; V691-M696 HydrophobicContact CG1-CE 3.62Å; M696-L716 HydrophobicContact SD-CD2 4.42Å; M696-L716 HydrophobicContact SD-CG 3.97Å; M696-R718 HydrophobicContact CE-CB 4.49Å
697	G	91.6	Very high	92.4	Very high	22 Å²	22	46.4 Å²	46.4	23%	0.227	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168	-162.2	-170.5	0	0	0	0	0	113.7	D695 K715 L716	D695-G697 PolarHBondContact O-N 3.1Å; G697-K715 CarbonylContact O-C 3.3Å; G697-K715 WeakPolarHBondContact O-CA 3.4Å; G697-L716 PolarHBondContact N-O 3.14Å; G697-L716 PolarHBondContact O-N 3.15Å
698	A	92.8	Very high	92.5	Very high	40 Å²	40	47 Å²	47	33%	0.331	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	128.1	-179.6	0	0	0	0	0	111.4	I713 F714	A698-I713 HydrophobicContact CB-CG2 3.92Å; A698-F714 WeakPolarHBondContact CA-O 3.32Å
699	Y	93.9	Very high	92.6	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	131.1	174.1	-65.3	-95.8	0	0	0	108.2	I641 Y656 R657 L662 F669 L686 I688 D695 F714 L716	I641-Y699 HydrophobicContact CD1-CD2 3.63Å; I641-Y699 HydrophobicContact CD1-CE2 4.33Å; I641-Y699 HydrophobicContact CD1-CG 3.8Å; Y656-Y699 CarbonylContact O-C 3.58Å; Y656-Y699 WeakPolarHBondContact O-CA 3.41Å; R657-Y699 HydrophobicContact CB-CD1 3.99Å; R657-Y699 HydrophobicContact CB-CE1 4.01Å; R657-Y699 HydrophobicContact CG-CD1 4.3Å; R657-Y699 HydrophobicContact CG-CE1 3.98Å; R657-Y699 PolarHBondContact NH1-OH 2.86Å; R657-Y699 VanDerWaalsContact NH1-OH 3.12Å; L662-Y699 HydrophobicContact CD1-CD1 4.17Å; L662-Y699 HydrophobicContact CD1-CE1 4.3Å; F669-Y699 HydrophobicContact CE1-CE1 4.15Å; L686-Y699 HydrophobicContact CD2-CD1 3.46Å; L686-Y699 VanDerWaalsContact CD2-CD1 3.46Å; L686-Y699 HydrophobicContact CD2-CE1 4.01Å; L686-Y699 HydrophobicContact CD2-CG 4.12Å; I688-Y699 HydrophobicContact CD1-CD1 4.46Å; I688-Y699 HydrophobicContact CD1-CD2 4.47Å; I688-Y699 HydrophobicContact CD1-CE1 3.84Å; I688-Y699 HydrophobicContact CD1-CE2 3.87Å; D695-Y699 VanDerWaalsContact O-CE2 3.25Å; D695-Y699 WeakPolarHBondContact O-CE2 3.43Å; D695-Y699 PolarHBondContact O-OH 2.87Å; Y699-F714 PolarHBondContact N-O 2.04Å; Y699-F714 PolarHBondContact O-N 2.84Å; Y699-L716 HydrophobicContact CD2-CB 4.34Å; Y699-L716 HydrophobicContact CE2-CB 4.03Å; Y699-L716 HydrophobicContact CE2-CD2 4.44Å
700	S	93.9	Very high	92.8	Very high	22 Å²	22	49 Å²	49	15%	0.154	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	134.3	174	71.6	0	0	0	0	112.6	W655 Y656 H712	W655-S700 CarbonylContact C-O 3.51Å; W655-S700 WeakPolarHBondContact CA-O 3.45Å; Y656-S700 PolarHBondContact N-O 3.47Å; Y656-S700 PolarHBondContact O-N 3.26Å; S700-H712 CarbonylContact C-O 3.24Å; S700-H712 WeakPolarHBondContact CA-O 3.4Å; S700-H712 WeakPolarHBondContact CB-O 3.37Å
701	C	93.8	Very high	92.9	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	133.2	166.6	173.9	0	0	0	0	108.5	C643 W655 V711 H712 F714	C643-C701 HydrophobicContact CB-CB 3.5Å; C643-C701 WeakPolarHBondContact CB-SG 3.46Å; C643-C701 WeakPolarHBondContact SG-CB 3.38Å; C643-C701 CovalentContact SG-SG 2.03Å; C643-C701 PolarHBondContact SG-SG 2.93Å; W655-C701 HydrophobicContact CD2-CB 4.39Å; W655-C701 HydrophobicContact CE3-CB 4.05Å; W655-C701 HydrophobicContact CH2-CB 3.81Å; W655-C701 HydrophobicContact CZ2-CB 4.13Å; W655-C701 HydrophobicContact CZ3-CB 3.76Å; C701-V711 VanDerWaalsContact O-CA 3.3Å; C701-V711 WeakPolarHBondContact O-CA 3.33Å; C701-H712 PolarHBondContact N-O 2.73Å; C701-H712 PolarHBondContact O-N 2.99Å; C701-F714 HydrophobicContact CB-CE2 3.91Å
702	K	94.6	Very high	92.9	Very high	41 Å²	41	48.7 Å²	48.7	18%	0.178	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	129.9	171.6	171.2	164.5	170.4	157.2	0	109.3	F653 R654 Y656 E709 D710 V711	F653-K702 CarbonylContact C-O 3.56Å; F653-K702 WeakPolarHBondContact CA-O 3.5Å; R654-K702 HydrophobicContact CB-CB 4.42Å; R654-K702 PolarHBondContact N-O 3.43Å; R654-K702 PolarHBondContact O-N 3.48Å; Y656-K702 HydrophobicContact CD2-CB 4.31Å; Y656-K702 HydrophobicContact CE2-CB 3.8Å; Y656-K702 HydrophobicContact CE2-CD 4Å; Y656-K702 HydrophobicContact CE2-CG 4.45Å; K702-E709 WeakPolarHBondContact CE-OE1 2.98Å; K702-E709 WeakPolarHBondContact CE-OE2 3.39Å; K702-E709 IonicContact NZ-OE1 3.68Å; K702-E709 PolarHBondContact NZ-OE1 3.35Å; K702-E709 IonicContact NZ-OE2 2.67Å; K702-E709 PolarHBondContact NZ-OE2 3.28Å; K702-D710 WeakPolarHBondContact CA-O 3.39Å; K702-V711 HydrophobicContact CB-CG2 3.99Å; K702-V711 HydrophobicContact CD-CG2 4.04Å; K702-V711 HydrophobicContact CG-CG2 3.92Å
703	A	93.5	Very high	92.9	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	134	177.1	0	0	0	0	0	110.4	P620 V645 P651 V652 F653 E709 D710	P620-A703 HydrophobicContact CB-CB 3.97Å; V645-A703 HydrophobicContact CB-CB 4.49Å; V645-A703 HydrophobicContact CG1-CB 3.92Å; V645-A703 HydrophobicContact CG2-CB 3.86Å; P651-A703 HydrophobicContact CB-CB 4.22Å; V652-A703 WeakPolarHBondContact O-CA 3.01Å; F653-A703 HydrophobicContact CD1-CB 4.44Å; F653-A703 HydrophobicContact CE1-CB 4.49Å; A703-E709 CarbonylContact O-C 3.56Å; A703-E709 WeakPolarHBondContact O-CA 3.3Å; A703-E709 WeakPolarHBondContact O-CB 3.4Å; A703-D710 PolarHBondContact N-O 3.32Å; A703-D710 PolarHBondContact O-N 3.02Å
704	A	95.1	Very high	93	Very high	20 Å²	20	40.8 Å²	40.8	17%	0.165	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	135.4	-175.6	0	0	0	0	0	112.9	P651 V652 G708 E709	P651-A704 CarbonylContact C-O 3.6Å; P651-A704 WeakPolarHBondContact CA-O 3.5Å; V652-A704 PolarHBondContact N-O 2.9Å; V652-A704 PolarHBondContact O-N 2.88Å; A704-G708 WeakPolarHBondContact CA-O 3.19Å; A704-E709 HydrophobicContact CB-CB 3.88Å
705	N	92.8	Very high	93.2	Very high	23 Å²	23	44 Å²	44	12%	0.123	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	-175	169.3	82.7	7.1	0	0	0	110.7	H618 P620 P649 F707 G708	H618-N705 PolarHBondContact O-ND2 2.98Å; P620-N705 WeakPolarHBondContact CD-OD1 3.3Å; P620-N705 HydrophobicContact CG-CB 4.06Å; P649-N705 PolarHBondContact O-ND2 2.87Å; N705-F707 PolarHBondContact O-N 2.96Å; N705-F707 VanDerWaalsContact O-N 3.09Å; N705-F707 WeakPolarHBondContact OD1-CB 3.44Å; N705-F707 PolarHBondContact OD1-N 2.86Å; N705-G708 PolarHBondContact N-O 3.39Å; N705-G708 PolarHBondContact O-N 2.74Å; N705-G708 VanDerWaalsContact O-N 3.1Å; N705-G708 VanDerWaalsContact O-O 3.08Å
706	L	92.6	Very high	93.3	Very high	131 Å²	131	43.5 Å²	43.5	69%	0.686	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-12	-176.1	72.4	87.3	0	0	0	115.6	P649	P649-L706 HydrophobicContact CG-CD2 3.91Å
707	F	91	Very high	93.4	Very high	65 Å²	65	43.7 Å²	43.7	29%	0.285	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-7.6	176	-63.7	-64	0	0	0	113.7	Q617 K619 S648 N705	Q617-F707 HydrophobicContact CB-CE2 3.77Å; Q617-F707 HydrophobicContact CB-CZ 4.02Å; K619-F707 HydrophobicContact CB-CB 3.87Å; K619-F707 WeakPolarHBondContact CB-O 3.49Å; S648-F707 WeakPolarHBondContact O-CE2 3.44Å; N705-F707 PolarHBondContact O-N 2.96Å; N705-F707 VanDerWaalsContact O-N 3.09Å; N705-F707 WeakPolarHBondContact OD1-CB 3.44Å; N705-F707 PolarHBondContact OD1-N 2.86Å
708	G	92.4	Very high	93.5	Very high	29 Å²	29	49.7 Å²	49.7	30%	0.299	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	143	-159.7	177.4	0	0	0	0	0	113.6	P620 A704 N705	P620-G708 WeakPolarHBondContact CD-O 3.43Å; A704-G708 WeakPolarHBondContact CA-O 3.19Å; N705-G708 PolarHBondContact N-O 3.39Å; N705-G708 PolarHBondContact O-N 2.74Å; N705-G708 VanDerWaalsContact O-N 3.1Å; N705-G708 VanDerWaalsContact O-O 3.08Å
709	E	95	Very high	93.5	Very high	95 Å²	95	49.7 Å²	49.7	44%	0.444	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	165.6	-175.4	58.1	176.6	-121.1	0	0	112.9	K619 K702 A703 A704	K619-E709 PolarHBondContact NZ-O 2.83Å; K702-E709 WeakPolarHBondContact CE-OE1 2.98Å; K702-E709 WeakPolarHBondContact CE-OE2 3.39Å; K702-E709 IonicContact NZ-OE1 3.68Å; K702-E709 PolarHBondContact NZ-OE1 3.35Å; K702-E709 IonicContact NZ-OE2 2.67Å; K702-E709 PolarHBondContact NZ-OE2 3.28Å; A703-E709 CarbonylContact O-C 3.56Å; A703-E709 WeakPolarHBondContact O-CA 3.3Å; A703-E709 WeakPolarHBondContact O-CB 3.4Å; A704-E709 HydrophobicContact CB-CB 3.88Å
710	D	94.6	Very high	93.5	Very high	45 Å²	45	52 Å²	52	24%	0.241	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	154.9	173.7	-163	30.5	0	0	0	111.1	K619 P620 V621 I622 K702 A703	K619-D710 IonicContact NZ-OD1 2.68Å; P620-D710 HydrophobicContact CB-CB 4.49Å; P620-D710 WeakPolarHBondContact O-CB 3.33Å; V621-D710 WeakPolarHBondContact CA-OD2 3.35Å; I622-D710 HydrophobicContact CD1-CB 4.25Å; I622-D710 HydrophobicContact CG1-CB 4.4Å; I622-D710 PolarHBondContact N-OD2 2.91Å; K702-D710 WeakPolarHBondContact CA-O 3.39Å; A703-D710 PolarHBondContact N-O 3.32Å; A703-D710 PolarHBondContact O-N 3.02Å
711	V	93.7	Very high	93.4	Very high	70 Å²	70	55.8 Å²	55.8	42%	0.424	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	129.8	-174.4	-174.3	0	0	0	0	111.4	C701 K702	C701-V711 VanDerWaalsContact O-CA 3.3Å; C701-V711 WeakPolarHBondContact O-CA 3.33Å; K702-V711 HydrophobicContact CB-CG2 3.99Å; K702-V711 HydrophobicContact CD-CG2 4.04Å; K702-V711 HydrophobicContact CG-CG2 3.92Å
712	H	92.4	Very high	93.4	Very high	31 Å²	31	56 Å²	56	14%	0.144	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	141.9	177.9	-167.4	90.8	0	0	0	110.8	I622 S700 C701 F714	I622-H712 HydrophobicContact CB-CB 4.08Å; I622-H712 HydrophobicContact CD1-CB 3.55Å; I622-H712 VanDerWaalsContact CD1-N 3.26Å; I622-H712 HydrophobicContact CG1-CB 4.34Å; I622-H712 HydrophobicContact CG2-CB 3.6Å; S700-H712 CarbonylContact C-O 3.24Å; S700-H712 WeakPolarHBondContact CA-O 3.4Å; S700-H712 WeakPolarHBondContact CB-O 3.37Å; C701-H712 PolarHBondContact N-O 2.73Å; C701-H712 PolarHBondContact O-N 2.99Å; H712-F714 HydrophobicContact CB-CE2 4.5Å; H712-F714 AromaticContact CD2-CE1 3.78Å; H712-F714 AromaticContact CD2-CE2 3.82Å; H712-F714 AromaticContact CD2-CZ 3.65Å
713	I	93.1	Very high	93.3	Very high	106 Å²	106	58.3 Å²	58.3	54%	0.544	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	118.6	-176.6	-49.8	-179.4	0	0	0	109.2	P629 A698	P629-I713 WeakPolarHBondContact CB-O 3.04Å; A698-I713 HydrophobicContact CB-CG2 3.92Å
714	F	93.2	Very high	93.2	Very high	9 Å²	9	61.3 Å²	61.3	4%	0.039	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	154.9	171	-54.4	-92.3	0	0	0	110.4	N624 P629 I641 C643 W655 A698 Y699 C701 H712	N624-F714 HydrophobicContact CB-CE1 3.97Å; N624-F714 HydrophobicContact CB-CZ 4.13Å; N624-F714 WeakPolarHBondContact OD1-CZ 3.45Å; P629-F714 CarbonylContact O-C 3.59Å; I641-F714 HydrophobicContact CG2-CB 3.52Å; I641-F714 HydrophobicContact CG2-CD1 3.85Å; I641-F714 HydrophobicContact CG2-CD2 3.58Å; I641-F714 HydrophobicContact CG2-CE1 4.44Å; I641-F714 HydrophobicContact CG2-CE2 4.2Å; I641-F714 HydrophobicContact CG2-CG 3.37Å; C643-F714 HydrophobicContact CB-CE2 4.2Å; C643-F714 HydrophobicContact CB-CZ 4.29Å; W655-F714 HydrophobicContact CH2-CD2 4.09Å; W655-F714 AromaticContact CH2-CE2 3.9Å; W655-F714 HydrophobicContact CH2-CE2 3.9Å; W655-F714 AromaticContact CZ3-CD2 3.83Å; W655-F714 HydrophobicContact CZ3-CD2 3.83Å; W655-F714 HydrophobicContact CZ3-CE2 4.02Å; A698-F714 WeakPolarHBondContact CA-O 3.32Å; Y699-F714 PolarHBondContact N-O 2.04Å; Y699-F714 PolarHBondContact O-N 2.84Å; C701-F714 HydrophobicContact CB-CE2 3.91Å; H712-F714 HydrophobicContact CB-CE2 4.5Å; H712-F714 AromaticContact CD2-CE1 3.78Å; H712-F714 AromaticContact CD2-CE2 3.82Å; H712-F714 AromaticContact CD2-CZ 3.65Å
715	K	93.1	Very high	93.1	Very high	113 Å²	113	60.8 Å²	60.8	49%	0.491	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	117.9	178.2	-167.4	-178.6	-173.8	-175.5	0	110.6	P629 V630 V631 G697 L717	P629-K715 WeakPolarHBondContact O-CB 3.32Å; P629-K715 PolarHBondContact O-N 3.04Å; V630-K715 WeakPolarHBondContact CA-O 3.17Å; V630-K715 HydrophobicContact CG1-CB 4.41Å; V631-K715 PolarHBondContact N-O 3.05Å; G697-K715 CarbonylContact O-C 3.3Å; G697-K715 WeakPolarHBondContact O-CA 3.4Å; K715-L717 HydrophobicContact CD-CD2 3.91Å; K715-L717 HydrophobicContact CD-CG 4.44Å; K715-L717 HydrophobicContact CG-CD2 4.05Å; K715-L717 HydrophobicContact CG-CG 4.33Å
716	L	94.1	Very high	92.9	Very high	1 Å²	1	64.1 Å²	64.1	1%	0.005	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	126.8	170.7	-173.6	62.6	0	0	0	109.5	V631 A639 I688 V691 M696 G697 Y699	V631-L716 HydrophobicContact CB-CD1 4.29Å; V631-L716 HydrophobicContact CG1-CD1 4.07Å; V631-L716 WeakPolarHBondContact O-CA 3.42Å; A639-L716 HydrophobicContact CB-CD1 3.68Å; A639-L716 HydrophobicContact CB-CD2 4.07Å; I688-L716 HydrophobicContact CD1-CD2 3.93Å; V691-L716 HydrophobicContact CG1-CD2 4.14Å; M696-L716 HydrophobicContact SD-CD2 4.42Å; M696-L716 HydrophobicContact SD-CG 3.97Å; G697-L716 PolarHBondContact N-O 3.14Å; G697-L716 PolarHBondContact O-N 3.15Å; Y699-L716 HydrophobicContact CD2-CB 4.34Å; Y699-L716 HydrophobicContact CE2-CB 4.03Å; Y699-L716 HydrophobicContact CE2-CD2 4.44Å
717	L	93.3	Very high	92.8	Very high	55 Å²	55	63.7 Å²	63.7	29%	0.288	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	165.8	-179.8	-64.1	178.2	0	0	0	110.6	V630 V631 A632 S633 K715	V630-L717 HydrophobicContact CB-CD1 4.28Å; V630-L717 HydrophobicContact CG1-CD1 3.77Å; V631-L717 PolarHBondContact O-N 2.9Å; A632-L717 VanDerWaalsContact CA-O 3.3Å; A632-L717 WeakPolarHBondContact CA-O 3.14Å; S633-L717 PolarHBondContact N-O 3.22Å; K715-L717 HydrophobicContact CD-CD2 3.91Å; K715-L717 HydrophobicContact CD-CG 4.44Å; K715-L717 HydrophobicContact CG-CD2 4.05Å; K715-L717 HydrophobicContact CG-CG 4.33Å
718	R	93.8	Very high	92.9	Very high	148 Å²	148	61.9 Å²	61.9	56%	0.558	31%	0.31	S	S	*	.			trans	-80.5	149.6	165.2	-166.9	174.8	-177.4	-128.6	-17.2	110.1	S633 D634 M696	S633-R718 WeakPolarHBondContact O-CA 3.2Å; D634-R718 IonicContact OD1-CZ 2.63Å; D634-R718 IonicContact OD1-NE 2.72Å; D634-R718 PolarHBondContact OD1-NE 3.03Å; D634-R718 IonicContact OD1-NH2 3.6Å; D634-R718 PolarHBondContact OD1-NH2 2.81Å; M696-R718 HydrophobicContact CE-CB 4.49Å
719	K	93.6	Very high	93	Very high	39 Å²	39	64.4 Å²	64.4	17%	0.17	31%	0.313	C	S	.	.			trans	-58.5	147.5	176.8	-60.5	-175.6	-179.6	165.5	0	112.8	A632 D634 E637 G748 H750 L813	A632-K719 HydrophobicContact CB-CG 4.12Å; D634-K719 WeakPolarHBondContact OD2-CB 3.43Å; E637-K719 IonicContact OE1-NZ 2.69Å; E637-K719 PolarHBondContact OE1-NZ 3.31Å; E637-K719 WeakPolarHBondContact OE2-CE 3.42Å; E637-K719 IonicContact OE2-NZ 3.77Å; E637-K719 PolarHBondContact OE2-NZ 3.19Å; K719-G748 CarbonylContact C-O 3.55Å; K719-G748 VanDerWaalsContact CA-O 3.23Å; K719-G748 WeakPolarHBondContact CA-O 3.33Å; K719-G748 WeakPolarHBondContact CB-O 3.38Å; K719-H750 VanDerWaalsContact CD-CE1 3.46Å; K719-H750 WeakPolarHBondContact CD-CE1 3.06Å; K719-L813 HydrophobicContact CB-CD1 4.15Å
720	S	93.2	Very high	92.9	Very high	49 Å²	49	61.8 Å²	61.8	34%	0.343	30%	0.304	S	S	.	.			trans	-147.9	176.7	-172.9	67	0	0	0	0	111.8	G748 N811	S720-G748 PolarHBondContact N-O 3.24Å; S720-G748 WeakPolarHBondContact OG-CA 3.33Å; S720-N811 PolarHBondContact O-ND2 3.2Å
721	K	93.2	Very high	92.6	Very high	102 Å²	102	63.1 Å²	63.1	44%	0.443	31%	0.309	S	S	.	.	S	Bend	trans	-64.3	164.2	158.4	74	177.7	-160	163.1	0	110.7	E815	K721-E815 WeakPolarHBondContact CD-O 3.37Å; K721-E815 WeakPolarHBondContact CE-O 3.28Å; K721-E815 PolarHBondContact NZ-O 2.91Å
722	P	92.9	Very high	92.1	Very high	4 Å²	4	63.7 Å²	63.7	3%	0.026	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-70.5	164.5	-178.4	-15.9	32.2	0	0	0	112.8	F746 Q752 A809 N811 T816	P722-F746 CarbonylContact C-O 3.58Å; P722-F746 VanDerWaalsContact CA-O 3.29Å; P722-F746 WeakPolarHBondContact CA-O 3.37Å; P722-F746 WeakPolarHBondContact CB-O 3.47Å; P722-Q752 HydrophobicContact CB-CB 4.35Å; P722-Q752 HydrophobicContact CG-CB 3.95Å; P722-A809 HydrophobicContact CB-CB 4.17Å; P722-A809 HydrophobicContact CG-CB 4.45Å; P722-N811 VanDerWaalsContact CD-CG 3.49Å; P722-N811 HydrophobicContact CG-CB 3.8Å; P722-T816 HydrophobicContact CB-CG2 4.21Å; P722-T816 WeakPolarHBondContact O-CG2 3.36Å
723	D	91.8	Very high	91.7	Very high	89 Å²	89	66.1 Å²	66.1	48%	0.476	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-78.6	152.4	161.9	-77.7	-32.5	0	0	0	111.2	F746 T816	D723-F746 HydrophobicContact CB-CB 4.47Å; D723-F746 PolarHBondContact N-O 3.48Å; D723-T816 WeakPolarHBondContact O-CG2 3.34Å
724	P	91.5	Very high	91.4	Very high	64 Å²	64	62.4 Å²	62.4	42%	0.416	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-57.3	146.3	175.8	-23.7	34.2	0	0	0	113.5	T816	P724-T816 HydrophobicContact CG-CG2 4.48Å
725	P	92.7	Very high	90.9	Very high	9 Å²	9	63.9 Å²	63.9	6%	0.058	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-57	149	167.1	-20.2	30.9	0	0	0	112.2	W742 F754 V807 A809 T819	P725-W742 HydrophobicContact CB-CB 4.5Å; P725-W742 HydrophobicContact CB-CG 4.31Å; P725-F754 HydrophobicContact CG-CD1 4.09Å; P725-F754 HydrophobicContact CG-CE1 4.07Å; P725-V807 HydrophobicContact CG-CG1 4.13Å; P725-A809 HydrophobicContact CG-CB 4.21Å; P725-T819 HydrophobicContact CB-CG2 3.96Å; P725-T819 HydrophobicContact CG-CG2 4.36Å
726	K	90.6	Very high	90.6	Very high	93 Å²	93	61.6 Å²	61.6	40%	0.404	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	165.2	175	-58.7	-178.2	-173	175.4	0	110.6	E627 L728 W742 V743	E627-K726 IonicContact OE2-NZ 2.7Å; E627-K726 PolarHBondContact OE2-NZ 3.15Å; K726-L728 VanDerWaalsContact C-N 3.34Å; K726-L728 PolarHBondContact O-N 3.24Å; K726-W742 WeakPolarHBondContact O-CB 3.48Å; K726-V743 HydrophobicContact CB-CB 4.32Å; K726-V743 PolarHBondContact N-O 2.83Å; K726-V743 PolarHBondContact O-N 2.94Å
727	E	89.5	Confident	90.5	Very high	122 Å²	122	62.6 Å²	62.6	57%	0.57	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	53.3	42.3	166.3	-63.8	177.4	-142.1	0	0	115.1	K729 V743	E727-K729 PolarHBondContact O-N 3.31Å; E727-V743 HydrophobicContact CB-CB 4.45Å; E727-V743 HydrophobicContact CB-CG2 4.13Å
728	L	93.9	Very high	90.4	Very high	26 Å²	26	60 Å²	60	14%	0.136	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	116	171.2	179	62.1	0	0	0	110.1	K726 L740 S741 W742 V807 T819 L822	K726-L728 VanDerWaalsContact C-N 3.34Å; K726-L728 PolarHBondContact O-N 3.24Å; L728-L740 HydrophobicContact CD1-CB 4.44Å; L728-S741 WeakPolarHBondContact CA-O 3.38Å; L728-W742 HydrophobicContact CB-CB 4.41Å; L728-W742 HydrophobicContact CD1-CB 4.26Å; L728-W742 HydrophobicContact CD1-CE3 3.78Å; L728-V807 HydrophobicContact CD1-CG2 3.73Å; L728-V807 HydrophobicContact CD2-CG2 4Å; L728-V807 HydrophobicContact CG-CG2 4.49Å; L728-T819 WeakPolarHBondContact CD2-OG1 3.45Å; L728-L822 HydrophobicContact CD2-CB 4.01Å; L728-L822 HydrophobicContact CG-CB 4.12Å; L728-L822 HydrophobicContact CG-CD2 4Å
729	K	93.5	Very high	90.3	Very high	83 Å²	83	54.5 Å²	54.5	36%	0.361	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	167.2	-178.4	65.5	-162.8	177.5	90.9	0	112.1	E727 E731 L740 S741 L822	E727-K729 PolarHBondContact O-N 3.31Å; K729-E731 WeakPolarHBondContact CE-OE1 3.22Å; K729-E731 IonicContact NZ-OE1 3.13Å; K729-E731 PolarHBondContact NZ-OE1 2.99Å; K729-E731 IonicContact NZ-OE2 2.67Å; K729-E731 PolarHBondContact NZ-OE2 2.85Å; K729-L740 CarbonylContact O-C 3.37Å; K729-L740 WeakPolarHBondContact O-CA 3.41Å; K729-S741 WeakPolarHBondContact CE-OG 3.31Å; K729-S741 WeakPolarHBondContact CG-OG 3.25Å; K729-S741 PolarHBondContact N-O 3.49Å; K729-S741 PolarHBondContact O-N 3.3Å; K729-L822 VanDerWaalsContact C-CD2 3.46Å
730	V	92.4	Very high	90.3	Very high	40 Å²	40	52.7 Å²	52.7	24%	0.242	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	134.2	165.2	178	0	0	0	0	108	T732 I738 L739 L740 L822 A824	V730-T732 VanDerWaalsContact CG1-O 3.31Å; V730-T732 WeakPolarHBondContact CG1-O 3.1Å; V730-I738 HydrophobicContact CB-CG2 4.41Å; V730-I738 HydrophobicContact CG1-CG2 3.86Å; V730-I738 HydrophobicContact CG2-CG2 3.69Å; V730-L739 WeakPolarHBondContact CA-O 3.39Å; V730-L740 HydrophobicContact CG2-CD2 4.27Å; V730-L822 HydrophobicContact CG2-CD2 3.98Å; V730-A824 HydrophobicContact CG2-CB 3.68Å
731	E	88	Confident	90.3	Very high	73 Å²	73	50.3 Å²	50.3	34%	0.341	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-49.7	170.3	-56	-67.9	-162	0	0	110.9	K729 L739 S741	K729-E731 WeakPolarHBondContact CE-OE1 3.22Å; K729-E731 IonicContact NZ-OE1 3.13Å; K729-E731 PolarHBondContact NZ-OE1 2.99Å; K729-E731 IonicContact NZ-OE2 2.67Å; K729-E731 PolarHBondContact NZ-OE2 2.85Å; E731-L739 HydrophobicContact CB-CD2 4.01Å; E731-L739 HydrophobicContact CB-CG 4.13Å; E731-L739 HydrophobicContact CG-CG 4.47Å; E731-L739 PolarHBondContact N-O 3.27Å; E731-S741 VanDerWaalsContact OE1-CB 3.32Å; E731-S741 WeakPolarHBondContact OE1-CB 3.32Å; E731-S741 PolarHBondContact OE1-OG 3.25Å
732	T	83.3	Confident	90.2	Very high	81 Å²	81	45.5 Å²	45.5	50%	0.497	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	158.9	178.3	61.7	0	0	0	0	110.9	V730 L739	V730-T732 VanDerWaalsContact CG1-O 3.31Å; V730-T732 WeakPolarHBondContact CG1-O 3.1Å; T732-L739 PolarHBondContact O-N 3.02Å; T732-L739 WeakPolarHBondContact OG1-CB 3.3Å
733	Q	84.4	Confident	90.1	Very high	82 Å²	82	46.4 Å²	46.4	38%	0.383	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	160.6	177.8	50.4	177.8	70.6	0	0	109.6	S737 I738 A825 E827	Q733-S737 CarbonylContact C-O 3.57Å; Q733-I738 HydrophobicContact CB-CG1 4.15Å; Q733-A825 PolarHBondContact NE2-O 3.14Å; Q733-A825 VanDerWaalsContact NE2-O 3.16Å; Q733-A825 PolarHBondContact OE1-O 2.98Å; Q733-E827 HydrophobicContact CG-CG 4.09Å
734	S	87	Confident	89.9	Confident	29 Å²	29	42.4 Å²	42.4	20%	0.203	22%	0.218	C	C	.	.			trans	-145.7	178.6	174.2	79.7	0	0	0	0	110	K736 S737 T826 E827	S734-K736 PolarHBondContact O-N 2.68Å; S734-K736 PolarHBondContact OG-N 3.45Å; S734-K736 VanDerWaalsContact OG-N 3.11Å; S734-S737 PolarHBondContact N-O 2.81Å; S734-S737 PolarHBondContact OG-N 2.95Å; S734-S737 PolarHBondContact OG-OG 2.86Å; S734-T826 WeakPolarHBondContact O-CA 3.25Å; S734-T826 VanDerWaalsContact O-CB 3.3Å; S734-T826 WeakPolarHBondContact O-CB 3.3Å; S734-T826 WeakPolarHBondContact O-CG2 3.46Å; S734-E827 WeakPolarHBondContact CA-OE2 3.24Å; S734-E827 PolarHBondContact O-N 3.28Å; S734-E827 VanDerWaalsContact O-N 3.08Å
735	H	84.1	Confident	89.7	Confident	39 Å²	39	39.6 Å²	39.6	18%	0.181	20%	0.2	C	C	.	.	S	Bend	trans	-67.9	-6.3	172.7	72.8	-83.9	0	0	0	114.6	P799 E827 D828 A829	H735-P799 HydrophobicContact CB-CB 4.2Å; H735-P799 HydrophobicContact CB-CG 4.35Å; H735-P799 VanDerWaalsContact O-CA 3.31Å; H735-P799 WeakPolarHBondContact O-CA 3.25Å; H735-P799 WeakPolarHBondContact O-CG 3.38Å; H735-E827 WeakPolarHBondContact CA-O 3.49Å; H735-D828 WeakPolarHBondContact CB-O 3.48Å; H735-A829 HydrophobicContact CB-CB 4.39Å
736	K	86.5	Confident	89.6	Confident	66 Å²	66	40.6 Å²	40.6	29%	0.287	20%	0.204	S	C	.	.	S	Bend	trans	-133.2	-4.9	-178.5	-83.7	171.7	179.3	177.1	0	114.8	S734 G796 L797 Q903 T904	S734-K736 PolarHBondContact O-N 2.68Å; S734-K736 PolarHBondContact OG-N 3.45Å; S734-K736 VanDerWaalsContact OG-N 3.11Å; K736-G796 PolarHBondContact O-N 3.15Å; K736-L797 PolarHBondContact O-N 3.1Å; K736-Q903 PolarHBondContact NZ-O 2.99Å; K736-T904 WeakPolarHBondContact CE-O 3.13Å; K736-T904 PolarHBondContact NZ-O 3Å
737	S	90.4	Very high	89.5	Confident	22 Å²	22	38.1 Å²	38.1	15%	0.154	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	157.1	-171.8	72.1	0	0	0	0	114.3	Q733 S734 N793 V794	Q733-S737 CarbonylContact C-O 3.57Å; S734-S737 PolarHBondContact N-O 2.81Å; S734-S737 PolarHBondContact OG-N 2.95Å; S734-S737 PolarHBondContact OG-OG 2.86Å; S737-N793 VanDerWaalsContact CB-OD1 3.32Å; S737-N793 WeakPolarHBondContact CB-OD1 3.26Å; S737-V794 CarbonylContact C-O 3.59Å; S737-V794 WeakPolarHBondContact CA-O 3.43Å; S737-V794 WeakPolarHBondContact CB-O 3.42Å
738	I	92.1	Very high	89.4	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	122.1	172.5	-65.7	180	0	0	0	108.5	V730 Q733 L740 V794 L797 F805 A824 T826	V730-I738 HydrophobicContact CB-CG2 4.41Å; V730-I738 HydrophobicContact CG1-CG2 3.86Å; V730-I738 HydrophobicContact CG2-CG2 3.69Å; Q733-I738 HydrophobicContact CB-CG1 4.15Å; I738-L740 HydrophobicContact CG2-CD2 4.07Å; I738-V794 PolarHBondContact N-O 3.11Å; I738-V794 PolarHBondContact O-N 3.24Å; I738-L797 HydrophobicContact CB-CD1 4.1Å; I738-L797 HydrophobicContact CD1-CD1 4.07Å; I738-L797 HydrophobicContact CG1-CD1 3.82Å; I738-F805 HydrophobicContact CB-CZ 4.13Å; I738-F805 HydrophobicContact CD1-CE2 4.01Å; I738-F805 HydrophobicContact CD1-CZ 3.93Å; I738-F805 HydrophobicContact CG2-CE2 4.32Å; I738-F805 HydrophobicContact CG2-CZ 4.23Å; I738-A824 HydrophobicContact CD1-CB 3.96Å; I738-T826 HydrophobicContact CD1-CG2 4.23Å; I738-T826 HydrophobicContact CG1-CG2 4.23Å
739	L	92.2	Very high	89.1	Confident	33 Å²	33	32.2 Å²	32.2	17%	0.173	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	108.2	175.9	-179.9	59.9	0	0	0	109.5	V730 E731 T732 E791 N793	V730-L739 WeakPolarHBondContact CA-O 3.39Å; E731-L739 HydrophobicContact CB-CD2 4.01Å; E731-L739 HydrophobicContact CB-CG 4.13Å; E731-L739 HydrophobicContact CG-CG 4.47Å; E731-L739 PolarHBondContact N-O 3.27Å; T732-L739 PolarHBondContact O-N 3.02Å; T732-L739 WeakPolarHBondContact OG1-CB 3.3Å; L739-E791 HydrophobicContact CD1-CB 4.23Å; L739-N793 HydrophobicContact CD1-CB 3.97Å
740	L	93	Very high	88.8	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	149.1	172.6	-56.4	176.1	0	0	0	110.1	L728 K729 V730 I738 W742 V756 E791 F792 V794 F805 L822	L728-L740 HydrophobicContact CD1-CB 4.44Å; K729-L740 CarbonylContact O-C 3.37Å; K729-L740 WeakPolarHBondContact O-CA 3.41Å; V730-L740 HydrophobicContact CG2-CD2 4.27Å; I738-L740 HydrophobicContact CG2-CD2 4.07Å; L740-W742 HydrophobicContact CB-CE3 4.36Å; L740-W742 HydrophobicContact CB-CZ3 4.04Å; L740-V756 HydrophobicContact CD1-CG1 3.81Å; L740-E791 CarbonylContact O-C 3.58Å; L740-E791 WeakPolarHBondContact O-CA 3.37Å; L740-F792 PolarHBondContact N-O 3.17Å; L740-F792 PolarHBondContact O-N 2.98Å; L740-V794 HydrophobicContact CD1-CG2 3.85Å; L740-V794 HydrophobicContact CG-CG2 4.29Å; L740-F805 HydrophobicContact CD1-CB 3.99Å; L740-F805 HydrophobicContact CD1-CD1 3.69Å; L740-F805 HydrophobicContact CD1-CE1 4.37Å; L740-F805 HydrophobicContact CD1-CG 3.98Å; L740-F805 HydrophobicContact CD2-CB 4.23Å; L740-F805 HydrophobicContact CD2-CD1 4.23Å; L740-F805 HydrophobicContact CD2-CD2 4.11Å; L740-F805 HydrophobicContact CD2-CG 3.94Å; L740-F805 HydrophobicContact CG-CD1 4.4Å; L740-L822 HydrophobicContact CD2-CD2 4.15Å
741	S	93.1	Very high	88.5	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	154.7	159.7	78.8	0	0	0	0	111.5	L728 K729 E731 V790	L728-S741 WeakPolarHBondContact CA-O 3.38Å; K729-S741 WeakPolarHBondContact CE-OG 3.31Å; K729-S741 WeakPolarHBondContact CG-OG 3.25Å; K729-S741 PolarHBondContact N-O 3.49Å; K729-S741 PolarHBondContact O-N 3.3Å; E731-S741 VanDerWaalsContact OE1-CB 3.32Å; E731-S741 WeakPolarHBondContact OE1-CB 3.32Å; E731-S741 PolarHBondContact OE1-OG 3.25Å; S741-V790 VanDerWaalsContact CA-O 3.29Å; S741-V790 WeakPolarHBondContact CA-O 3.45Å
742	W	92.1	Very high	88.5	Confident	1 Å²	1	33.3 Å²	33.3	0%	0.004	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	148.1	171.8	57.6	87.1	0	0	0	111.1	P725 K726 L728 L740 F754 V756 A770 P789 V790 F792 V807	P725-W742 HydrophobicContact CB-CB 4.5Å; P725-W742 HydrophobicContact CB-CG 4.31Å; K726-W742 WeakPolarHBondContact O-CB 3.48Å; L728-W742 HydrophobicContact CB-CB 4.41Å; L728-W742 HydrophobicContact CD1-CB 4.26Å; L728-W742 HydrophobicContact CD1-CE3 3.78Å; L740-W742 HydrophobicContact CB-CE3 4.36Å; L740-W742 HydrophobicContact CB-CZ3 4.04Å; W742-F754 HydrophobicContact CZ2-CB 3.66Å; W742-F754 HydrophobicContact CZ2-CD1 4.48Å; W742-F754 AromaticContact CZ2-CG 3.97Å; W742-F754 HydrophobicContact CZ2-CG 3.97Å; W742-F754 AromaticContact NE1-CD1 3.34Å; W742-F754 VanDerWaalsContact NE1-CD1 3.34Å; W742-F754 AromaticContact NE1-CE1 3.7Å; W742-F754 AromaticContact NE1-CG 3.55Å; W742-V756 HydrophobicContact CH2-CG2 3.55Å; W742-V756 HydrophobicContact CZ2-CG2 4.36Å; W742-V756 HydrophobicContact CZ3-CG2 4.01Å; W742-A770 HydrophobicContact CH2-CB 3.57Å; W742-A770 HydrophobicContact CZ2-CB 3.75Å; W742-P789 CarbonylContact O-C 3.57Å; W742-P789 VanDerWaalsContact O-CA 3.28Å; W742-P789 WeakPolarHBondContact O-CA 3.47Å; W742-V790 HydrophobicContact CD2-CB 4.43Å; W742-V790 HydrophobicContact CH2-CG1 4.33Å; W742-V790 HydrophobicContact CZ2-CB 4.03Å; W742-V790 HydrophobicContact CZ2-CG1 3.6Å; W742-V790 PolarHBondContact N-O 2.93Å; W742-V790 VanDerWaalsContact N-O 3.11Å; W742-V790 PolarHBondContact O-N 2.75Å; W742-F792 HydrophobicContact CH2-CB 3.55Å; W742-F792 HydrophobicContact CH2-CG 4.3Å; W742-F792 HydrophobicContact CZ3-CB 3.77Å; W742-V807 HydrophobicContact CD2-CG1 4.08Å; W742-V807 HydrophobicContact CD2-CG2 4.13Å; W742-V807 HydrophobicContact CE3-CG2 3.82Å; W742-V807 HydrophobicContact CH2-CG1 4.41Å; W742-V807 HydrophobicContact CH2-CG2 4.41Å; W742-V807 HydrophobicContact CZ2-CG1 3.99Å; W742-V807 HydrophobicContact CZ3-CG2 3.97Å
743	V	89.3	Confident	88.9	Confident	22 Å²	22	34.4 Å²	34.4	13%	0.133	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	121.8	172.4	172.7	0	0	0	0	108.5	K726 E727	K726-V743 HydrophobicContact CB-CB 4.32Å; K726-V743 PolarHBondContact N-O 2.83Å; K726-V743 PolarHBondContact O-N 2.94Å; E727-V743 HydrophobicContact CB-CB 4.45Å; E727-V743 HydrophobicContact CB-CG2 4.13Å
744	P	88.7	Confident	89.3	Confident	6 Å²	6	30.5 Å²	30.5	4%	0.039	15%	0.149	C	C	.	.			trans	-66.8	154.2	-178.5	28.3	-35.5	0	0	0	111.4	R628 F754 A787 L788 V790	R628-P744 VanDerWaalsContact CZ-O 3.24Å; R628-P744 PolarHBondContact NH1-O 2.88Å; R628-P744 PolarHBondContact NH2-O 3.34Å; P744-F754 HydrophobicContact CB-CE1 4.23Å; P744-F754 HydrophobicContact CB-CE2 4.3Å; P744-F754 HydrophobicContact CB-CZ 3.53Å; P744-A787 HydrophobicContact CG-CB 4.01Å; P744-L788 WeakPolarHBondContact CD-O 3.46Å; P744-V790 HydrophobicContact CB-CG2 4.23Å; P744-V790 HydrophobicContact CG-CG2 4.29Å
745	G	87.9	Confident	89.7	Confident	4 Å²	4	29.6 Å²	29.6	4%	0.041	14%	0.142	C	C	.	.			trans	-72.9	178.4	173.5	0	0	0	0	0	113	R628 Q752	R628-G745 VanDerWaalsContact NH1-C 3.32Å; R628-G745 PolarHBondContact NH1-O 2.8Å; G745-Q752 PolarHBondContact O-NE2 2.83Å
746	F	88.8	Confident	90.2	Very high	31 Å²	31	27.7 Å²	27.7	14%	0.136	13%	0.134	C	C	.	.			trans	-64.1	134.9	158.5	177.1	-120.5	0	0	0	108.6	V630 A632 P722 D723 G748	V630-F746 HydrophobicContact CB-CD2 4.46Å; V630-F746 HydrophobicContact CB-CE1 4.43Å; V630-F746 HydrophobicContact CB-CE2 4.23Å; V630-F746 HydrophobicContact CB-CZ 4.2Å; V630-F746 HydrophobicContact CG2-CB 4.32Å; V630-F746 HydrophobicContact CG2-CD1 4.11Å; V630-F746 HydrophobicContact CG2-CD2 3.52Å; V630-F746 HydrophobicContact CG2-CE1 4.29Å; V630-F746 HydrophobicContact CG2-CE2 3.74Å; V630-F746 HydrophobicContact CG2-CG 3.72Å; V630-F746 HydrophobicContact CG2-CZ 4.12Å; A632-F746 HydrophobicContact CB-CE1 4.1Å; A632-F746 HydrophobicContact CB-CZ 3.7Å; P722-F746 CarbonylContact C-O 3.58Å; P722-F746 VanDerWaalsContact CA-O 3.29Å; P722-F746 WeakPolarHBondContact CA-O 3.37Å; P722-F746 WeakPolarHBondContact CB-O 3.47Å; D723-F746 HydrophobicContact CB-CB 4.47Å; D723-F746 PolarHBondContact N-O 3.48Å; F746-G748 VanDerWaalsContact C-N 3.26Å; F746-G748 PolarHBondContact O-N 2.86Å
747	D	88.9	Confident	90.7	Very high	41 Å²	41	25.4 Å²	25.4	22%	0.219	12%	0.124	C	C	.	.			trans	-78.4	-9.9	-170.7	79.3	-24.8	0	0	0	113.6	G749 H750 Q752 N811	D747-G749 PolarHBondContact OD1-N 2.7Å; D747-H750 WeakPolarHBondContact CB-O 3.38Å; D747-H750 VanDerWaalsContact OD2-C 3.25Å; D747-H750 PolarHBondContact OD2-N 2.88Å; D747-Q752 HydrophobicContact CB-CB 4.18Å; D747-Q752 HydrophobicContact CB-CG 3.9Å; D747-N811 PolarHBondContact O-ND2 2.63Å
748	G	88.7	Confident	90.9	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.119	C	C	.	.			trans	79.1	13.3	-176.4	0	0	0	0	0	114.3	K719 S720 F746	K719-G748 CarbonylContact C-O 3.55Å; K719-G748 VanDerWaalsContact CA-O 3.23Å; K719-G748 WeakPolarHBondContact CA-O 3.33Å; K719-G748 WeakPolarHBondContact CB-O 3.38Å; S720-G748 PolarHBondContact N-O 3.24Å; S720-G748 WeakPolarHBondContact OG-CA 3.33Å; F746-G748 VanDerWaalsContact C-N 3.26Å; F746-G748 PolarHBondContact O-N 2.86Å
749	G	87	Confident	90.9	Very high	23 Å²	23	26.1 Å²	26.1	24%	0.237	13%	0.127	C	C	.	.	S	Bend	trans	83.4	14.6	-174.7	0	0	0	0	0	114.4	D747	D747-G749 PolarHBondContact OD1-N 2.7Å
750	H	87.6	Confident	90.6	Very high	38 Å²	38	27 Å²	27	18%	0.176	13%	0.13	C	C	.	.	S	Bend	trans	-145.2	133.3	175.3	-68	-45.7	0	0	0	110.9	K719 D747 Q752 N811 Q812	K719-H750 VanDerWaalsContact CD-CE1 3.46Å; K719-H750 WeakPolarHBondContact CD-CE1 3.06Å; D747-H750 WeakPolarHBondContact CB-O 3.38Å; D747-H750 VanDerWaalsContact OD2-C 3.25Å; D747-H750 PolarHBondContact OD2-N 2.88Å; H750-Q752 PolarHBondContact O-N 2.9Å; H750-Q752 VanDerWaalsContact O-N 3.08Å; H750-N811 HydrophobicContact CB-CB 4.16Å; H750-Q812 HydrophobicContact CB-CG 4.38Å; H750-Q812 PolarHBondContact CD2-NE2 2.84Å; H750-Q812 PolarHBondContact CE1-NE2 2.02Å; H750-Q812 PolarHBondContact ND1-NE2 3.3Å; H750-Q812 PolarHBondContact NE2-NE2 2.84Å
751	R	86.1	Confident	90.1	Very high	164 Å²	164	31.3 Å²	31.3	62%	0.619	15%	0.153	S	C	*	.			trans	-42	113.5	177.8	-179.9	172.3	171.6	143.4	-0.9	112.3	D772	R751-D772 IonicContact CZ-OD2 3.36Å; R751-D772 IonicContact NE-OD2 2.66Å; R751-D772 PolarHBondContact NE-OD2 2.79Å; R751-D772 IonicContact NH2-OD2 3.28Å; R751-D772 PolarHBondContact NH2-OD2 2.83Å
752	Q	86.6	Confident	89.4	Confident	18 Å²	18	39.3 Å²	39.3	8%	0.084	20%	0.196	C	C	.	.			trans	-89.5	149.7	-179.9	62.7	-176.8	-31.6	0	0	112.5	P722 G745 D747 H750 F754 S810	P722-Q752 HydrophobicContact CB-CB 4.35Å; P722-Q752 HydrophobicContact CG-CB 3.95Å; G745-Q752 PolarHBondContact O-NE2 2.83Å; D747-Q752 HydrophobicContact CB-CB 4.18Å; D747-Q752 HydrophobicContact CB-CG 3.9Å; H750-Q752 PolarHBondContact O-N 2.9Å; H750-Q752 VanDerWaalsContact O-N 3.08Å; Q752-F754 HydrophobicContact CG-CE2 4.12Å; Q752-F754 HydrophobicContact CG-CZ 3.8Å; Q752-S810 CarbonylContact C-O 3.58Å; Q752-S810 VanDerWaalsContact CA-O 3.27Å; Q752-S810 WeakPolarHBondContact CA-O 3.45Å
753	K	91.5	Very high	89.1	Confident	104 Å²	104	45.9 Å²	45.9	45%	0.452	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	156.9	176.6	-49.2	-153.8	167.5	-171	0	110.4	D772 A809 S810	K753-D772 WeakPolarHBondContact CD-OD1 3.3Å; K753-D772 VanDerWaalsContact CG-OD1 3.23Å; K753-D772 WeakPolarHBondContact CG-OD1 3.35Å; K753-A809 CarbonylContact O-C 3.58Å; K753-A809 VanDerWaalsContact O-CA 3.26Å; K753-A809 WeakPolarHBondContact O-CA 3.29Å; K753-S810 PolarHBondContact N-O 3.46Å; K753-S810 PolarHBondContact O-N 2.89Å
754	F	94.5	Very high	89	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	132.8	-178.7	-59.3	-79.9	0	0	0	112.4	P725 W742 P744 Q752 A770 A773 V790 V807 K808 A809	P725-F754 HydrophobicContact CG-CD1 4.09Å; P725-F754 HydrophobicContact CG-CE1 4.07Å; W742-F754 HydrophobicContact CZ2-CB 3.66Å; W742-F754 HydrophobicContact CZ2-CD1 4.48Å; W742-F754 AromaticContact CZ2-CG 3.97Å; W742-F754 HydrophobicContact CZ2-CG 3.97Å; W742-F754 AromaticContact NE1-CD1 3.34Å; W742-F754 VanDerWaalsContact NE1-CD1 3.34Å; W742-F754 AromaticContact NE1-CE1 3.7Å; W742-F754 AromaticContact NE1-CG 3.55Å; P744-F754 HydrophobicContact CB-CE1 4.23Å; P744-F754 HydrophobicContact CB-CE2 4.3Å; P744-F754 HydrophobicContact CB-CZ 3.53Å; Q752-F754 HydrophobicContact CG-CE2 4.12Å; Q752-F754 HydrophobicContact CG-CZ 3.8Å; F754-A770 HydrophobicContact CB-CB 4.13Å; F754-A770 PolarHBondContact O-N 2.85Å; F754-A773 HydrophobicContact CE2-CB 4.15Å; F754-V790 HydrophobicContact CD2-CG1 4.32Å; F754-V790 HydrophobicContact CD2-CG2 4.24Å; F754-V790 HydrophobicContact CE2-CG2 3.87Å; F754-V790 HydrophobicContact CZ-CG2 4.4Å; F754-V807 HydrophobicContact CB-CG1 4.27Å; F754-V807 HydrophobicContact CD1-CG1 4.31Å; F754-K808 WeakPolarHBondContact CA-O 3.49Å; F754-A809 HydrophobicContact CD1-CB 3.9Å; F754-A809 HydrophobicContact CE1-CB 3.66Å
755	T	94.8	Very high	89	Confident	9 Å²	9	54.3 Å²	54.3	6%	0.055	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	128.9	173.6	-59.6	0	0	0	0	109.2	T767 F768 Q769 V807 K808 W818	T755-T767 HydrophobicContact CG2-CG2 3.4Å; T755-F768 WeakPolarHBondContact CA-O 3.48Å; T755-Q769 PolarHBondContact OG1-NE2 2.84Å; T755-V807 CarbonylContact O-C 3.54Å; T755-V807 VanDerWaalsContact O-CA 3.3Å; T755-V807 WeakPolarHBondContact O-CA 3.4Å; T755-K808 PolarHBondContact N-O 2.89Å; T755-K808 PolarHBondContact O-N 3.11Å; T755-W818 HydrophobicContact CG2-CH2 3.88Å; T755-W818 HydrophobicContact CG2-CZ3 4.35Å; T755-W818 WeakPolarHBondContact O-CZ3 3.45Å
756	V	95.1	Very high	89.1	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	131.8	178.1	-172.2	0	0	0	0	109.1	L740 W742 T767 F768 A770 F792 R806 V807	L740-V756 HydrophobicContact CD1-CG1 3.81Å; W742-V756 HydrophobicContact CH2-CG2 3.55Å; W742-V756 HydrophobicContact CZ2-CG2 4.36Å; W742-V756 HydrophobicContact CZ3-CG2 4.01Å; V756-T767 CarbonylContact O-C 3.5Å; V756-T767 WeakPolarHBondContact O-CA 3.35Å; V756-T767 WeakPolarHBondContact O-CG2 3.38Å; V756-F768 HydrophobicContact CB-CB 4.42Å; V756-F768 PolarHBondContact N-O 2.96Å; V756-F768 PolarHBondContact O-N 2.76Å; V756-A770 HydrophobicContact CG2-CB 3.89Å; V756-F792 HydrophobicContact CB-CD1 4.37Å; V756-F792 HydrophobicContact CB-CE1 4.41Å; V756-F792 HydrophobicContact CG2-CD1 3.87Å; V756-F792 HydrophobicContact CG2-CE1 4.27Å; V756-F792 HydrophobicContact CG2-CG 4.48Å; V756-R806 WeakPolarHBondContact CA-O 3.11Å; V756-V807 HydrophobicContact CG1-CG2 4.31Å; V756-V807 HydrophobicContact CG2-CG1 4.49Å; V756-V807 HydrophobicContact CG2-CG2 4.1Å
757	E	95.3	Very high	89.3	Confident	18 Å²	18	61.2 Å²	61.2	8%	0.084	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	139.5	173.5	-165.3	-169.1	85.7	0	0	110.5	M764 F805 R806 W818	E757-M764 HydrophobicContact CG-CG 3.86Å; E757-M764 HydrophobicContact CG-SD 4.08Å; E757-F805 WeakPolarHBondContact O-CA 3.33Å; E757-R806 HydrophobicContact CB-CG 3.99Å; E757-R806 VanDerWaalsContact CD-NE 3.34Å; E757-R806 PolarHBondContact N-O 2.88Å; E757-R806 PolarHBondContact O-N 2.94Å; E757-R806 IonicContact OE1-CZ 2.84Å; E757-R806 IonicContact OE1-NE 3.31Å; E757-R806 PolarHBondContact OE1-NE 3.25Å; E757-R806 IonicContact OE1-NH2 2.74Å; E757-R806 PolarHBondContact OE1-NH2 3.2Å; E757-R806 IonicContact OE2-CZ 3.96Å; E757-R806 IonicContact OE2-NE 3.03Å; E757-R806 PolarHBondContact OE2-NE 3.39Å; E757-R806 IonicContact OE2-NH2 2.72Å; E757-R806 PolarHBondContact OE2-NH2 2.66Å; E757-W818 HydrophobicContact CB-CH2 3.78Å; E757-W818 HydrophobicContact CB-CZ3 3.86Å
758	L	94.8	Very high	89.4	Confident	8 Å²	8	60.9 Å²	60.9	4%	0.042	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	124.5	177.9	170.8	68.1	0	0	0	109.9	L765 K766 F768 V794 L797 Y803 F805	L758-L765 HydrophobicContact CD2-CB 4.25Å; L758-L765 HydrophobicContact CD2-CD1 4.31Å; L758-L765 HydrophobicContact CG-CB 4.25Å; L758-L765 HydrophobicContact CG-CD1 4.36Å; L758-L765 PolarHBondContact O-N 2.89Å; L758-K766 HydrophobicContact CD2-CB 4.45Å; L758-K766 PolarHBondContact N-O 3.35Å; L758-K766 PolarHBondContact O-N 3.44Å; L758-F768 HydrophobicContact CB-CE2 3.88Å; L758-F768 HydrophobicContact CD2-CE2 4.03Å; L758-F768 HydrophobicContact CD2-CZ 4.28Å; L758-V794 HydrophobicContact CD2-CG1 4.3Å; L758-L797 HydrophobicContact CD1-CD2 4.36Å; L758-L797 HydrophobicContact CD2-CD2 3.9Å; L758-Y803 HydrophobicContact CD1-CD1 3.71Å; L758-Y803 HydrophobicContact CD1-CG 3.99Å; L758-Y803 HydrophobicContact CG-CD1 4.48Å; L758-F805 HydrophobicContact CD1-CD1 3.97Å; L758-F805 HydrophobicContact CD1-CE1 3.5Å; L758-F805 HydrophobicContact CD1-CZ 3.96Å
759	T	92.5	Very high	89.6	Confident	29 Å²	29	66.5 Å²	66.5	18%	0.178	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	155.1	174.9	70.1	0	0	0	0	112.3	H763 M764 S804	T759-H763 CarbonylContact C-O 3.35Å; T759-H763 WeakPolarHBondContact CA-O 3.12Å; T759-H763 WeakPolarHBondContact CB-O 3.23Å; T759-M764 HydrophobicContact CG2-CB 4.4Å; T759-S804 PolarHBondContact N-O 3.14Å; T759-S804 PolarHBondContact O-N 3.5Å; T759-S804 WeakPolarHBondContact OG1-CB 3.47Å
760	H	86.6	Confident	89.5	Confident	51 Å²	51	65.8 Å²	65.8	24%	0.236	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	133.8	175.4	173.5	66.5	0	0	0	108.5	D762 H763 L765 L802 Y803	H760-D762 VanDerWaalsContact C-N 3.27Å; H760-D762 PolarHBondContact O-N 2.74Å; H760-H763 PolarHBondContact N-O 3.04Å; H760-H763 PolarHBondContact O-N 3.21Å; H760-L765 HydrophobicContact CB-CD1 3.62Å; H760-L765 HydrophobicContact CB-CD2 4.33Å; H760-L765 HydrophobicContact CB-CG 3.97Å; H760-L802 PolarHBondContact ND1-O 2.95Å; H760-Y803 HydrophobicContact CB-CD1 3.97Å; H760-Y803 HydrophobicContact CB-CE1 4.13Å
761	D	81.9	Confident	89.1	Confident	91 Å²	91	67.4 Å²	67.4	49%	0.487	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	38.4	55.4	-173.8	-73.5	5.8	0	0	0	112.7	H763 K869	D761-H763 PolarHBondContact O-N 2.53Å; D761-H763 PolarHBondContact O-ND1 3.05Å; D761-K869 IonicContact OD1-NZ 2.84Å; D761-K869 IonicContact OD2-NZ 2.7Å; D761-K869 PolarHBondContact OD2-NZ 2.67Å
762	D	78.8	Confident	88.3	Confident	167 Å²	167	61.2 Å²	61.2	89%	0.893	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	1.3	-176	-67.6	-37.8	0	0	0	117.7	H760	H760-D762 VanDerWaalsContact C-N 3.27Å; H760-D762 PolarHBondContact O-N 2.74Å
763	H	85.6	Confident	87.1	Confident	139 Å²	139	61.8 Å²	61.8	64%	0.644	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.2	134	176.1	-66	73.7	0	0	0	111.5	T759 H760 D761 L765	T759-H763 CarbonylContact C-O 3.35Å; T759-H763 WeakPolarHBondContact CA-O 3.12Å; T759-H763 WeakPolarHBondContact CB-O 3.23Å; H760-H763 PolarHBondContact N-O 3.04Å; H760-H763 PolarHBondContact O-N 3.21Å; D761-H763 PolarHBondContact O-N 2.53Å; D761-H763 PolarHBondContact O-ND1 3.05Å; H763-L765 PolarHBondContact O-N 2.8Å
764	M	88.1	Confident	85.4	Confident	113 Å²	113	63.1 Å²	63.1	56%	0.557	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74	114	172.4	-173.7	-165.4	74.3	0	0	110	E757 T759	E757-M764 HydrophobicContact CG-CG 3.86Å; E757-M764 HydrophobicContact CG-SD 4.08Å; T759-M764 HydrophobicContact CG2-CB 4.4Å
765	L	87.2	Confident	83.2	Confident	92 Å²	92	69.7 Å²	69.7	48%	0.482	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	-45.5	178.1	-61	-174.5	0	0	0	111.7	L758 H760 H763 Y803	L758-L765 HydrophobicContact CD2-CB 4.25Å; L758-L765 HydrophobicContact CD2-CD1 4.31Å; L758-L765 HydrophobicContact CG-CB 4.25Å; L758-L765 HydrophobicContact CG-CD1 4.36Å; L758-L765 PolarHBondContact O-N 2.89Å; H760-L765 HydrophobicContact CB-CD1 3.62Å; H760-L765 HydrophobicContact CB-CD2 4.33Å; H760-L765 HydrophobicContact CB-CG 3.97Å; H763-L765 PolarHBondContact O-N 2.8Å; L765-Y803 HydrophobicContact CD1-CD1 4.14Å; L765-Y803 HydrophobicContact CD1-CE1 3.71Å
766	K	90	Very high	80.6	Confident	116 Å²	116	71.8 Å²	71.8	50%	0.504	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	154.6	-170.8	-164	158.6	172.9	-178.2	0	112.4	L758 F768	L758-K766 HydrophobicContact CD2-CB 4.45Å; L758-K766 PolarHBondContact N-O 3.35Å; L758-K766 PolarHBondContact O-N 3.44Å; K766-F768 HydrophobicContact CB-CE2 3.84Å; K766-F768 HydrophobicContact CB-CZ 4.05Å; K766-F768 HydrophobicContact CD-CE1 3.77Å; K766-F768 HydrophobicContact CD-CE2 4.15Å; K766-F768 HydrophobicContact CD-CZ 3.55Å; K766-F768 HydrophobicContact CG-CD2 4.31Å; K766-F768 HydrophobicContact CG-CE1 4.17Å; K766-F768 HydrophobicContact CG-CE2 3.85Å; K766-F768 HydrophobicContact CG-CZ 3.78Å
767	T	93.1	Very high	77.7	Confident	64 Å²	64	78 Å²	78	39%	0.393	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	139.5	167.6	-41.8	0	0	0	0	108.6	T755 V756	T755-T767 HydrophobicContact CG2-CG2 3.4Å; V756-T767 CarbonylContact O-C 3.5Å; V756-T767 WeakPolarHBondContact O-CA 3.35Å; V756-T767 WeakPolarHBondContact O-CG2 3.38Å
768	F	92	Very high	74.7	Confident	34 Å²	34	83.1 Å²	83.1	15%	0.149	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	148.9	-178.4	-55.2	-100.1	0	0	0	110	T755 V756 L758 K766 F792 V794	T755-F768 WeakPolarHBondContact CA-O 3.48Å; V756-F768 HydrophobicContact CB-CB 4.42Å; V756-F768 PolarHBondContact N-O 2.96Å; V756-F768 PolarHBondContact O-N 2.76Å; L758-F768 HydrophobicContact CB-CE2 3.88Å; L758-F768 HydrophobicContact CD2-CE2 4.03Å; L758-F768 HydrophobicContact CD2-CZ 4.28Å; K766-F768 HydrophobicContact CB-CE2 3.84Å; K766-F768 HydrophobicContact CB-CZ 4.05Å; K766-F768 HydrophobicContact CD-CE1 3.77Å; K766-F768 HydrophobicContact CD-CE2 4.15Å; K766-F768 HydrophobicContact CD-CZ 3.55Å; K766-F768 HydrophobicContact CG-CD2 4.31Å; K766-F768 HydrophobicContact CG-CE1 4.17Å; K766-F768 HydrophobicContact CG-CE2 3.85Å; K766-F768 HydrophobicContact CG-CZ 3.78Å; F768-F792 HydrophobicContact CB-CE1 3.65Å; F768-F792 HydrophobicContact CB-CZ 3.6Å; F768-F792 HydrophobicContact CD1-CE1 4.21Å; F768-F792 HydrophobicContact CD1-CZ 4Å; F768-F792 HydrophobicContact CD2-CE1 4.42Å; F768-F792 AromaticContact CG-CE1 3.88Å; F768-F792 HydrophobicContact CG-CE1 3.88Å; F768-F792 AromaticContact CG-CZ 3.99Å; F768-F792 HydrophobicContact CG-CZ 3.99Å; F768-V794 HydrophobicContact CE1-CG1 4.49Å; F768-V794 HydrophobicContact CE2-CG1 3.89Å; F768-V794 HydrophobicContact CZ-CG1 3.74Å
769	Q	91.7	Very high	72.2	Confident	119 Å²	119	91.2 Å²	91.2	56%	0.556	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.7	120.9	160.3	-63.7	-60.5	-75	0	0	107.1	T755	T755-Q769 PolarHBondContact OG1-NE2 2.84Å
770	A	86.2	Confident	69.6	Low	7 Å²	7	93.6 Å²	93.6	6%	0.058	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	163.2	172.3	0	0	0	0	0	110	W742 F754 V756 F792	W742-A770 HydrophobicContact CH2-CB 3.57Å; W742-A770 HydrophobicContact CZ2-CB 3.75Å; F754-A770 HydrophobicContact CB-CB 4.13Å; F754-A770 PolarHBondContact O-N 2.85Å; V756-A770 HydrophobicContact CG2-CB 3.89Å; A770-F792 HydrophobicContact CB-CB 4.11Å; A770-F792 HydrophobicContact CB-CD1 4.36Å; A770-F792 HydrophobicContact CB-CD2 3.68Å; A770-F792 HydrophobicContact CB-CE2 4.18Å; A770-F792 HydrophobicContact CB-CG 3.78Å
771	P	78.1	Confident	67.9	Low	73 Å²	73	95.4 Å²	95.4	47%	0.474	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-52.1	143.1	174.7	-27	35	0	0	0	112.4
772	D	70.9	Confident	66.7	Low	34 Å²	34	91.8 Å²	91.8	18%	0.182	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-60	143.9	160.2	-58.4	-13.8	0	0	0	107.8	R751 K753 E774	R751-D772 IonicContact CZ-OD2 3.36Å; R751-D772 IonicContact NE-OD2 2.66Å; R751-D772 PolarHBondContact NE-OD2 2.79Å; R751-D772 IonicContact NH2-OD2 3.28Å; R751-D772 PolarHBondContact NH2-OD2 2.83Å; K753-D772 WeakPolarHBondContact CD-OD1 3.3Å; K753-D772 VanDerWaalsContact CG-OD1 3.23Å; K753-D772 WeakPolarHBondContact CG-OD1 3.35Å; D772-E774 PolarHBondContact O-N 2.88Å
773	A	60.7	Low	65.9	Low	30 Å²	30	85.1 Å²	85.1	25%	0.248	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-59.6	125.8	177.3	0	0	0	0	0	110.3	F754 I775 V790	F754-A773 HydrophobicContact CE2-CB 4.15Å; A773-I775 PolarHBondContact O-N 2.85Å; A773-V790 HydrophobicContact CB-CG2 3.72Å
774	E	55.6	Low	65.2	Low	131 Å²	131	82.6 Å²	82.6	61%	0.612	42%	0.422	S	S	*	.			trans	-67	100.8	-178.4	-78.5	-167.7	156.7	0	0	111.5	D772 G776 K777	D772-E774 PolarHBondContact O-N 2.88Å; E774-G776 PolarHBondContact O-N 2.9Å; E774-K777 IonicContact OE1-NZ 2.7Å; E774-K777 PolarHBondContact OE1-NZ 3.13Å; E774-K777 WeakPolarHBondContact OE2-CD 3.37Å; E774-K777 WeakPolarHBondContact OE2-CE 3.49Å; E774-K777 WeakPolarHBondContact OE2-CG 3.4Å; E774-K777 IonicContact OE2-NZ 3.01Å; E774-K777 PolarHBondContact OE2-NZ 2.96Å
775	I	47.3	Very low	64.3	Low	139 Å²	139	78.9 Å²	78.9	71%	0.713	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	91.4	170.1	-51.2	174.6	0	0	0	108.1	A773	A773-I775 PolarHBondContact O-N 2.85Å
776	G	42.1	Very low	63.4	Low	52 Å²	52	81.4 Å²	81.4	54%	0.536	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	161.9	-37.3	172.1	0	0	0	0	0	116.3	E774 W778	E774-G776 PolarHBondContact O-N 2.9Å; G776-W778 PolarHBondContact O-N 3.17Å
777	K	33	Very low	62.3	Low	131 Å²	131	76.9 Å²	76.9	57%	0.57	40%	0.395	S	S	*	.			trans	-77.8	51.4	-176.1	-68.6	-161.4	-174.5	112	0	113.9	E774 R779 L788	E774-K777 IonicContact OE1-NZ 2.7Å; E774-K777 PolarHBondContact OE1-NZ 3.13Å; E774-K777 WeakPolarHBondContact OE2-CD 3.37Å; E774-K777 WeakPolarHBondContact OE2-CE 3.49Å; E774-K777 WeakPolarHBondContact OE2-CG 3.4Å; E774-K777 IonicContact OE2-NZ 3.01Å; E774-K777 PolarHBondContact OE2-NZ 2.96Å; K777-R779 PolarHBondContact O-N 2.75Å; K777-L788 VanDerWaalsContact O-CD1 3.31Å; K777-L788 WeakPolarHBondContact O-CD1 3.29Å
778	W	33.1	Very low	61.3	Low	125 Å²	125	78.3 Å²	78.3	47%	0.473	40%	0.4	S	S	.	.			trans	-61.3	107.7	165.2	-59.9	103.8	0	0	0	109	G776 P780 E785	G776-W778 PolarHBondContact O-N 3.17Å; W778-P780 VanDerWaalsContact O-CD 3.23Å; W778-P780 WeakPolarHBondContact O-CD 3.45Å; W778-E785 HydrophobicContact CE3-CB 4.24Å; W778-E785 HydrophobicContact CE3-CG 4.14Å; W778-E785 HydrophobicContact CZ3-CB 3.82Å; W778-E785 HydrophobicContact CZ3-CG 4.19Å
779	R	40.7	Very low	60.9	Low	179 Å²	179	79.1 Å²	79.1	68%	0.675	41%	0.408	S	S	*	.			trans	-74.8	112.7	161.7	-69.6	-161	-167.1	-166.3	13.7	107.1	E550 K777 K781	E550-R779 IonicContact OE1-NH1 2.79Å; K777-R779 PolarHBondContact O-N 2.75Å; R779-K781 HydrophobicContact CB-CG 4.44Å; R779-K781 PolarHBondContact O-N 2.59Å
780	P	39.5	Very low	60.6	Low	78 Å²	78	74 Å²	74	51%	0.506	39%	0.385	S	S	.	.			trans	-81	59.7	178.3	4.1	15.8	0	0	0	109.7	W778 F782	W778-P780 VanDerWaalsContact O-CD 3.23Å; W778-P780 WeakPolarHBondContact O-CD 3.45Å; P780-F782 PolarHBondContact O-N 2.91Å
781	K	50.8	Low	60.8	Low	89 Å²	89	79 Å²	79	39%	0.387	41%	0.407	S	S	.	.			trans	-74	64.6	175	-83.1	-165.2	171.9	-173.7	0	110.8	E550 R779 G783	E550-K781 IonicContact OE1-NZ 3.15Å; E550-K781 PolarHBondContact OE1-NZ 2.78Å; R779-K781 HydrophobicContact CB-CG 4.44Å; R779-K781 PolarHBondContact O-N 2.59Å; K781-G783 WeakPolarHBondContact O-CA 3.29Å; K781-G783 PolarHBondContact O-N 3.42Å
782	F	55.5	Low	61.4	Low	15 Å²	15	77.1 Å²	77.1	7%	0.066	39%	0.392	C	S	.	.	S	Bend	trans	40.6	38	163	-52.8	-79.7	0	0	0	115.8	D548 W590 N591 K593 F613 F679 P780	D548-F782 WeakPolarHBondContact OD1-CE2 3.49Å; D548-F782 WeakPolarHBondContact OD2-CD2 3.21Å; D548-F782 WeakPolarHBondContact OD2-CE2 3.5Å; W590-F782 WeakPolarHBondContact CZ3-O 3.01Å; N591-F782 WeakPolarHBondContact CA-O 3.33Å; N591-F782 WeakPolarHBondContact CB-O 3.38Å; K593-F782 HydrophobicContact CD-CD1 3.9Å; K593-F782 HydrophobicContact CG-CB 4Å; K593-F782 HydrophobicContact CG-CD1 3.48Å; K593-F782 VanDerWaalsContact CG-CD1 3.48Å; K593-F782 HydrophobicContact CG-CE1 4.1Å; K593-F782 HydrophobicContact CG-CG 3.95Å; K593-F782 WeakPolarHBondContact O-CB 3.34Å; K593-F782 VanDerWaalsContact O-CD2 3.26Å; K593-F782 WeakPolarHBondContact O-CD2 3.33Å; K593-F782 WeakPolarHBondContact O-CG 3.46Å; F613-F782 HydrophobicContact CE2-CE1 4.09Å; F613-F782 AromaticContact CE2-CZ 3.97Å; F613-F782 HydrophobicContact CE2-CZ 3.97Å; F613-F782 HydrophobicContact CZ-CE1 4.42Å; F679-F782 HydrophobicContact CB-CD1 4.06Å; F679-F782 HydrophobicContact CB-CE1 3.47Å; F679-F782 VanDerWaalsContact CB-CE1 3.47Å; F679-F782 HydrophobicContact CB-CZ 4.25Å; F679-F782 AromaticContact CD1-CE1 3.42Å; F679-F782 HydrophobicContact CD1-CE1 3.42Å; F679-F782 VanDerWaalsContact CD1-CE1 3.42Å; F679-F782 AromaticContact CD1-CZ 3.46Å; F679-F782 HydrophobicContact CD1-CZ 3.46Å; F679-F782 VanDerWaalsContact CD1-CZ 3.46Å; F679-F782 HydrophobicContact CD2-CE1 4.41Å; F679-F782 HydrophobicContact CD2-CZ 4.41Å; F679-F782 HydrophobicContact CE1-CE1 4.29Å; F679-F782 AromaticContact CE1-CZ 3.88Å; F679-F782 HydrophobicContact CE1-CZ 3.88Å; F679-F782 HydrophobicContact CG-CD1 4.44Å; F679-F782 AromaticContact CG-CE1 3.49Å; F679-F782 HydrophobicContact CG-CE1 3.49Å; F679-F782 VanDerWaalsContact CG-CE1 3.49Å; F679-F782 AromaticContact CG-CZ 3.77Å; F679-F782 HydrophobicContact CG-CZ 3.77Å; P780-F782 PolarHBondContact O-N 2.91Å
783	G	63.3	Low	62.4	Low	28 Å²	28	79 Å²	79	29%	0.289	40%	0.402	S	S	.	.	S	Bend	trans	-149.5	-178.5	-164.5	0	0	0	0	0	112.3	I623 K781	I623-G783 WeakPolarHBondContact CB-O 3.31Å; I623-G783 WeakPolarHBondContact CG2-O 3.44Å; K781-G783 WeakPolarHBondContact O-CA 3.29Å; K781-G783 PolarHBondContact O-N 3.42Å
784	I	70.6	Confident	63.8	Low	86 Å²	86	77.7 Å²	77.7	44%	0.441	39%	0.39	S	S	.	.			trans	-71.2	128.3	173.2	-59.9	173.5	0	0	0	108.4	P626 K786	P626-I784 HydrophobicContact CG-CG2 4.36Å; I784-K786 PolarHBondContact O-N 2.84Å
785	E	69.8	Low	65.5	Low	35 Å²	35	75.8 Å²	75.8	16%	0.164	39%	0.388	C	S	.	.			trans	-58.3	128.3	172	-65	-166.1	153.9	0	0	109.9	I623 D625 K644 W778	I623-E785 WeakPolarHBondContact O-CA 3.43Å; I623-E785 WeakPolarHBondContact O-CB 3.37Å; I623-E785 WeakPolarHBondContact O-CG 3.47Å; I623-E785 PolarHBondContact O-N 3.4Å; D625-E785 WeakPolarHBondContact CA-O 3.28Å; D625-E785 VanDerWaalsContact CB-O 3.25Å; D625-E785 WeakPolarHBondContact CB-O 3.49Å; D625-E785 PolarHBondContact N-O 3.47Å; K644-E785 VanDerWaalsContact CD-OE1 3.31Å; K644-E785 WeakPolarHBondContact CD-OE1 3.48Å; K644-E785 WeakPolarHBondContact CD-OE2 3.3Å; K644-E785 IonicContact NZ-OE1 3.02Å; K644-E785 PolarHBondContact NZ-OE1 3.32Å; K644-E785 IonicContact NZ-OE2 3.74Å; K644-E785 PolarHBondContact NZ-OE2 2.66Å; W778-E785 HydrophobicContact CE3-CB 4.24Å; W778-E785 HydrophobicContact CE3-CG 4.14Å; W778-E785 HydrophobicContact CZ3-CB 3.82Å; W778-E785 HydrophobicContact CZ3-CG 4.19Å
786	K	67	Low	67.2	Low	145 Å²	145	72.8 Å²	72.8	63%	0.63	39%	0.391	S	S	*	.			trans	-119.6	146.4	164	-64.3	-168.8	173.7	-159.4	0	107.2	I784 L788	I784-K786 PolarHBondContact O-N 2.84Å; K786-L788 PolarHBondContact O-N 3.09Å
787	A	67.7	Low	69.4	Low	21 Å²	21	70.8 Å²	70.8	17%	0.174	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-58.1	128.2	166.3	0	0	0	0	0	109.5	D625 P744	D625-A787 PolarHBondContact OD2-N 3.13Å; P744-A787 HydrophobicContact CG-CB 4.01Å
788	L	71.8	Confident	71.8	Confident	94 Å²	94	65.9 Å²	65.9	49%	0.492	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-60.4	143.4	176.1	-70.1	176.8	0	0	0	110.4	P744 K777 K786	P744-L788 WeakPolarHBondContact CD-O 3.46Å; K777-L788 VanDerWaalsContact O-CD1 3.31Å; K777-L788 WeakPolarHBondContact O-CD1 3.29Å; K786-L788 PolarHBondContact O-N 3.09Å
789	P	83	Confident	74.2	Confident	51 Å²	51	59.9 Å²	59.9	33%	0.331	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-55.5	139.9	165.4	-22.1	33.5	0	0	0	110.6	W742	W742-P789 CarbonylContact O-C 3.57Å; W742-P789 VanDerWaalsContact O-CA 3.28Å; W742-P789 WeakPolarHBondContact O-CA 3.47Å
790	V	86.2	Confident	76.2	Confident	10 Å²	10	52.6 Å²	52.6	6%	0.061	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	118.3	165.2	179.5	0	0	0	0	106.7	S741 W742 P744 F754 A773	S741-V790 VanDerWaalsContact CA-O 3.29Å; S741-V790 WeakPolarHBondContact CA-O 3.45Å; W742-V790 HydrophobicContact CD2-CB 4.43Å; W742-V790 HydrophobicContact CH2-CG1 4.33Å; W742-V790 HydrophobicContact CZ2-CB 4.03Å; W742-V790 HydrophobicContact CZ2-CG1 3.6Å; W742-V790 PolarHBondContact N-O 2.93Å; W742-V790 VanDerWaalsContact N-O 3.11Å; W742-V790 PolarHBondContact O-N 2.75Å; P744-V790 HydrophobicContact CB-CG2 4.23Å; P744-V790 HydrophobicContact CG-CG2 4.29Å; F754-V790 HydrophobicContact CD2-CG1 4.32Å; F754-V790 HydrophobicContact CD2-CG2 4.24Å; F754-V790 HydrophobicContact CE2-CG2 3.87Å; F754-V790 HydrophobicContact CZ-CG2 4.4Å; A773-V790 HydrophobicContact CB-CG2 3.72Å
791	E	89.6	Confident	78.3	Confident	114 Å²	114	49.3 Å²	49.3	53%	0.533	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	141.2	177.1	-72.2	176.2	-165.4	0	0	111	L739 L740	L739-E791 HydrophobicContact CD1-CB 4.23Å; L740-E791 CarbonylContact O-C 3.58Å; L740-E791 WeakPolarHBondContact O-CA 3.37Å
792	F	91.1	Very high	80.1	Confident	33 Å²	33	48.8 Å²	48.8	15%	0.145	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	114.6	177.1	-172.8	-111.6	0	0	0	112.1	L740 W742 V756 F768 A770 V794	L740-F792 PolarHBondContact N-O 3.17Å; L740-F792 PolarHBondContact O-N 2.98Å; W742-F792 HydrophobicContact CH2-CB 3.55Å; W742-F792 HydrophobicContact CH2-CG 4.3Å; W742-F792 HydrophobicContact CZ3-CB 3.77Å; V756-F792 HydrophobicContact CB-CD1 4.37Å; V756-F792 HydrophobicContact CB-CE1 4.41Å; V756-F792 HydrophobicContact CG2-CD1 3.87Å; V756-F792 HydrophobicContact CG2-CE1 4.27Å; V756-F792 HydrophobicContact CG2-CG 4.48Å; F768-F792 HydrophobicContact CB-CE1 3.65Å; F768-F792 HydrophobicContact CB-CZ 3.6Å; F768-F792 HydrophobicContact CD1-CE1 4.21Å; F768-F792 HydrophobicContact CD1-CZ 4Å; F768-F792 HydrophobicContact CD2-CE1 4.42Å; F768-F792 AromaticContact CG-CE1 3.88Å; F768-F792 HydrophobicContact CG-CE1 3.88Å; F768-F792 AromaticContact CG-CZ 3.99Å; F768-F792 HydrophobicContact CG-CZ 3.99Å; A770-F792 HydrophobicContact CB-CB 4.11Å; A770-F792 HydrophobicContact CB-CD1 4.36Å; A770-F792 HydrophobicContact CB-CD2 3.68Å; A770-F792 HydrophobicContact CB-CE2 4.18Å; A770-F792 HydrophobicContact CB-CG 3.78Å; F792-V794 HydrophobicContact CD1-CG2 3.85Å; F792-V794 HydrophobicContact CE1-CG2 3.9Å
793	N	91.7	Very high	81.7	Confident	74 Å²	74	48.9 Å²	48.9	40%	0.396	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	111.5	179.1	-165.7	0.5	0	0	0	111.1	S737 L739 T795	S737-N793 VanDerWaalsContact CB-OD1 3.32Å; S737-N793 WeakPolarHBondContact CB-OD1 3.26Å; L739-N793 HydrophobicContact CD1-CB 3.97Å; N793-T795 HydrophobicContact CB-CG2 4.4Å; N793-T795 PolarHBondContact O-N 2.96Å
794	V	91.2	Very high	83.2	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.006	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	106.3	174.3	-171.6	0	0	0	0	108.5	S737 I738 L740 L758 F768 F792 L797 F805	S737-V794 CarbonylContact C-O 3.59Å; S737-V794 WeakPolarHBondContact CA-O 3.43Å; S737-V794 WeakPolarHBondContact CB-O 3.42Å; I738-V794 PolarHBondContact N-O 3.11Å; I738-V794 PolarHBondContact O-N 3.24Å; L740-V794 HydrophobicContact CD1-CG2 3.85Å; L740-V794 HydrophobicContact CG-CG2 4.29Å; L758-V794 HydrophobicContact CD2-CG1 4.3Å; F768-V794 HydrophobicContact CE1-CG1 4.49Å; F768-V794 HydrophobicContact CE2-CG1 3.89Å; F768-V794 HydrophobicContact CZ-CG1 3.74Å; F792-V794 HydrophobicContact CD1-CG2 3.85Å; F792-V794 HydrophobicContact CE1-CG2 3.9Å; V794-L797 HydrophobicContact CG1-CD1 4.46Å; V794-L797 HydrophobicContact CG1-CD2 4.11Å; V794-L797 HydrophobicContact CG1-CG 4.47Å; V794-F805 HydrophobicContact CB-CE1 4.03Å; V794-F805 HydrophobicContact CG1-CE1 4.1Å; V794-F805 HydrophobicContact CG2-CD1 4.21Å; V794-F805 HydrophobicContact CG2-CE1 3.87Å
795	T	90.4	Very high	84.3	Confident	92 Å²	92	44.8 Å²	44.8	56%	0.564	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.2	163.7	-175.1	61.1	0	0	0	0	112.9	N793	N793-T795 HydrophobicContact CB-CG2 4.4Å; N793-T795 PolarHBondContact O-N 2.96Å
796	G	83	Confident	85.5	Confident	75 Å²	75	46.8 Å²	46.8	77%	0.773	27%	0.265	S	S	*	.	S	Bend	trans	81.4	23.7	-179	0	0	0	0	0	113.5	K736	K736-G796 PolarHBondContact O-N 3.15Å
797	L	88	Confident	86.9	Confident	11 Å²	11	39.9 Å²	39.9	6%	0.058	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-80	156.5	174.6	-57.7	179.8	0	0	0	110.3	K736 I738 L758 V794 Y803 F805 T826	K736-L797 PolarHBondContact O-N 3.1Å; I738-L797 HydrophobicContact CB-CD1 4.1Å; I738-L797 HydrophobicContact CD1-CD1 4.07Å; I738-L797 HydrophobicContact CG1-CD1 3.82Å; L758-L797 HydrophobicContact CD1-CD2 4.36Å; L758-L797 HydrophobicContact CD2-CD2 3.9Å; V794-L797 HydrophobicContact CG1-CD1 4.46Å; V794-L797 HydrophobicContact CG1-CD2 4.11Å; V794-L797 HydrophobicContact CG1-CG 4.47Å; L797-Y803 HydrophobicContact CB-CD2 4.43Å; L797-Y803 HydrophobicContact CB-CE2 3.72Å; L797-Y803 HydrophobicContact CD1-CD2 4.07Å; L797-Y803 HydrophobicContact CD1-CE2 4.2Å; L797-Y803 HydrophobicContact CD2-CD1 4.36Å; L797-Y803 HydrophobicContact CD2-CD2 4.18Å; L797-Y803 HydrophobicContact CD2-CE1 4.12Å; L797-Y803 HydrophobicContact CD2-CE2 3.93Å; L797-Y803 HydrophobicContact CD2-CG 4.38Å; L797-Y803 HydrophobicContact CG-CD2 4.46Å; L797-Y803 HydrophobicContact CG-CE2 4.15Å; L797-F805 HydrophobicContact CD1-CZ 4.38Å; L797-T826 HydrophobicContact CB-CG2 3.63Å; L797-T826 HydrophobicContact CD1-CG2 3.91Å; L797-T826 HydrophobicContact CG-CG2 4.43Å
798	A	83.1	Confident	88.2	Confident	27 Å²	27	40.2 Å²	40.2	22%	0.223	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-81.6	148.6	173.8	0	0	0	0	0	110.8	T801 Y803 T826	A798-T801 WeakPolarHBondContact CB-OG1 3.01Å; A798-T801 WeakPolarHBondContact O-CB 3.48Å; A798-T801 PolarHBondContact O-OG1 3.44Å; A798-Y803 PolarHBondContact N-OH 2.98Å; A798-T826 WeakPolarHBondContact O-CB 3.25Å; A798-T826 WeakPolarHBondContact O-CG2 3.37Å; A798-T826 PolarHBondContact O-OG1 2.7Å
799	P	84.2	Confident	89.3	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	154	173.3	-21	31.2	0	0	0	113	H735 T801 E827 A829 L905	H735-P799 HydrophobicContact CB-CB 4.2Å; H735-P799 HydrophobicContact CB-CG 4.35Å; H735-P799 VanDerWaalsContact O-CA 3.31Å; H735-P799 WeakPolarHBondContact O-CA 3.25Å; H735-P799 WeakPolarHBondContact O-CG 3.38Å; P799-T801 PolarHBondContact O-N 3.13Å; P799-T801 VanDerWaalsContact O-N 3.12Å; P799-T801 PolarHBondContact O-OG1 3.08Å; P799-E827 WeakPolarHBondContact CA-O 3.48Å; P799-A829 HydrophobicContact CB-CB 3.97Å; P799-A829 HydrophobicContact CG-CB 3.85Å; P799-L905 HydrophobicContact CG-CD1 3.97Å
800	S	82	Confident	89.8	Confident	26 Å²	26	34.3 Å²	34.3	18%	0.182	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.8	42.4	176.6	-63.7	0	0	0	0	113.9	T826 E827 D828	S800-T826 PolarHBondContact N-OG1 2.72Å; S800-E827 PolarHBondContact N-O 2.64Å; S800-D828 VanDerWaalsContact OG-CA 3.3Å; S800-D828 WeakPolarHBondContact OG-CA 3.14Å; S800-D828 WeakPolarHBondContact OG-CB 3.13Å; S800-D828 PolarHBondContact OG-OD1 2.7Å
801	T	83.9	Confident	90.1	Very high	9 Å²	9	34.8 Å²	34.8	6%	0.055	20%	0.203	C	C	.	.			trans	-127.8	135.5	-173	-57.4	0	0	0	0	110.8	A798 P799 Y803 A825 T826	A798-T801 WeakPolarHBondContact CB-OG1 3.01Å; A798-T801 WeakPolarHBondContact O-CB 3.48Å; A798-T801 PolarHBondContact O-OG1 3.44Å; P799-T801 PolarHBondContact O-N 3.13Å; P799-T801 VanDerWaalsContact O-N 3.12Å; P799-T801 PolarHBondContact O-OG1 3.08Å; T801-Y803 HydrophobicContact CG2-CD2 4.4Å; T801-Y803 HydrophobicContact CG2-CE1 4.11Å; T801-Y803 HydrophobicContact CG2-CE2 3.66Å; T801-Y803 WeakPolarHBondContact O-CD2 3.28Å; T801-A825 WeakPolarHBondContact O-CA 3.42Å; T801-T826 PolarHBondContact N-OG1 2.93Å; T801-T826 PolarHBondContact O-N 2.91Å; T801-T826 VanDerWaalsContact O-N 3.1Å; T801-T826 PolarHBondContact O-OG1 3.12Å
802	L	88.5	Confident	90.2	Very high	77 Å²	77	36.7 Å²	36.7	40%	0.403	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	127	-176.2	-167.8	71.2	0	0	0	111.7	H760 T823 A825	H760-L802 PolarHBondContact ND1-O 2.95Å; L802-T823 HydrophobicContact CD1-CG2 3.75Å; L802-T823 HydrophobicContact CD2-CG2 4.16Å; L802-T823 HydrophobicContact CG-CG2 3.86Å; L802-A825 HydrophobicContact CD1-CB 3.95Å
803	Y	90.8	Very high	90.3	Very high	18 Å²	18	39.4 Å²	39.4	7%	0.071	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	153.7	-179.2	-65.2	-74.4	0	0	0	111.6	L758 H760 L765 L797 A798 T801 T823 A824 T826	L758-Y803 HydrophobicContact CD1-CD1 3.71Å; L758-Y803 HydrophobicContact CD1-CG 3.99Å; L758-Y803 HydrophobicContact CG-CD1 4.48Å; H760-Y803 HydrophobicContact CB-CD1 3.97Å; H760-Y803 HydrophobicContact CB-CE1 4.13Å; L765-Y803 HydrophobicContact CD1-CD1 4.14Å; L765-Y803 HydrophobicContact CD1-CE1 3.71Å; L797-Y803 HydrophobicContact CB-CD2 4.43Å; L797-Y803 HydrophobicContact CB-CE2 3.72Å; L797-Y803 HydrophobicContact CD1-CD2 4.07Å; L797-Y803 HydrophobicContact CD1-CE2 4.2Å; L797-Y803 HydrophobicContact CD2-CD1 4.36Å; L797-Y803 HydrophobicContact CD2-CD2 4.18Å; L797-Y803 HydrophobicContact CD2-CE1 4.12Å; L797-Y803 HydrophobicContact CD2-CE2 3.93Å; L797-Y803 HydrophobicContact CD2-CG 4.38Å; L797-Y803 HydrophobicContact CG-CD2 4.46Å; L797-Y803 HydrophobicContact CG-CE2 4.15Å; A798-Y803 PolarHBondContact N-OH 2.98Å; T801-Y803 HydrophobicContact CG2-CD2 4.4Å; T801-Y803 HydrophobicContact CG2-CE1 4.11Å; T801-Y803 HydrophobicContact CG2-CE2 3.66Å; T801-Y803 WeakPolarHBondContact O-CD2 3.28Å; Y803-T823 WeakPolarHBondContact O-CA 3.38Å; Y803-T823 WeakPolarHBondContact O-CG2 3.37Å; Y803-A824 PolarHBondContact N-O 2.81Å; Y803-A824 PolarHBondContact O-N 2.92Å; Y803-A824 VanDerWaalsContact O-O 3.06Å; Y803-T826 HydrophobicContact CD2-CG2 4.42Å; Y803-T826 HydrophobicContact CE2-CG2 4.16Å
804	S	93.3	Very high	90.4	Very high	26 Å²	26	37.1 Å²	37.1	18%	0.182	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	146.2	170.2	-65.1	0	0	0	0	112.3	T759 L822 T823	T759-S804 PolarHBondContact N-O 3.14Å; T759-S804 PolarHBondContact O-N 3.5Å; T759-S804 WeakPolarHBondContact OG1-CB 3.47Å; S804-L822 CarbonylContact C-O 3.5Å; S804-L822 VanDerWaalsContact CA-O 3.3Å; S804-L822 WeakPolarHBondContact CA-O 3.36Å; S804-T823 WeakPolarHBondContact OG-CB 3.44Å; S804-T823 WeakPolarHBondContact OG-CG2 3.33Å; S804-T823 PolarHBondContact OG-OG1 3.04Å
805	F	94.5	Very high	90.5	Very high	1 Å²	1	41.6 Å²	41.6	0%	0.004	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	139.4	-167.7	-54.7	-90.1	0	0	0	110.8	I738 L740 E757 L758 V794 L797 S821 L822 A824	I738-F805 HydrophobicContact CB-CZ 4.13Å; I738-F805 HydrophobicContact CD1-CE2 4.01Å; I738-F805 HydrophobicContact CD1-CZ 3.93Å; I738-F805 HydrophobicContact CG2-CE2 4.32Å; I738-F805 HydrophobicContact CG2-CZ 4.23Å; L740-F805 HydrophobicContact CD1-CB 3.99Å; L740-F805 HydrophobicContact CD1-CD1 3.69Å; L740-F805 HydrophobicContact CD1-CE1 4.37Å; L740-F805 HydrophobicContact CD1-CG 3.98Å; L740-F805 HydrophobicContact CD2-CB 4.23Å; L740-F805 HydrophobicContact CD2-CD1 4.23Å; L740-F805 HydrophobicContact CD2-CD2 4.11Å; L740-F805 HydrophobicContact CD2-CG 3.94Å; L740-F805 HydrophobicContact CG-CD1 4.4Å; E757-F805 WeakPolarHBondContact O-CA 3.33Å; L758-F805 HydrophobicContact CD1-CD1 3.97Å; L758-F805 HydrophobicContact CD1-CE1 3.5Å; L758-F805 HydrophobicContact CD1-CZ 3.96Å; V794-F805 HydrophobicContact CB-CE1 4.03Å; V794-F805 HydrophobicContact CG1-CE1 4.1Å; V794-F805 HydrophobicContact CG2-CD1 4.21Å; V794-F805 HydrophobicContact CG2-CE1 3.87Å; L797-F805 HydrophobicContact CD1-CZ 4.38Å; F805-S821 CarbonylContact O-C 3.6Å; F805-S821 WeakPolarHBondContact O-CA 3.05Å; F805-L822 PolarHBondContact N-O 3.2Å; F805-L822 PolarHBondContact O-N 3.21Å; F805-A824 HydrophobicContact CE2-CB 4.3Å
806	R	95.3	Very high	90.7	Very high	77 Å²	77	37.9 Å²	37.9	29%	0.291	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	152.5	169.8	59.4	179.4	-177.3	170.6	3.5	111.6	V756 E757 W818	V756-R806 WeakPolarHBondContact CA-O 3.11Å; E757-R806 HydrophobicContact CB-CG 3.99Å; E757-R806 VanDerWaalsContact CD-NE 3.34Å; E757-R806 PolarHBondContact N-O 2.88Å; E757-R806 PolarHBondContact O-N 2.94Å; E757-R806 IonicContact OE1-CZ 2.84Å; E757-R806 IonicContact OE1-NE 3.31Å; E757-R806 PolarHBondContact OE1-NE 3.25Å; E757-R806 IonicContact OE1-NH2 2.74Å; E757-R806 PolarHBondContact OE1-NH2 3.2Å; E757-R806 IonicContact OE2-CZ 3.96Å; E757-R806 IonicContact OE2-NE 3.03Å; E757-R806 PolarHBondContact OE2-NE 3.39Å; E757-R806 IonicContact OE2-NH2 2.72Å; E757-R806 PolarHBondContact OE2-NH2 2.66Å; R806-W818 HydrophobicContact CB-CE3 4.27Å; R806-W818 HydrophobicContact CG-CD2 4.14Å; R806-W818 HydrophobicContact CG-CE3 3.74Å; R806-W818 HydrophobicContact CG-CZ3 4.24Å; R806-W818 WeakPolarHBondContact O-CZ3 3Å
807	V	95.6	Very high	91.3	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	146.2	-173.5	-172	0	0	0	0	111.1	P725 L728 W742 F754 T755 V756 W818 T819	P725-V807 HydrophobicContact CG-CG1 4.13Å; L728-V807 HydrophobicContact CD1-CG2 3.73Å; L728-V807 HydrophobicContact CD2-CG2 4Å; L728-V807 HydrophobicContact CG-CG2 4.49Å; W742-V807 HydrophobicContact CD2-CG1 4.08Å; W742-V807 HydrophobicContact CD2-CG2 4.13Å; W742-V807 HydrophobicContact CE3-CG2 3.82Å; W742-V807 HydrophobicContact CH2-CG1 4.41Å; W742-V807 HydrophobicContact CH2-CG2 4.41Å; W742-V807 HydrophobicContact CZ2-CG1 3.99Å; W742-V807 HydrophobicContact CZ3-CG2 3.97Å; F754-V807 HydrophobicContact CB-CG1 4.27Å; F754-V807 HydrophobicContact CD1-CG1 4.31Å; T755-V807 CarbonylContact O-C 3.54Å; T755-V807 VanDerWaalsContact O-CA 3.3Å; T755-V807 WeakPolarHBondContact O-CA 3.4Å; V756-V807 HydrophobicContact CG1-CG2 4.31Å; V756-V807 HydrophobicContact CG2-CG1 4.49Å; V756-V807 HydrophobicContact CG2-CG2 4.1Å; V807-W818 VanDerWaalsContact C-CE3 3.47Å; V807-W818 CarbonylContact O-C 3.52Å; V807-W818 WeakPolarHBondContact O-CA 3.23Å; V807-T819 HydrophobicContact CB-CG2 4.29Å; V807-T819 PolarHBondContact N-OG1 2.86Å; V807-T819 WeakPolarHBondContact O-CG2 3.2Å; V807-T819 PolarHBondContact O-N 2.79Å
808	K	95.1	Very high	91.6	Very high	29 Å²	29	40.9 Å²	40.9	13%	0.126	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	154.2	165	61.4	167.9	170.6	155.5	0	110.5	F754 T755 E815 W818	F754-K808 WeakPolarHBondContact CA-O 3.49Å; T755-K808 PolarHBondContact N-O 2.89Å; T755-K808 PolarHBondContact O-N 3.11Å; K808-E815 IonicContact NZ-OE1 3.27Å; K808-E815 PolarHBondContact NZ-OE1 2.83Å; K808-E815 IonicContact NZ-OE2 2.72Å; K808-E815 PolarHBondContact NZ-OE2 3.07Å; K808-W818 HydrophobicContact CB-CD2 4.12Å; K808-W818 HydrophobicContact CB-CE3 3.89Å; K808-W818 HydrophobicContact CB-CZ3 4.31Å; K808-W818 HydrophobicContact CD-CD2 4.33Å; K808-W818 HydrophobicContact CD-CE3 4.47Å; K808-W818 HydrophobicContact CD-CH2 4.19Å; K808-W818 HydrophobicContact CD-CZ2 4.02Å; K808-W818 HydrophobicContact CD-CZ3 4.41Å; K808-W818 HydrophobicContact CG-CD2 4.14Å; K808-W818 HydrophobicContact CG-CE3 3.84Å; K808-W818 HydrophobicContact CG-CH2 4.01Å; K808-W818 HydrophobicContact CG-CZ2 4.29Å; K808-W818 HydrophobicContact CG-CZ3 3.77Å
809	A	94.4	Very high	92.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	154	170.8	0	0	0	0	0	111.2	P722 P725 K753 F754 E815 T816	P722-A809 HydrophobicContact CB-CB 4.17Å; P722-A809 HydrophobicContact CG-CB 4.45Å; P725-A809 HydrophobicContact CG-CB 4.21Å; K753-A809 CarbonylContact O-C 3.58Å; K753-A809 VanDerWaalsContact O-CA 3.26Å; K753-A809 WeakPolarHBondContact O-CA 3.29Å; F754-A809 HydrophobicContact CD1-CB 3.9Å; F754-A809 HydrophobicContact CE1-CB 3.66Å; A809-E815 WeakPolarHBondContact O-CA 3.36Å; A809-T816 HydrophobicContact CB-CG2 3.82Å; A809-T816 PolarHBondContact N-OG1 2.94Å; A809-T816 PolarHBondContact O-N 3.06Å; A809-T816 PolarHBondContact O-OG1 3.48Å
810	S	94.2	Very high	92.5	Very high	21 Å²	21	49.4 Å²	49.4	15%	0.147	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	146.2	173.9	60.6	0	0	0	0	112.1	Q752 K753 G814	Q752-S810 CarbonylContact C-O 3.58Å; Q752-S810 VanDerWaalsContact CA-O 3.27Å; Q752-S810 WeakPolarHBondContact CA-O 3.45Å; K753-S810 PolarHBondContact N-O 3.46Å; K753-S810 PolarHBondContact O-N 2.89Å; S810-G814 WeakPolarHBondContact CA-O 3.44Å
811	N	92.5	Very high	93	Very high	20 Å²	20	51.9 Å²	51.9	11%	0.107	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	-175.7	165.5	77.8	13.4	0	0	0	109.5	S720 P722 D747 H750 L813 G814	S720-N811 PolarHBondContact O-ND2 3.2Å; P722-N811 VanDerWaalsContact CD-CG 3.49Å; P722-N811 HydrophobicContact CG-CB 3.8Å; D747-N811 PolarHBondContact O-ND2 2.63Å; H750-N811 HydrophobicContact CB-CB 4.16Å; N811-L813 PolarHBondContact O-N 2.96Å; N811-L813 VanDerWaalsContact O-N 3.07Å; N811-L813 WeakPolarHBondContact OD1-CA 3.34Å; N811-L813 WeakPolarHBondContact OD1-CB 3.29Å; N811-L813 PolarHBondContact OD1-N 3.43Å; N811-G814 PolarHBondContact N-O 2.92Å; N811-G814 PolarHBondContact O-N 3.08Å; N811-G814 PolarHBondContact OD1-N 3.46Å
812	Q	91.8	Very high	93.5	Very high	154 Å²	154	53.6 Å²	53.6	72%	0.72	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-11.1	-177.8	68.1	178.1	16.8	0	0	115.7	H750	H750-Q812 HydrophobicContact CB-CG 4.38Å; H750-Q812 PolarHBondContact CD2-NE2 2.84Å; H750-Q812 PolarHBondContact CE1-NE2 2.02Å; H750-Q812 PolarHBondContact ND1-NE2 3.3Å; H750-Q812 PolarHBondContact NE2-NE2 2.84Å
813	L	93.1	Very high	93.7	Very high	90 Å²	90	53.6 Å²	53.6	47%	0.471	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-3.6	175.9	-60.5	178.3	0	0	0	113.2	K719 N811	K719-L813 HydrophobicContact CB-CD1 4.15Å; N811-L813 PolarHBondContact O-N 2.96Å; N811-L813 VanDerWaalsContact O-N 3.07Å; N811-L813 WeakPolarHBondContact OD1-CA 3.34Å; N811-L813 WeakPolarHBondContact OD1-CB 3.29Å; N811-L813 PolarHBondContact OD1-N 3.43Å
814	G	93.3	Very high	93.6	Very high	26 Å²	26	53.4 Å²	53.4	27%	0.268	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	139.8	-172.6	169.8	0	0	0	0	0	115.4	S810 N811	S810-G814 WeakPolarHBondContact CA-O 3.44Å; N811-G814 PolarHBondContact N-O 2.92Å; N811-G814 PolarHBondContact O-N 3.08Å; N811-G814 PolarHBondContact OD1-N 3.46Å
815	E	94.2	Very high	93.4	Very high	94 Å²	94	54 Å²	54	44%	0.439	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	157.7	-175.5	-49	-162	126.4	0	0	113.6	K721 K808 A809	K721-E815 WeakPolarHBondContact CD-O 3.37Å; K721-E815 WeakPolarHBondContact CE-O 3.28Å; K721-E815 PolarHBondContact NZ-O 2.91Å; K808-E815 IonicContact NZ-OE1 3.27Å; K808-E815 PolarHBondContact NZ-OE1 2.83Å; K808-E815 IonicContact NZ-OE2 2.72Å; K808-E815 PolarHBondContact NZ-OE2 3.07Å; A809-E815 WeakPolarHBondContact O-CA 3.36Å
816	T	95	Very high	93.1	Very high	14 Å²	14	54.2 Å²	54.2	9%	0.086	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-82.5	169.5	169.6	70.4	0	0	0	0	111.6	P722 D723 P724 A809	P722-T816 HydrophobicContact CB-CG2 4.21Å; P722-T816 WeakPolarHBondContact O-CG2 3.36Å; D723-T816 WeakPolarHBondContact O-CG2 3.34Å; P724-T816 HydrophobicContact CG-CG2 4.48Å; A809-T816 HydrophobicContact CB-CG2 3.82Å; A809-T816 PolarHBondContact N-OG1 2.94Å; A809-T816 PolarHBondContact O-N 3.06Å; A809-T816 PolarHBondContact O-OG1 3.48Å
817	A	94.2	Very high	92.7	Very high	69 Å²	69	55.2 Å²	55.2	57%	0.57	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-65	161.1	156.1	0	0	0	0	0	110
818	W	94.2	Very high	92.2	Very high	80 Å²	80	58.9 Å²	58.9	30%	0.303	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-66.2	152.1	166.9	-63.5	101.8	0	0	0	111	T755 E757 R806 V807 K808	T755-W818 HydrophobicContact CG2-CH2 3.88Å; T755-W818 HydrophobicContact CG2-CZ3 4.35Å; T755-W818 WeakPolarHBondContact O-CZ3 3.45Å; E757-W818 HydrophobicContact CB-CH2 3.78Å; E757-W818 HydrophobicContact CB-CZ3 3.86Å; R806-W818 HydrophobicContact CB-CE3 4.27Å; R806-W818 HydrophobicContact CG-CD2 4.14Å; R806-W818 HydrophobicContact CG-CE3 3.74Å; R806-W818 HydrophobicContact CG-CZ3 4.24Å; R806-W818 WeakPolarHBondContact O-CZ3 3Å; V807-W818 VanDerWaalsContact C-CE3 3.47Å; V807-W818 CarbonylContact O-C 3.52Å; V807-W818 WeakPolarHBondContact O-CA 3.23Å; K808-W818 HydrophobicContact CB-CD2 4.12Å; K808-W818 HydrophobicContact CB-CE3 3.89Å; K808-W818 HydrophobicContact CB-CZ3 4.31Å; K808-W818 HydrophobicContact CD-CD2 4.33Å; K808-W818 HydrophobicContact CD-CE3 4.47Å; K808-W818 HydrophobicContact CD-CH2 4.19Å; K808-W818 HydrophobicContact CD-CZ2 4.02Å; K808-W818 HydrophobicContact CD-CZ3 4.41Å; K808-W818 HydrophobicContact CG-CD2 4.14Å; K808-W818 HydrophobicContact CG-CE3 3.84Å; K808-W818 HydrophobicContact CG-CH2 4.01Å; K808-W818 HydrophobicContact CG-CZ2 4.29Å; K808-W818 HydrophobicContact CG-CZ3 3.77Å
819	T	95.4	Very high	91.7	Very high	25 Å²	25	57.7 Å²	57.7	15%	0.153	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-60.4	169.2	163.5	59	0	0	0	0	111.3	P725 L728 V807	P725-T819 HydrophobicContact CB-CG2 3.96Å; P725-T819 HydrophobicContact CG-CG2 4.36Å; L728-T819 WeakPolarHBondContact CD2-OG1 3.45Å; V807-T819 HydrophobicContact CB-CG2 4.29Å; V807-T819 PolarHBondContact N-OG1 2.86Å; V807-T819 WeakPolarHBondContact O-CG2 3.2Å; V807-T819 PolarHBondContact O-N 2.79Å
820	Q	92.2	Very high	91.4	Very high	182 Å²	182	60.4 Å²	60.4	85%	0.85	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-57.6	148.9	157.5	-65.6	-179.2	-5.7	0	0	109.7
821	S	91.9	Very high	91.1	Very high	78 Å²	78	62.8 Å²	62.8	55%	0.545	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-74.8	129.7	176.9	-56.4	0	0	0	0	110.6	F805	F805-S821 CarbonylContact O-C 3.6Å; F805-S821 WeakPolarHBondContact O-CA 3.05Å
822	L	93.6	Very high	90.8	Very high	45 Å²	45	63.4 Å²	63.4	24%	0.236	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	130.7	170.8	174.9	66.2	0	0	0	108.9	L728 K729 V730 L740 S804 F805	L728-L822 HydrophobicContact CD2-CB 4.01Å; L728-L822 HydrophobicContact CG-CB 4.12Å; L728-L822 HydrophobicContact CG-CD2 4Å; K729-L822 VanDerWaalsContact C-CD2 3.46Å; V730-L822 HydrophobicContact CG2-CD2 3.98Å; L740-L822 HydrophobicContact CD2-CD2 4.15Å; S804-L822 CarbonylContact C-O 3.5Å; S804-L822 VanDerWaalsContact CA-O 3.3Å; S804-L822 WeakPolarHBondContact CA-O 3.36Å; F805-L822 PolarHBondContact N-O 3.2Å; F805-L822 PolarHBondContact O-N 3.21Å
823	T	92.3	Very high	90.5	Very high	77 Å²	77	62.2 Å²	62.2	47%	0.472	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	132.8	178.3	-54.2	0	0	0	0	110.1	L802 Y803 S804	L802-T823 HydrophobicContact CD1-CG2 3.75Å; L802-T823 HydrophobicContact CD2-CG2 4.16Å; L802-T823 HydrophobicContact CG-CG2 3.86Å; Y803-T823 WeakPolarHBondContact O-CA 3.38Å; Y803-T823 WeakPolarHBondContact O-CG2 3.37Å; S804-T823 WeakPolarHBondContact OG-CB 3.44Å; S804-T823 WeakPolarHBondContact OG-CG2 3.33Å; S804-T823 PolarHBondContact OG-OG1 3.04Å
824	A	89.9	Confident	90.1	Very high	13 Å²	13	62.5 Å²	62.5	11%	0.107	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	155.6	179.4	0	0	0	0	0	111.2	V730 I738 Y803 F805	V730-A824 HydrophobicContact CG2-CB 3.68Å; I738-A824 HydrophobicContact CD1-CB 3.96Å; Y803-A824 PolarHBondContact N-O 2.81Å; Y803-A824 PolarHBondContact O-N 2.92Å; Y803-A824 VanDerWaalsContact O-O 3.06Å; F805-A824 HydrophobicContact CE2-CB 4.3Å
825	A	88.3	Confident	89.8	Confident	38 Å²	38	61.4 Å²	61.4	31%	0.314	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	143.4	178	0	0	0	0	0	110.7	Q733 T801 L802	Q733-A825 PolarHBondContact NE2-O 3.14Å; Q733-A825 VanDerWaalsContact NE2-O 3.16Å; Q733-A825 PolarHBondContact OE1-O 2.98Å; T801-A825 WeakPolarHBondContact O-CA 3.42Å; L802-A825 HydrophobicContact CD1-CB 3.95Å
826	T	88.7	Confident	89.5	Confident	7 Å²	7	64.5 Å²	64.5	4%	0.043	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-66.5	156	165.9	44.5	0	0	0	0	111.3	S734 I738 L797 A798 S800 T801 Y803	S734-T826 WeakPolarHBondContact O-CA 3.25Å; S734-T826 VanDerWaalsContact O-CB 3.3Å; S734-T826 WeakPolarHBondContact O-CB 3.3Å; S734-T826 WeakPolarHBondContact O-CG2 3.46Å; I738-T826 HydrophobicContact CD1-CG2 4.23Å; I738-T826 HydrophobicContact CG1-CG2 4.23Å; L797-T826 HydrophobicContact CB-CG2 3.63Å; L797-T826 HydrophobicContact CD1-CG2 3.91Å; L797-T826 HydrophobicContact CG-CG2 4.43Å; A798-T826 WeakPolarHBondContact O-CB 3.25Å; A798-T826 WeakPolarHBondContact O-CG2 3.37Å; A798-T826 PolarHBondContact O-OG1 2.7Å; S800-T826 PolarHBondContact N-OG1 2.72Å; T801-T826 PolarHBondContact N-OG1 2.93Å; T801-T826 PolarHBondContact O-N 2.91Å; T801-T826 VanDerWaalsContact O-N 3.1Å; T801-T826 PolarHBondContact O-OG1 3.12Å; Y803-T826 HydrophobicContact CD2-CG2 4.42Å; Y803-T826 HydrophobicContact CE2-CG2 4.16Å
827	E	87.4	Confident	89.2	Confident	97 Å²	97	66.6 Å²	66.6	45%	0.453	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-71.1	167.5	172.9	-53.9	-173.5	138.7	0	0	111.2	Q733 S734 H735 P799 S800	Q733-E827 HydrophobicContact CG-CG 4.09Å; S734-E827 WeakPolarHBondContact CA-OE2 3.24Å; S734-E827 PolarHBondContact O-N 3.28Å; S734-E827 VanDerWaalsContact O-N 3.08Å; H735-E827 WeakPolarHBondContact CA-O 3.49Å; P799-E827 WeakPolarHBondContact CA-O 3.48Å; S800-E827 PolarHBondContact N-O 2.64Å
828	D	85.2	Confident	89	Confident	78 Å²	78	63.6 Å²	63.6	42%	0.417	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-78.2	152.8	171.1	-160.6	26	0	0	0	111.6	H735 S800 Y866 R898	H735-D828 WeakPolarHBondContact CB-O 3.48Å; S800-D828 VanDerWaalsContact OG-CA 3.3Å; S800-D828 WeakPolarHBondContact OG-CA 3.14Å; S800-D828 WeakPolarHBondContact OG-CB 3.13Å; S800-D828 PolarHBondContact OG-OD1 2.7Å; D828-Y866 WeakPolarHBondContact OD1-CE1 3.31Å; D828-Y866 PolarHBondContact OD1-OH 3.04Å; D828-R898 IonicContact OD1-NH2 3.89Å; D828-R898 PolarHBondContact OD1-NH2 2.86Å; D828-R898 IonicContact OD2-CZ 2.74Å; D828-R898 IonicContact OD2-NH2 3.18Å; D828-R898 PolarHBondContact OD2-NH2 2.82Å
829	A	84.9	Confident	88.8	Confident	4 Å²	4	65.3 Å²	65.3	3%	0.033	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-69.6	141.1	-175.1	0	0	0	0	0	111.8	H735 P799 R898 L905	H735-A829 HydrophobicContact CB-CB 4.39Å; P799-A829 HydrophobicContact CB-CB 3.97Å; P799-A829 HydrophobicContact CG-CB 3.85Å; A829-R898 PolarHBondContact O-NH1 2.91Å; A829-R898 PolarHBondContact O-NH2 2.98Å; A829-L905 HydrophobicContact CB-CB 4.47Å; A829-L905 WeakPolarHBondContact CB-O 3.34Å
830	P	87.3	Confident	88.5	Confident	56 Å²	56	66.7 Å²	66.7	36%	0.364	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-65.7	146.7	-170	26.1	-35.1	0	0	0	112.6	E906 C907	P830-E906 HydrophobicContact CG-CG 4Å; P830-E906 WeakPolarHBondContact O-CA 3.44Å; P830-C907 PolarHBondContact O-N 2.84Å
831	T	88.1	Confident	88.4	Confident	72 Å²	72	58.4 Å²	58.4	44%	0.442	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-85.4	132.1	174.8	54.2	0	0	0	0	111.3	C907 E909	T831-C907 CarbonylContact C-O 3.51Å; T831-C907 VanDerWaalsContact CA-O 3.27Å; T831-C907 WeakPolarHBondContact CA-O 3.47Å; T831-E909 WeakPolarHBondContact CB-OE1 3.35Å; T831-E909 WeakPolarHBondContact CG2-OE1 3.3Å; T831-E909 PolarHBondContact OG1-OE1 3.12Å
832	N	86.4	Confident	88.2	Confident	32 Å²	32	56.8 Å²	56.8	17%	0.171	34%	0.338	C	S	.	.			trans	-116.3	111.7	175.1	-179.4	-27	0	0	0	108.8	S834 I835 E906 C907	N832-S834 PolarHBondContact O-N 3.05Å; N832-S834 WeakPolarHBondContact OD1-CB 3.35Å; N832-S834 PolarHBondContact OD1-N 3.02Å; N832-S834 PolarHBondContact OD1-OG 2.9Å; N832-I835 HydrophobicContact CB-CD1 4.08Å; N832-I835 HydrophobicContact CB-CG1 4.2Å; N832-I835 PolarHBondContact O-N 3.29Å; N832-E906 HydrophobicContact CB-CB 4.06Å; N832-E906 PolarHBondContact ND2-OE2 2.03Å; N832-C907 PolarHBondContact N-O 2.91Å
833	P	84.9	Confident	88.1	Confident	130 Å²	130	54.9 Å²	54.9	84%	0.844	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-13.2	-178.7	-27.7	36	0	0	0	116
834	S	84.6	Confident	87.7	Confident	95 Å²	95	53.6 Å²	53.6	66%	0.664	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-22.5	177.4	-46.9	0	0	0	0	112.8	N832	N832-S834 PolarHBondContact O-N 3.05Å; N832-S834 WeakPolarHBondContact OD1-CB 3.35Å; N832-S834 PolarHBondContact OD1-N 3.02Å; N832-S834 PolarHBondContact OD1-OG 2.9Å
835	I	87.5	Confident	87.3	Confident	4 Å²	4	55 Å²	55	2%	0.021	33%	0.327	C	S	.	.	S	Bend	trans	-88	114.8	-178.7	-50.2	175.5	0	0	0	109	N832 Y861 N899 Y901 E906 S908	N832-I835 HydrophobicContact CB-CD1 4.08Å; N832-I835 HydrophobicContact CB-CG1 4.2Å; N832-I835 PolarHBondContact O-N 3.29Å; I835-Y861 HydrophobicContact CG2-CD1 4.23Å; I835-Y861 HydrophobicContact CG2-CE1 3.99Å; I835-N899 HydrophobicContact CG2-CB 3.87Å; I835-Y901 HydrophobicContact CD1-CD2 3.52Å; I835-Y901 HydrophobicContact CD1-CE2 3.5Å; I835-Y901 VanDerWaalsContact CD1-CE2 3.5Å; I835-Y901 HydrophobicContact CD1-CG 4.27Å; I835-Y901 HydrophobicContact CG1-CD2 4.24Å; I835-Y901 HydrophobicContact CG1-CE2 3.68Å; I835-E906 HydrophobicContact CD1-CB 4.35Å; I835-E906 VanDerWaalsContact CD1-O 3.25Å; I835-E906 WeakPolarHBondContact CD1-O 3.43Å; I835-S908 VanDerWaalsContact O-CB 3.27Å; I835-S908 WeakPolarHBondContact O-CB 3.3Å
836	K	87	Confident	87	Confident	159 Å²	159	59.7 Å²	59.7	69%	0.691	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-65.3	127.6	177.6	-68.1	-178.1	179.2	178	0	110.5	N899	K836-N899 PolarHBondContact O-ND2 2.65Å
837	P	90.2	Very high	86.9	Confident	58 Å²	58	62.5 Å²	62.5	38%	0.377	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-68.2	159.1	174.3	29.8	-35.2	0	0	0	111.5	S908	P837-S908 WeakPolarHBondContact CA-OG 3.37Å
838	P	90.1	Very high	86.9	Confident	6 Å²	6	61.7 Å²	61.7	4%	0.039	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-53	140	164.7	-25.3	36.2	0	0	0	111.1	V852 L863 V897 L911	P838-V852 HydrophobicContact CB-CG2 3.73Å; P838-V852 HydrophobicContact CG-CG2 4.12Å; P838-L863 HydrophobicContact CG-CD1 3.93Å; P838-V897 HydrophobicContact CB-CG2 4.44Å; P838-V897 HydrophobicContact CG-CG2 4.21Å; P838-L911 HydrophobicContact CB-CB 4.42Å; P838-L911 HydrophobicContact CB-CD2 3.88Å
839	V	89.1	Confident	87.1	Confident	115 Å²	115	62 Å²	62	70%	0.697	36%	0.357	S	S	*	.	S	Bend	trans	-90.1	-33.1	179.6	174.2	0	0	0	0	110.9	N853 P854	V839-N853 PolarHBondContact N-O 3.22Å; V839-P854 HydrophobicContact CG2-CG 4.46Å
840	S	88.9	Confident	87.4	Confident	55 Å²	55	61.8 Å²	61.8	39%	0.385	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	143.4	172	60.3	0	0	0	0	110.9	N853	S840-N853 PolarHBondContact N-O 3.03Å; S840-N853 PolarHBondContact O-N 3.34Å
841	A	89.9	Confident	87.5	Confident	7 Å²	7	64.6 Å²	64.6	6%	0.058	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	137.6	170.1	0	0	0	0	0	110.6	E851 V852 V897 L911 V913 A914	A841-E851 CarbonylContact C-O 3.53Å; A841-E851 VanDerWaalsContact CA-O 3.23Å; A841-E851 WeakPolarHBondContact CA-O 3.31Å; A841-V852 HydrophobicContact CB-CG2 4.3Å; A841-V897 HydrophobicContact CB-CG2 3.71Å; A841-L911 HydrophobicContact CB-CD2 3.9Å; A841-V913 HydrophobicContact CB-CB 4.5Å; A841-V913 HydrophobicContact CB-CG1 4.23Å; A841-V913 HydrophobicContact CB-CG2 4.02Å; A841-A914 PolarHBondContact O-N 2.83Å
842	T	88.7	Confident	87.5	Confident	45 Å²	45	61.5 Å²	61.5	28%	0.276	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	130.8	-176.5	31.5	0	0	0	0	110.6	E851 A914	T842-E851 PolarHBondContact N-O 2.85Å; T842-E851 PolarHBondContact O-N 2.8Å; T842-A914 WeakPolarHBondContact CA-O 3.36Å; T842-A914 HydrophobicContact CG2-CB 4.08Å
843	Y	90.1	Very high	87.6	Confident	4 Å²	4	64.5 Å²	64.5	2%	0.016	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	130.8	179	175.6	-112.2	0	0	0	111.4	E849 L850 V889 T891 L895 A914 V915 N916	Y843-E849 WeakPolarHBondContact CA-O 3.09Å; Y843-E849 VanDerWaalsContact CD2-O 3.24Å; Y843-E849 WeakPolarHBondContact CD2-O 3.26Å; Y843-L850 HydrophobicContact CD2-CB 4.23Å; Y843-V889 HydrophobicContact CD2-CB 4.46Å; Y843-V889 HydrophobicContact CE2-CB 3.89Å; Y843-V889 HydrophobicContact CE2-CG1 4.2Å; Y843-V889 WeakPolarHBondContact CE2-O 3.47Å; Y843-V889 PolarHBondContact OH-O 3.49Å; Y843-T891 HydrophobicContact CE1-CG2 4.22Å; Y843-T891 WeakPolarHBondContact OH-CA 3.47Å; Y843-T891 VanDerWaalsContact OH-CG2 3.26Å; Y843-T891 WeakPolarHBondContact OH-CG2 3.38Å; Y843-T891 PolarHBondContact OH-N 3.4Å; Y843-L895 HydrophobicContact CD1-CD1 3.37Å; Y843-L895 HydrophobicContact CD2-CD1 3.93Å; Y843-L895 HydrophobicContact CE1-CD1 3.76Å; Y843-L895 HydrophobicContact CE2-CD1 4.27Å; Y843-L895 HydrophobicContact CG-CD1 3.44Å; Y843-L895 VanDerWaalsContact CG-CD1 3.44Å; Y843-A914 PolarHBondContact N-O 2.81Å; Y843-V915 HydrophobicContact CD1-CG1 4.21Å; Y843-V915 HydrophobicContact CD1-CG2 4.31Å; Y843-N916 PolarHBondContact O-N 2.89Å
844	N	85.4	Confident	87.5	Confident	51 Å²	51	60.5 Å²	60.5	27%	0.273	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	102.4	175.2	-179.4	-4.4	0	0	0	109.9	M846 T847 Q848 E849	N844-M846 PolarHBondContact O-N 3.11Å; N844-M846 VanDerWaalsContact O-N 3.09Å; N844-M846 PolarHBondContact OD1-N 3.16Å; N844-T847 WeakPolarHBondContact CB-OG1 3.46Å; N844-T847 PolarHBondContact ND2-OG1 2.84Å; N844-T847 PolarHBondContact O-N 3.14Å; N844-Q848 WeakPolarHBondContact O-CA 3.3Å; N844-Q848 PolarHBondContact O-N 2.86Å; N844-E849 PolarHBondContact N-O 2.95Å
845	S	81.5	Confident	87.3	Confident	43 Å²	43	59.5 Å²	59.5	30%	0.301	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-6.6	-177.8	62.1	0	0	0	0	114.9
846	M	80.9	Confident	87.1	Confident	135 Å²	135	61.5 Å²	61.5	67%	0.665	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-28.9	174.7	-63	-172.2	-61.3	0	0	113.1	N844 A918	N844-M846 PolarHBondContact O-N 3.11Å; N844-M846 VanDerWaalsContact O-N 3.09Å; N844-M846 PolarHBondContact OD1-N 3.16Å; M846-A918 HydrophobicContact CE-CB 3.59Å; M846-A918 HydrophobicContact SD-CB 4.31Å
847	T	86.4	Confident	86.9	Confident	66 Å²	66	58.2 Å²	58.2	41%	0.405	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-13.6	178.1	56.1	0	0	0	0	113.4	N844 E849	N844-T847 WeakPolarHBondContact CB-OG1 3.46Å; N844-T847 PolarHBondContact ND2-OG1 2.84Å; N844-T847 PolarHBondContact O-N 3.14Å; T847-E849 WeakPolarHBondContact CB-OE2 3.18Å; T847-E849 PolarHBondContact O-N 2.88Å; T847-E849 WeakPolarHBondContact OG1-CG 3.25Å; T847-E849 PolarHBondContact OG1-OE2 2.96Å
848	Q	88.9	Confident	86.4	Confident	80 Å²	80	57.4 Å²	57.4	37%	0.374	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	22.7	-172.7	-58.9	-175.6	-25.5	0	0	113.8	N844 S888 V889	N844-Q848 WeakPolarHBondContact O-CA 3.3Å; N844-Q848 PolarHBondContact O-N 2.86Å; Q848-S888 PolarHBondContact O-N 2.89Å; Q848-S888 VanDerWaalsContact O-N 3.15Å; Q848-V889 PolarHBondContact O-N 2.78Å
849	E	89	Confident	85.9	Confident	85 Å²	85	59.9 Å²	59.9	40%	0.397	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	135.5	176.1	-63.8	157	163.1	0	0	110.8	Y843 N844 T847 I885	Y843-E849 WeakPolarHBondContact CA-O 3.09Å; Y843-E849 VanDerWaalsContact CD2-O 3.24Å; Y843-E849 WeakPolarHBondContact CD2-O 3.26Å; N844-E849 PolarHBondContact N-O 2.95Å; T847-E849 WeakPolarHBondContact CB-OE2 3.18Å; T847-E849 PolarHBondContact O-N 2.88Å; T847-E849 WeakPolarHBondContact OG1-CG 3.25Å; T847-E849 PolarHBondContact OG1-OE2 2.96Å; E849-I885 HydrophobicContact CB-CG2 4.5Å
850	L	90	Very high	85.6	Confident	0 Å²	0	60 Å²	60	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	111.4	174.9	171.6	63.6	0	0	0	109.3	Y843 L863 V865 I885 I886 V889 V897 V913	Y843-L850 HydrophobicContact CD2-CB 4.23Å; L850-L863 HydrophobicContact CD2-CD2 4.27Å; L850-V865 HydrophobicContact CD2-CG1 4.06Å; L850-V865 HydrophobicContact CD2-CG2 3.81Å; L850-I885 CarbonylContact O-C 3.52Å; L850-I885 WeakPolarHBondContact O-CA 3.23Å; L850-I886 HydrophobicContact CB-CB 4.43Å; L850-I886 PolarHBondContact N-O 3.27Å; L850-I886 PolarHBondContact O-N 2.78Å; L850-V889 HydrophobicContact CB-CB 4.44Å; L850-V889 HydrophobicContact CB-CG2 3.77Å; L850-V889 HydrophobicContact CD2-CG2 4.08Å; L850-V897 HydrophobicContact CD1-CG1 4.4Å; L850-V897 HydrophobicContact CD2-CG1 3.87Å; L850-V913 HydrophobicContact CD1-CG1 3.68Å; L850-V913 HydrophobicContact CD1-CG2 4.09Å
851	E	89.3	Confident	85.6	Confident	114 Å²	114	60 Å²	60	53%	0.533	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	141.5	177.4	-172.1	-179.4	-179.8	0	0	110.7	A841 T842 G884 I885	A841-E851 CarbonylContact C-O 3.53Å; A841-E851 VanDerWaalsContact CA-O 3.23Å; A841-E851 WeakPolarHBondContact CA-O 3.31Å; T842-E851 PolarHBondContact N-O 2.85Å; T842-E851 PolarHBondContact O-N 2.8Å; E851-G884 CarbonylContact C-O 3.6Å; E851-G884 VanDerWaalsContact CA-O 3.31Å; E851-G884 WeakPolarHBondContact CA-O 3.03Å; E851-I885 HydrophobicContact CG-CG1 4.39Å
852	V	90	Very high	85.7	Confident	7 Å²	7	59.8 Å²	59.8	4%	0.042	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	141.4	-176.4	70.8	0	0	0	0	113.2	P838 A841 L863 T882 G884	P838-V852 HydrophobicContact CB-CG2 3.73Å; P838-V852 HydrophobicContact CG-CG2 4.12Å; A841-V852 HydrophobicContact CB-CG2 4.3Å; V852-L863 HydrophobicContact CB-CD2 4.22Å; V852-L863 HydrophobicContact CG1-CD1 4.49Å; V852-L863 HydrophobicContact CG1-CD2 4.02Å; V852-L863 HydrophobicContact CG2-CD1 3.98Å; V852-L863 HydrophobicContact CG2-CD2 4.3Å; V852-T882 HydrophobicContact CG1-CG2 4Å; V852-G884 PolarHBondContact N-O 2.77Å
853	N	86.7	Confident	85.8	Confident	95 Å²	95	57.7 Å²	57.7	51%	0.508	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	135.6	-176.1	-176.8	17.1	0	0	0	110.2	V839 S840	V839-N853 PolarHBondContact N-O 3.22Å; S840-N853 PolarHBondContact N-O 3.03Å; S840-N853 PolarHBondContact O-N 3.34Å
854	P	82.7	Confident	85.7	Confident	47 Å²	47	57.5 Å²	57.5	31%	0.305	32%	0.316	S	S	.	.	S	Bend	cis	-73.7	148.5	-5.6	32.8	-36.2	0	0	0	113	V839 L856	V839-P854 HydrophobicContact CG2-CG 4.46Å; P854-L856 PolarHBondContact O-N 3.42Å
855	V	81.4	Confident	86	Confident	73 Å²	73	55.1 Å²	55.1	44%	0.442	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-71.5	122.3	168.6	-167.6	0	0	0	0	108.3	G884	V855-G884 VanDerWaalsContact CG2-CA 3.47Å
856	L	83.3	Confident	86.3	Confident	47 Å²	47	53.6 Å²	53.6	25%	0.246	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-89.8	166.3	168.5	-62.8	-170.8	0	0	0	110.4	P854 S858 Y861 N899	P854-L856 PolarHBondContact O-N 3.42Å; L856-S858 PolarHBondContact O-N 2.95Å; L856-S858 VanDerWaalsContact O-N 3.08Å; L856-Y861 HydrophobicContact CB-CD2 3.82Å; L856-Y861 HydrophobicContact CB-CG 3.99Å; L856-Y861 HydrophobicContact CD1-CD1 3.89Å; L856-Y861 HydrophobicContact CD1-CD2 4.14Å; L856-Y861 HydrophobicContact CD1-CE1 4.18Å; L856-Y861 HydrophobicContact CD1-CE2 4.43Å; L856-Y861 HydrophobicContact CD1-CG 3.87Å; L856-N899 HydrophobicContact CD1-CB 3.78Å; L856-N899 WeakPolarHBondContact CD1-ND2 3.21Å
857	D	83.6	Confident	86.7	Confident	89 Å²	89	48.4 Å²	48.4	48%	0.476	27%	0.266	S	S	.	.			trans	-60.3	111	178.2	174.6	16.2	0	0	0	111.8	G859 H860 Y861	D857-G859 PolarHBondContact O-N 2.89Å; D857-G859 VanDerWaalsContact O-N 3.14Å; D857-G859 PolarHBondContact OD1-N 2.84Å; D857-H860 PolarHBondContact O-N 3.11Å; D857-H860 IonicContact OD2-CE1 3.49Å; D857-H860 IonicContact OD2-CG 2.68Å; D857-H860 IonicContact OD2-ND1 2.73Å; D857-H860 PolarHBondContact OD2-ND1 2.86Å; D857-Y861 HydrophobicContact CB-CD2 4.45Å; D857-Y861 WeakPolarHBondContact O-CD2 3.24Å; D857-Y861 PolarHBondContact O-N 2.9Å
858	S	79.4	Confident	86.6	Confident	41 Å²	41	48 Å²	48	29%	0.287	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-0.5	-180	52.7	0	0	0	0	114.3	L856 N883 F902	L856-S858 PolarHBondContact O-N 2.95Å; L856-S858 VanDerWaalsContact O-N 3.08Å; S858-N883 PolarHBondContact OG-OD1 3.48Å; S858-F902 WeakPolarHBondContact O-CE2 3.38Å
859	G	78.2	Confident	86.1	Confident	58 Å²	58	47.2 Å²	47.2	60%	0.598	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-24.4	163.7	0	0	0	0	0	114.5	D857	D857-G859 PolarHBondContact O-N 2.89Å; D857-G859 VanDerWaalsContact O-N 3.14Å; D857-G859 PolarHBondContact OD1-N 2.84Å
860	H	83.8	Confident	85.5	Confident	118 Å²	118	50 Å²	50	55%	0.546	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-31.4	-176.6	-70.4	93.5	0	0	0	113.6	D857 F902	D857-H860 PolarHBondContact O-N 3.11Å; D857-H860 IonicContact OD2-CE1 3.49Å; D857-H860 IonicContact OD2-CG 2.68Å; D857-H860 IonicContact OD2-ND1 2.73Å; D857-H860 PolarHBondContact OD2-ND1 2.86Å; H860-F902 PolarHBondContact O-N 3.02Å
861	Y	89.2	Confident	84.6	Confident	54 Å²	54	54.2 Å²	54.2	21%	0.212	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	139.6	-174.3	-56.5	-88.7	0	0	0	112.2	I835 L856 D857 C900 Y901 F902	I835-Y861 HydrophobicContact CG2-CD1 4.23Å; I835-Y861 HydrophobicContact CG2-CE1 3.99Å; L856-Y861 HydrophobicContact CB-CD2 3.82Å; L856-Y861 HydrophobicContact CB-CG 3.99Å; L856-Y861 HydrophobicContact CD1-CD1 3.89Å; L856-Y861 HydrophobicContact CD1-CD2 4.14Å; L856-Y861 HydrophobicContact CD1-CE1 4.18Å; L856-Y861 HydrophobicContact CD1-CE2 4.43Å; L856-Y861 HydrophobicContact CD1-CG 3.87Å; D857-Y861 HydrophobicContact CB-CD2 4.45Å; D857-Y861 WeakPolarHBondContact O-CD2 3.24Å; D857-Y861 PolarHBondContact O-N 2.9Å; Y861-C900 CarbonylContact C-O 3.26Å; Y861-C900 VanDerWaalsContact CA-O 3.25Å; Y861-C900 WeakPolarHBondContact CA-O 3.31Å; Y861-Y901 AromaticContact CD1-CD1 3.98Å; Y861-Y901 HydrophobicContact CD1-CD1 3.98Å; Y861-Y901 HydrophobicContact CD1-CE1 4.07Å; Y861-Y901 AromaticContact CE1-CD1 3.64Å; Y861-Y901 HydrophobicContact CE1-CD1 3.64Å; Y861-Y901 AromaticContact CE1-CE1 3.26Å; Y861-Y901 HydrophobicContact CE1-CE1 3.26Å; Y861-Y901 AromaticContact CE1-CZ 3.87Å; Y861-Y901 HydrophobicContact CE2-CE1 4.46Å; Y861-Y901 AromaticContact CZ-CE1 3.5Å; Y861-Y901 WeakPolarHBondContact OH-CE1 2.81Å; Y861-F902 VanDerWaalsContact O-CE2 3.3Å; Y861-F902 WeakPolarHBondContact O-CE2 3.43Å
862	C	90.5	Very high	83.9	Confident	3 Å²	3	50.7 Å²	50.7	2%	0.02	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	152.2	163.5	57.4	0	0	0	0	110.9	C879 A880 C900 F902	C862-C879 HydrophobicContact CB-CB 3.95Å; C862-C879 VanDerWaalsContact CB-O 3.3Å; C862-C879 WeakPolarHBondContact CB-O 3.47Å; C862-C879 WeakPolarHBondContact CB-SG 3.18Å; C862-C879 WeakPolarHBondContact SG-CB 3.22Å; C862-C879 CovalentContact SG-SG 2.04Å; C862-C879 PolarHBondContact SG-SG 2.83Å; C862-A880 WeakPolarHBondContact CA-O 3.43Å; C862-A880 WeakPolarHBondContact CB-O 3.42Å; C862-C900 PolarHBondContact N-O 3.37Å; C862-C900 PolarHBondContact O-N 2.88Å; C862-F902 HydrophobicContact CB-CD1 4.05Å; C862-F902 HydrophobicContact CB-CD2 4.42Å; C862-F902 HydrophobicContact CB-CE1 3.61Å; C862-F902 HydrophobicContact CB-CE2 4Å; C862-F902 HydrophobicContact CB-CG 4.44Å; C862-F902 HydrophobicContact CB-CZ 3.58Å
863	L	90.7	Very high	83.1	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.01	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	110.2	170.1	-167.3	80.4	0	0	0	108.4	P838 L850 V852 V865 C879 A880 T882 I886 V897 R898 N899	P838-L863 HydrophobicContact CG-CD1 3.93Å; L850-L863 HydrophobicContact CD2-CD2 4.27Å; V852-L863 HydrophobicContact CB-CD2 4.22Å; V852-L863 HydrophobicContact CG1-CD1 4.49Å; V852-L863 HydrophobicContact CG1-CD2 4.02Å; V852-L863 HydrophobicContact CG2-CD1 3.98Å; V852-L863 HydrophobicContact CG2-CD2 4.3Å; L863-V865 HydrophobicContact CD2-CG2 4.27Å; L863-V865 PolarHBondContact O-N 2.92Å; L863-C879 WeakPolarHBondContact O-CA 3.17Å; L863-A880 PolarHBondContact N-O 2.91Å; L863-A880 PolarHBondContact O-N 3.13Å; L863-T882 HydrophobicContact CB-CG2 3.85Å; L863-I886 HydrophobicContact CB-CD1 4.1Å; L863-I886 HydrophobicContact CD2-CD1 3.7Å; L863-I886 HydrophobicContact CG-CD1 4.48Å; L863-V897 HydrophobicContact CD1-CB 4.08Å; L863-V897 HydrophobicContact CD2-CB 4.08Å; L863-V897 HydrophobicContact CD2-CG1 3.87Å; L863-V897 HydrophobicContact CG-CB 4.11Å; L863-V897 HydrophobicContact CG-CG1 4.34Å; L863-R898 CarbonylContact C-O 3.41Å; L863-R898 WeakPolarHBondContact CA-O 3.41Å; L863-N899 WeakPolarHBondContact CD1-OD1 3.43Å
864	M	89.9	Confident	82.7	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	119.5	173.8	-161	170.6	-63.3	0	0	109.7	Y866 R876 D878 C879 V897 R898 C900 L905	M864-Y866 HydrophobicContact CB-CE2 4.07Å; M864-Y866 HydrophobicContact CG-CD2 4.36Å; M864-Y866 HydrophobicContact CG-CE2 3.66Å; M864-Y866 HydrophobicContact SD-CE2 3.92Å; M864-Y866 PolarHBondContact SD-OH 3.07Å; M864-R876 HydrophobicContact CG-CG 4.09Å; M864-R876 HydrophobicContact SD-CG 4.29Å; M864-D878 WeakPolarHBondContact CA-O 3.3Å; M864-C879 HydrophobicContact CB-CB 4.11Å; M864-C879 HydrophobicContact CE-CB 3.96Å; M864-C879 HydrophobicContact CG-CB 4.09Å; M864-V897 VanDerWaalsContact O-CA 3.31Å; M864-V897 WeakPolarHBondContact O-CA 3.26Å; M864-R898 HydrophobicContact CB-CG 4.25Å; M864-R898 PolarHBondContact N-O 3.38Å; M864-R898 PolarHBondContact O-N 2.82Å; M864-C900 VanDerWaalsContact CB-SG 3.55Å; M864-C900 HydrophobicContact CE-CB 4.34Å; M864-L905 HydrophobicContact CE-CB 4.49Å; M864-L905 HydrophobicContact CE-CD2 3.99Å
865	V	90.4	Very high	82.5	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.006	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	132	-177.9	-174.1	0	0	0	0	109.2	L850 L863 W877 D878 I886 V889 L895 V897	L850-V865 HydrophobicContact CD2-CG1 4.06Å; L850-V865 HydrophobicContact CD2-CG2 3.81Å; L863-V865 HydrophobicContact CD2-CG2 4.27Å; L863-V865 PolarHBondContact O-N 2.92Å; V865-W877 HydrophobicContact CB-CE3 4Å; V865-W877 HydrophobicContact CG1-CE3 4.23Å; V865-W877 HydrophobicContact CG2-CE3 4.3Å; V865-W877 PolarHBondContact O-N 2.84Å; V865-D878 PolarHBondContact N-O 2.89Å; V865-I886 HydrophobicContact CG2-CD1 4.13Å; V865-V889 HydrophobicContact CG1-CG1 4.08Å; V865-L895 HydrophobicContact CG1-CD2 3.8Å; V865-V897 HydrophobicContact CG2-CG1 4.32Å
866	Y	88.9	Confident	82.5	Confident	10 Å²	10	52.6 Å²	52.6	4%	0.039	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	134.9	178.8	-64.7	-105.8	0	0	0	110.9	D828 M864 E875 R876 L895 R896 R898	D828-Y866 WeakPolarHBondContact OD1-CE1 3.31Å; D828-Y866 PolarHBondContact OD1-OH 3.04Å; M864-Y866 HydrophobicContact CB-CE2 4.07Å; M864-Y866 HydrophobicContact CG-CD2 4.36Å; M864-Y866 HydrophobicContact CG-CE2 3.66Å; M864-Y866 HydrophobicContact SD-CE2 3.92Å; M864-Y866 PolarHBondContact SD-OH 3.07Å; Y866-E875 CarbonylContact C-O 3.59Å; Y866-E875 VanDerWaalsContact CA-O 3.29Å; Y866-E875 WeakPolarHBondContact CA-O 3.38Å; Y866-R876 HydrophobicContact CE1-CB 4.46Å; Y866-L895 WeakPolarHBondContact O-CA 3.23Å; Y866-R896 PolarHBondContact N-O 2.84Å; Y866-R896 PolarHBondContact O-N 3.49Å; Y866-R896 VanDerWaalsContact O-N 3.12Å; Y866-R898 HydrophobicContact CE2-CG 4.05Å; Y866-R898 PolarHBondContact OH-NE 3.45Å; Y866-R898 PolarHBondContact OH-NH2 2.85Å
867	L	88.1	Confident	82.5	Confident	26 Å²	26	54.6 Å²	54.6	14%	0.136	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	137.4	174.8	-60.4	169.9	0	0	0	108.9	K869 E875 W877 P890 A892 L895	L867-K869 PolarHBondContact O-N 2.8Å; L867-E875 PolarHBondContact N-O 3.02Å; L867-E875 PolarHBondContact O-N 2.88Å; L867-W877 HydrophobicContact CD1-CB 3.73Å; L867-W877 HydrophobicContact CD1-CG 3.95Å; L867-W877 HydrophobicContact CG-CB 3.91Å; L867-W877 HydrophobicContact CG-CG 4.49Å; L867-P890 HydrophobicContact CD1-CB 3.95Å; L867-P890 HydrophobicContact CD1-CG 3.98Å; L867-P890 HydrophobicContact CD2-CB 4.36Å; L867-P890 VanDerWaalsContact CD2-O 3.31Å; L867-P890 WeakPolarHBondContact CD2-O 3.24Å; L867-A892 HydrophobicContact CB-CB 3.94Å; L867-A892 HydrophobicContact CD2-CB 3.64Å; L867-A892 HydrophobicContact CG-CB 4.37Å; L867-L895 HydrophobicContact CD2-CD2 3.6Å; L867-L895 HydrophobicContact CD2-CG 4.37Å
868	Q	85.8	Confident	82.5	Confident	57 Å²	57	53.5 Å²	53.5	27%	0.266	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	109.8	167.2	-163.9	173.1	38.2	0	0	110.2	G872 W874 A894	Q868-G872 PolarHBondContact NE2-O 2.9Å; Q868-W874 HydrophobicContact CB-CD2 4.19Å; Q868-W874 HydrophobicContact CB-CE3 4.02Å; Q868-W874 HydrophobicContact CB-CH2 4.21Å; Q868-W874 HydrophobicContact CB-CZ2 4.33Å; Q868-W874 HydrophobicContact CB-CZ3 4.03Å; Q868-W874 HydrophobicContact CG-CD2 4.44Å; Q868-A894 HydrophobicContact CB-CB 4.22Å; Q868-A894 PolarHBondContact N-O 3.02Å
869	K	77.7	Confident	82.8	Confident	64 Å²	64	52 Å²	52	28%	0.278	29%	0.287	S	S	.	.			trans	-65	154.9	172.4	-94.5	178.3	162.9	165.4	0	109.7	D761 L867 S871 G872 L873 E875	D761-K869 IonicContact OD1-NZ 2.84Å; D761-K869 IonicContact OD2-NZ 2.7Å; D761-K869 PolarHBondContact OD2-NZ 2.67Å; L867-K869 PolarHBondContact O-N 2.8Å; K869-S871 PolarHBondContact O-N 3.43Å; K869-G872 PolarHBondContact O-N 2.78Å; K869-L873 PolarHBondContact N-O 3.07Å; K869-E875 HydrophobicContact CD-CB 4.49Å; K869-E875 WeakPolarHBondContact CD-OE2 3.12Å; K869-E875 WeakPolarHBondContact CE-OE2 3.05Å; K869-E875 IonicContact NZ-OE1 2.78Å; K869-E875 PolarHBondContact NZ-OE1 2.86Å; K869-E875 IonicContact NZ-OE2 2.65Å; K869-E875 PolarHBondContact NZ-OE2 3.06Å
870	P	75.8	Confident	83.1	Confident	144 Å²	144	49.9 Å²	49.9	94%	0.935	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-13.7	-178.4	-26.7	35.8	0	0	0	116	G872	P870-G872 PolarHBondContact O-N 2.97Å
871	S	72.2	Confident	83.1	Confident	89 Å²	89	48 Å²	48	62%	0.622	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-6	170.3	51.2	0	0	0	0	114.1	K869 L873	K869-S871 PolarHBondContact O-N 3.43Å; S871-L873 PolarHBondContact O-N 3.05Å
872	G	74.5	Confident	82.7	Confident	40 Å²	40	46.1 Å²	46.1	41%	0.412	26%	0.256	S	S	.	.	S	Bend	trans	84.9	-11.6	-172.6	0	0	0	0	0	114.2	Q868 K869 P870	Q868-G872 PolarHBondContact NE2-O 2.9Å; K869-G872 PolarHBondContact O-N 2.78Å; P870-G872 PolarHBondContact O-N 2.97Å
873	L	72.2	Confident	82.2	Confident	113 Å²	113	52.6 Å²	52.6	59%	0.592	29%	0.29	S	S	*	.			trans	-66.3	138	174.5	-69.9	170.5	0	0	0	110.8	K869 S871	K869-L873 PolarHBondContact N-O 3.07Å; S871-L873 PolarHBondContact O-N 3.05Å
874	W	78.8	Confident	81.8	Confident	61 Å²	61	52.9 Å²	52.9	23%	0.231	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	135	166.5	-69.4	95.9	0	0	0	109.4	Q868 A894 R896	Q868-W874 HydrophobicContact CB-CD2 4.19Å; Q868-W874 HydrophobicContact CB-CE3 4.02Å; Q868-W874 HydrophobicContact CB-CH2 4.21Å; Q868-W874 HydrophobicContact CB-CZ2 4.33Å; Q868-W874 HydrophobicContact CB-CZ3 4.03Å; Q868-W874 HydrophobicContact CG-CD2 4.44Å; W874-A894 HydrophobicContact CH2-CB 3.49Å; W874-A894 VanDerWaalsContact CH2-CB 3.49Å; W874-A894 HydrophobicContact CZ2-CB 3.99Å; W874-A894 HydrophobicContact CZ3-CB 4.34Å; W874-R896 HydrophobicContact CE3-CB 4.35Å; W874-R896 HydrophobicContact CE3-CG 4.44Å; W874-R896 HydrophobicContact CH2-CB 4.15Å; W874-R896 HydrophobicContact CH2-CG 3.58Å; W874-R896 HydrophobicContact CZ2-CG 4.05Å; W874-R896 VanDerWaalsContact CZ2-NE 3.31Å; W874-R896 HydrophobicContact CZ3-CB 3.86Å; W874-R896 HydrophobicContact CZ3-CG 3.82Å
875	E	77.8	Confident	81.7	Confident	34 Å²	34	57.5 Å²	57.5	16%	0.159	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	142.4	176.6	-172.7	176.1	-107.6	0	0	109.1	Y866 L867 K869 W877	Y866-E875 CarbonylContact C-O 3.59Å; Y866-E875 VanDerWaalsContact CA-O 3.29Å; Y866-E875 WeakPolarHBondContact CA-O 3.38Å; L867-E875 PolarHBondContact N-O 3.02Å; L867-E875 PolarHBondContact O-N 2.88Å; K869-E875 HydrophobicContact CD-CB 4.49Å; K869-E875 WeakPolarHBondContact CD-OE2 3.12Å; K869-E875 WeakPolarHBondContact CE-OE2 3.05Å; K869-E875 IonicContact NZ-OE1 2.78Å; K869-E875 PolarHBondContact NZ-OE1 2.86Å; K869-E875 IonicContact NZ-OE2 2.65Å; K869-E875 PolarHBondContact NZ-OE2 3.06Å; E875-W877 PolarHBondContact O-N 2.03Å
876	R	82.7	Confident	81.6	Confident	53 Å²	53	58.1 Å²	58.1	20%	0.2	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	128.3	172.8	172.9	-175.6	160.3	162.8	-2.2	109.2	M864 Y866 D878	M864-R876 HydrophobicContact CG-CG 4.09Å; M864-R876 HydrophobicContact SD-CG 4.29Å; Y866-R876 HydrophobicContact CE1-CB 4.46Å; R876-D878 IonicContact NH2-OD1 2.73Å; R876-D878 PolarHBondContact NH2-OD1 2.92Å
877	W	83.3	Confident	81.6	Confident	90 Å²	90	62.5 Å²	62.5	34%	0.341	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	-59.8	166	176.2	64.4	0	0	0	110.8	V865 L867 E875 I886 V889	V865-W877 HydrophobicContact CB-CE3 4Å; V865-W877 HydrophobicContact CG1-CE3 4.23Å; V865-W877 HydrophobicContact CG2-CE3 4.3Å; V865-W877 PolarHBondContact O-N 2.84Å; L867-W877 HydrophobicContact CD1-CB 3.73Å; L867-W877 HydrophobicContact CD1-CG 3.95Å; L867-W877 HydrophobicContact CG-CB 3.91Å; L867-W877 HydrophobicContact CG-CG 4.49Å; E875-W877 PolarHBondContact O-N 2.03Å; W877-I886 HydrophobicContact CH2-CG2 4.17Å; W877-I886 HydrophobicContact CZ3-CG2 3.96Å; W877-V889 HydrophobicContact CE3-CG2 4.46Å; W877-V889 HydrophobicContact CH2-CB 4.43Å; W877-V889 HydrophobicContact CH2-CG2 3.88Å; W877-V889 HydrophobicContact CZ3-CB 4.42Å; W877-V889 HydrophobicContact CZ3-CG2 3.72Å
878	D	82.6	Confident	81.6	Confident	66 Å²	66	65.2 Å²	65.2	35%	0.353	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	173.2	175.6	-160.9	10.8	0	0	0	111.9	M864 V865 R876	M864-D878 WeakPolarHBondContact CA-O 3.3Å; V865-D878 PolarHBondContact N-O 2.89Å; R876-D878 IonicContact NH2-OD1 2.73Å; R876-D878 PolarHBondContact NH2-OD1 2.92Å
879	C	85.6	Confident	81.6	Confident	9 Å²	9	62.5 Å²	62.5	6%	0.061	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	85.7	161.6	-159.9	0	0	0	0	108	C862 L863 M864	C862-C879 HydrophobicContact CB-CB 3.95Å; C862-C879 VanDerWaalsContact CB-O 3.3Å; C862-C879 WeakPolarHBondContact CB-O 3.47Å; C862-C879 WeakPolarHBondContact CB-SG 3.18Å; C862-C879 WeakPolarHBondContact SG-CB 3.22Å; C862-C879 CovalentContact SG-SG 2.04Å; C862-C879 PolarHBondContact SG-SG 2.83Å; L863-C879 WeakPolarHBondContact O-CA 3.17Å; M864-C879 HydrophobicContact CB-CB 4.11Å; M864-C879 HydrophobicContact CE-CB 3.96Å; M864-C879 HydrophobicContact CG-CB 4.09Å
880	A	84.3	Confident	82	Confident	13 Å²	13	61.6 Å²	61.6	11%	0.107	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	146.5	-173.6	0	0	0	0	0	111.7	C862 L863 I886	C862-A880 WeakPolarHBondContact CA-O 3.43Å; C862-A880 WeakPolarHBondContact CB-O 3.42Å; L863-A880 PolarHBondContact N-O 2.91Å; L863-A880 PolarHBondContact O-N 3.13Å; A880-I886 HydrophobicContact CB-CD1 4.36Å
881	P	84.6	Confident	82.3	Confident	80 Å²	80	59 Å²	59	52%	0.519	34%	0.335	S	S	.	.			trans	-60.8	135.7	158.5	25.3	-29	0	0	0	108.7	F902	P881-F902 HydrophobicContact CB-CE2 4.5Å; P881-F902 HydrophobicContact CB-CZ 3.87Å; P881-F902 HydrophobicContact CG-CZ 4.2Å
882	T	80.3	Confident	82.6	Confident	13 Å²	13	56.1 Å²	56.1	8%	0.08	32%	0.317	C	S	.	.			trans	-132.8	143.5	176.6	-179.9	0	0	0	0	110.8	V852 L863 G884 I885 I886	V852-T882 HydrophobicContact CG1-CG2 4Å; L863-T882 HydrophobicContact CB-CG2 3.85Å; T882-G884 VanDerWaalsContact C-N 3.32Å; T882-G884 PolarHBondContact OG1-N 3.34Å; T882-I885 PolarHBondContact OG1-N 3.4Å; T882-I885 PolarHBondContact OG1-O 2.86Å; T882-I886 HydrophobicContact CG2-CD1 4.45Å
883	N	81.2	Confident	82.8	Confident	140 Å²	140	58.6 Å²	58.6	75%	0.749	33%	0.334	S	S	*	.	S	Bend	trans	-98.4	19.8	170.8	-63.3	-18	0	0	0	111.4	S858	S858-N883 PolarHBondContact OG-OD1 3.48Å
884	G	82	Confident	83.4	Confident	8 Å²	8	54.4 Å²	54.4	8%	0.082	32%	0.315	C	S	.	.	S	Bend	trans	110.9	-12.9	-177.1	0	0	0	0	0	114.6	E851 V852 V855 T882	E851-G884 CarbonylContact C-O 3.6Å; E851-G884 VanDerWaalsContact CA-O 3.31Å; E851-G884 WeakPolarHBondContact CA-O 3.03Å; V852-G884 PolarHBondContact N-O 2.77Å; V855-G884 VanDerWaalsContact CG2-CA 3.47Å; T882-G884 VanDerWaalsContact C-N 3.32Å; T882-G884 PolarHBondContact OG1-N 3.34Å
885	I	87.6	Confident	84	Confident	96 Å²	96	51.7 Å²	51.7	49%	0.492	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	147.6	173.6	-57	176.6	0	0	0	108.9	E849 L850 E851 T882	E849-I885 HydrophobicContact CB-CG2 4.5Å; L850-I885 CarbonylContact O-C 3.52Å; L850-I885 WeakPolarHBondContact O-CA 3.23Å; E851-I885 HydrophobicContact CG-CG1 4.39Å; T882-I885 PolarHBondContact OG1-N 3.4Å; T882-I885 PolarHBondContact OG1-O 2.86Å
886	I	87.8	Confident	84.6	Confident	15 Å²	15	53.9 Å²	53.9	8%	0.077	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	126.1	167.3	-54.7	177.6	0	0	0	108.5	L850 L863 V865 W877 A880 T882 V889	L850-I886 HydrophobicContact CB-CB 4.43Å; L850-I886 PolarHBondContact N-O 3.27Å; L850-I886 PolarHBondContact O-N 2.78Å; L863-I886 HydrophobicContact CB-CD1 4.1Å; L863-I886 HydrophobicContact CD2-CD1 3.7Å; L863-I886 HydrophobicContact CG-CD1 4.48Å; V865-I886 HydrophobicContact CG2-CD1 4.13Å; W877-I886 HydrophobicContact CH2-CG2 4.17Å; W877-I886 HydrophobicContact CZ3-CG2 3.96Å; A880-I886 HydrophobicContact CB-CD1 4.36Å; T882-I886 HydrophobicContact CG2-CD1 4.45Å; I886-V889 HydrophobicContact CB-CG2 4.15Å; I886-V889 HydrophobicContact CG2-CG2 3.8Å
887	D	88.5	Confident	85.1	Confident	101 Å²	101	51.3 Å²	51.3	54%	0.54	30%	0.303	S	S	.	.			trans	-90.7	164.7	-179.5	-49.8	-35.1	0	0	0	111.6	V889	D887-V889 PolarHBondContact O-N 2.91Å
888	S	87.5	Confident	85.5	Confident	83 Å²	83	47.2 Å²	47.2	58%	0.58	29%	0.287	S	S	*	.	S	Bend	trans	60.4	22.7	173.4	-48.2	0	0	0	0	115.6	Q848 P890	Q848-S888 PolarHBondContact O-N 2.89Å; Q848-S888 VanDerWaalsContact O-N 3.15Å; S888-P890 WeakPolarHBondContact O-CD 3.41Å
889	V	87.6	Confident	85.9	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	27%	0.272	C	S	.	.			trans	-69.3	122.6	177.2	-178.1	0	0	0	0	109.3	Y843 Q848 L850 V865 W877 I886 D887 L895	Y843-V889 HydrophobicContact CD2-CB 4.46Å; Y843-V889 HydrophobicContact CE2-CB 3.89Å; Y843-V889 HydrophobicContact CE2-CG1 4.2Å; Y843-V889 WeakPolarHBondContact CE2-O 3.47Å; Y843-V889 PolarHBondContact OH-O 3.49Å; Q848-V889 PolarHBondContact O-N 2.78Å; L850-V889 HydrophobicContact CB-CB 4.44Å; L850-V889 HydrophobicContact CB-CG2 3.77Å; L850-V889 HydrophobicContact CD2-CG2 4.08Å; V865-V889 HydrophobicContact CG1-CG1 4.08Å; W877-V889 HydrophobicContact CE3-CG2 4.46Å; W877-V889 HydrophobicContact CH2-CB 4.43Å; W877-V889 HydrophobicContact CH2-CG2 3.88Å; W877-V889 HydrophobicContact CZ3-CB 4.42Å; W877-V889 HydrophobicContact CZ3-CG2 3.72Å; I886-V889 HydrophobicContact CB-CG2 4.15Å; I886-V889 HydrophobicContact CG2-CG2 3.8Å; D887-V889 PolarHBondContact O-N 2.91Å; V889-L895 HydrophobicContact CG1-CD2 3.87Å
890	P	85.4	Confident	86.1	Confident	45 Å²	45	44 Å²	44	29%	0.292	27%	0.269	S	S	.	.			trans	-61	142.7	-176.2	-25.9	34.9	0	0	0	113.4	L867 S888 A892	L867-P890 HydrophobicContact CD1-CB 3.95Å; L867-P890 HydrophobicContact CD1-CG 3.98Å; L867-P890 HydrophobicContact CD2-CB 4.36Å; L867-P890 VanDerWaalsContact CD2-O 3.31Å; L867-P890 WeakPolarHBondContact CD2-O 3.24Å; S888-P890 WeakPolarHBondContact O-CD 3.41Å; P890-A892 PolarHBondContact O-N 2.95Å; P890-A892 VanDerWaalsContact O-N 3.16Å
891	T	81.4	Confident	86.3	Confident	89 Å²	89	46.7 Å²	46.7	55%	0.546	28%	0.277	S	S	.	.			trans	-68.9	108.9	173.6	41.4	0	0	0	0	111	Y843	Y843-T891 HydrophobicContact CE1-CG2 4.22Å; Y843-T891 WeakPolarHBondContact OH-CA 3.47Å; Y843-T891 VanDerWaalsContact OH-CG2 3.26Å; Y843-T891 WeakPolarHBondContact OH-CG2 3.38Å; Y843-T891 PolarHBondContact OH-N 3.4Å
892	A	78.6	Confident	86.2	Confident	29 Å²	29	46.8 Å²	46.8	24%	0.24	27%	0.269	C	S	.	.			trans	-111.3	168.9	172	0	0	0	0	0	112.1	L867 P890 A894	L867-A892 HydrophobicContact CB-CB 3.94Å; L867-A892 HydrophobicContact CD2-CB 3.64Å; L867-A892 HydrophobicContact CG-CB 4.37Å; P890-A892 PolarHBondContact O-N 2.95Å; P890-A892 VanDerWaalsContact O-N 3.16Å; A892-A894 VanDerWaalsContact C-N 3.29Å; A892-A894 WeakPolarHBondContact CB-O 3.36Å; A892-A894 PolarHBondContact O-N 2.86Å
893	A	79.6	Confident	85.8	Confident	93 Å²	93	54.5 Å²	54.5	77%	0.769	31%	0.305	S	S	*	.	S	Bend	trans	-67.3	-30.8	177	0	0	0	0	0	112.8
894	A	85.4	Confident	85.8	Confident	25 Å²	25	50.4 Å²	50.4	21%	0.207	28%	0.284	C	S	.	.	S	Bend	trans	-149.2	156.4	170.8	0	0	0	0	0	109.5	Q868 W874 A892	Q868-A894 HydrophobicContact CB-CB 4.22Å; Q868-A894 PolarHBondContact N-O 3.02Å; W874-A894 HydrophobicContact CH2-CB 3.49Å; W874-A894 VanDerWaalsContact CH2-CB 3.49Å; W874-A894 HydrophobicContact CZ2-CB 3.99Å; W874-A894 HydrophobicContact CZ3-CB 4.34Å; A892-A894 VanDerWaalsContact C-N 3.29Å; A892-A894 WeakPolarHBondContact CB-O 3.36Å; A892-A894 PolarHBondContact O-N 2.86Å
895	L	90.2	Very high	85.6	Confident	3 Å²	3	51 Å²	51	2%	0.016	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	139.3	-177.5	-89.8	157.1	0	0	0	109.6	Y843 V865 Y866 L867 V889 V913 V915	Y843-L895 HydrophobicContact CD1-CD1 3.37Å; Y843-L895 HydrophobicContact CD2-CD1 3.93Å; Y843-L895 HydrophobicContact CE1-CD1 3.76Å; Y843-L895 HydrophobicContact CE2-CD1 4.27Å; Y843-L895 HydrophobicContact CG-CD1 3.44Å; Y843-L895 VanDerWaalsContact CG-CD1 3.44Å; V865-L895 HydrophobicContact CG1-CD2 3.8Å; Y866-L895 WeakPolarHBondContact O-CA 3.23Å; L867-L895 HydrophobicContact CD2-CD2 3.6Å; L867-L895 HydrophobicContact CD2-CG 4.37Å; V889-L895 HydrophobicContact CG1-CD2 3.87Å; L895-V913 HydrophobicContact CB-CB 3.77Å; L895-V913 HydrophobicContact CB-CG1 4.47Å; L895-V913 HydrophobicContact CB-CG2 3.89Å; L895-V913 PolarHBondContact O-N 2.99Å; L895-V915 HydrophobicContact CD1-CG2 4.47Å
896	R	91.2	Very high	85.5	Confident	80 Å²	80	49.3 Å²	49.3	30%	0.302	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	146.2	173.8	-85.6	171.4	-176.4	-172.6	0.1	110.4	Y866 W874 L911 E912	Y866-R896 PolarHBondContact N-O 2.84Å; Y866-R896 PolarHBondContact O-N 3.49Å; Y866-R896 VanDerWaalsContact O-N 3.12Å; W874-R896 HydrophobicContact CE3-CB 4.35Å; W874-R896 HydrophobicContact CE3-CG 4.44Å; W874-R896 HydrophobicContact CH2-CB 4.15Å; W874-R896 HydrophobicContact CH2-CG 3.58Å; W874-R896 HydrophobicContact CZ2-CG 4.05Å; W874-R896 VanDerWaalsContact CZ2-NE 3.31Å; W874-R896 HydrophobicContact CZ3-CB 3.86Å; W874-R896 HydrophobicContact CZ3-CG 3.82Å; R896-L911 CarbonylContact C-O 3.42Å; R896-L911 WeakPolarHBondContact CA-O 3.5Å; R896-E912 HydrophobicContact CG-CB 4.48Å; R896-E912 HydrophobicContact CG-CG 3.91Å; R896-E912 IonicContact CZ-OE1 2.76Å; R896-E912 IonicContact NE-OE1 3.9Å; R896-E912 PolarHBondContact NE-OE1 2.99Å; R896-E912 IonicContact NH2-OE1 3.5Å; R896-E912 PolarHBondContact NH2-OE1 2.95Å
897	V	91.9	Very high	85.7	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	145.4	179.2	-64.8	0	0	0	0	111.9	P838 A841 L850 L863 M864 V865 L911 V913	P838-V897 HydrophobicContact CB-CG2 4.44Å; P838-V897 HydrophobicContact CG-CG2 4.21Å; A841-V897 HydrophobicContact CB-CG2 3.71Å; L850-V897 HydrophobicContact CD1-CG1 4.4Å; L850-V897 HydrophobicContact CD2-CG1 3.87Å; L863-V897 HydrophobicContact CD1-CB 4.08Å; L863-V897 HydrophobicContact CD2-CB 4.08Å; L863-V897 HydrophobicContact CD2-CG1 3.87Å; L863-V897 HydrophobicContact CG-CB 4.11Å; L863-V897 HydrophobicContact CG-CG1 4.34Å; M864-V897 VanDerWaalsContact O-CA 3.31Å; M864-V897 WeakPolarHBondContact O-CA 3.26Å; V865-V897 HydrophobicContact CG2-CG1 4.32Å; V897-L911 HydrophobicContact CG2-CB 4.1Å; V897-L911 HydrophobicContact CG2-CD2 4.48Å; V897-L911 PolarHBondContact N-O 3.02Å; V897-L911 PolarHBondContact O-N 3.18Å; V897-V913 HydrophobicContact CB-CG2 4.35Å; V897-V913 HydrophobicContact CG1-CG2 3.67Å; V897-V913 HydrophobicContact CG2-CG2 3.92Å
898	R	91.8	Very high	85.8	Confident	4 Å²	4	43.8 Å²	43.8	2%	0.015	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	152.5	168.8	50.5	-172.1	-169.4	149.9	-1.6	112.2	D828 A829 L863 M864 Y866 C907 S908	D828-R898 IonicContact OD1-NH2 3.89Å; D828-R898 PolarHBondContact OD1-NH2 2.86Å; D828-R898 IonicContact OD2-CZ 2.74Å; D828-R898 IonicContact OD2-NH2 3.18Å; D828-R898 PolarHBondContact OD2-NH2 2.82Å; A829-R898 PolarHBondContact O-NH1 2.91Å; A829-R898 PolarHBondContact O-NH2 2.98Å; L863-R898 CarbonylContact C-O 3.41Å; L863-R898 WeakPolarHBondContact CA-O 3.41Å; M864-R898 HydrophobicContact CB-CG 4.25Å; M864-R898 PolarHBondContact N-O 3.38Å; M864-R898 PolarHBondContact O-N 2.82Å; Y866-R898 HydrophobicContact CE2-CG 4.05Å; Y866-R898 PolarHBondContact OH-NE 3.45Å; Y866-R898 PolarHBondContact OH-NH2 2.85Å; R898-C907 HydrophobicContact CG-CB 4.03Å; R898-C907 VanDerWaalsContact NH1-CB 3.35Å; R898-S908 WeakPolarHBondContact CB-OG 3.33Å; R898-S908 WeakPolarHBondContact CD-O 3.38Å
899	N	91.5	Very high	85.9	Confident	7 Å²	7	45.2 Å²	45.2	4%	0.037	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	130.3	175.5	-69.7	-31	0	0	0	108.8	I835 K836 L856 L863 C907 S908	I835-N899 HydrophobicContact CG2-CB 3.87Å; K836-N899 PolarHBondContact O-ND2 2.65Å; L856-N899 HydrophobicContact CD1-CB 3.78Å; L856-N899 WeakPolarHBondContact CD1-ND2 3.21Å; L863-N899 WeakPolarHBondContact CD1-OD1 3.43Å; N899-C907 CarbonylContact O-C 3.56Å; N899-C907 WeakPolarHBondContact O-CA 3.27Å; N899-S908 PolarHBondContact N-OG 2.84Å; N899-S908 VanDerWaalsContact N-OG 3.15Å; N899-S908 PolarHBondContact O-N 3.48Å
900	C	90.3	Very high	86.1	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	147.9	-178.1	-52.5	0	0	0	0	112	Y861 C862 M864 E906 C907	Y861-C900 CarbonylContact C-O 3.26Å; Y861-C900 VanDerWaalsContact CA-O 3.25Å; Y861-C900 WeakPolarHBondContact CA-O 3.31Å; C862-C900 PolarHBondContact N-O 3.37Å; C862-C900 PolarHBondContact O-N 2.88Å; M864-C900 VanDerWaalsContact CB-SG 3.55Å; M864-C900 HydrophobicContact CE-CB 4.34Å; C900-E906 CarbonylContact C-O 3.52Å; C900-E906 VanDerWaalsContact CA-O 3.22Å; C900-E906 WeakPolarHBondContact CA-O 3.47Å; C900-C907 HydrophobicContact CB-CB 4.01Å; C900-C907 WeakPolarHBondContact CB-SG 3.47Å; C900-C907 WeakPolarHBondContact SG-CB 3.34Å; C900-C907 CovalentContact SG-SG 2.03Å; C900-C907 PolarHBondContact SG-SG 3.32Å
901	Y	88	Confident	86.3	Confident	70 Å²	70	48.2 Å²	48.2	28%	0.275	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	133.1	169.9	-70.9	-59.6	0	0	0	110.9	I835 Y861 Q903 L905 E906	I835-Y901 HydrophobicContact CD1-CD2 3.52Å; I835-Y901 HydrophobicContact CD1-CE2 3.5Å; I835-Y901 VanDerWaalsContact CD1-CE2 3.5Å; I835-Y901 HydrophobicContact CD1-CG 4.27Å; I835-Y901 HydrophobicContact CG1-CD2 4.24Å; I835-Y901 HydrophobicContact CG1-CE2 3.68Å; Y861-Y901 AromaticContact CD1-CD1 3.98Å; Y861-Y901 HydrophobicContact CD1-CD1 3.98Å; Y861-Y901 HydrophobicContact CD1-CE1 4.07Å; Y861-Y901 AromaticContact CE1-CD1 3.64Å; Y861-Y901 HydrophobicContact CE1-CD1 3.64Å; Y861-Y901 AromaticContact CE1-CE1 3.26Å; Y861-Y901 HydrophobicContact CE1-CE1 3.26Å; Y861-Y901 AromaticContact CE1-CZ 3.87Å; Y861-Y901 HydrophobicContact CE2-CE1 4.46Å; Y861-Y901 AromaticContact CZ-CE1 3.5Å; Y861-Y901 WeakPolarHBondContact OH-CE1 2.81Å; Y901-Q903 PolarHBondContact O-N 2.74Å; Y901-Q903 VanDerWaalsContact O-N 3.16Å; Y901-L905 WeakPolarHBondContact O-CA 3.46Å; Y901-L905 PolarHBondContact O-N 2.87Å; Y901-E906 HydrophobicContact CD2-CB 4.33Å; Y901-E906 PolarHBondContact N-O 3.26Å
902	F	81.9	Confident	86.7	Confident	81 Å²	81	49.8 Å²	49.8	36%	0.355	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-36.4	179.2	-90.5	-72.2	0	0	0	114.4	S858 H860 Y861 C862 P881	S858-F902 WeakPolarHBondContact O-CE2 3.38Å; H860-F902 PolarHBondContact O-N 3.02Å; Y861-F902 VanDerWaalsContact O-CE2 3.3Å; Y861-F902 WeakPolarHBondContact O-CE2 3.43Å; C862-F902 HydrophobicContact CB-CD1 4.05Å; C862-F902 HydrophobicContact CB-CD2 4.42Å; C862-F902 HydrophobicContact CB-CE1 3.61Å; C862-F902 HydrophobicContact CB-CE2 4Å; C862-F902 HydrophobicContact CB-CG 4.44Å; C862-F902 HydrophobicContact CB-CZ 3.58Å; P881-F902 HydrophobicContact CB-CE2 4.5Å; P881-F902 HydrophobicContact CB-CZ 3.87Å; P881-F902 HydrophobicContact CG-CZ 4.2Å
903	Q	73.5	Confident	87.1	Confident	176 Å²	176	49 Å²	49	82%	0.822	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-55.3	-172.5	-60.5	179.9	4.6	0	0	112.2	K736 Y901	K736-Q903 PolarHBondContact NZ-O 2.99Å; Y901-Q903 PolarHBondContact O-N 2.74Å; Y901-Q903 VanDerWaalsContact O-N 3.16Å
904	T	79.5	Confident	86.8	Confident	53 Å²	53	47 Å²	47	33%	0.325	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-22.5	-175.9	64.6	0	0	0	0	112.7	K736 E906	K736-T904 WeakPolarHBondContact CE-O 3.13Å; K736-T904 PolarHBondContact NZ-O 3Å; T904-E906 WeakPolarHBondContact CB-OE1 3.45Å; T904-E906 WeakPolarHBondContact CG2-OE1 3.26Å; T904-E906 PolarHBondContact O-N 2.96Å; T904-E906 WeakPolarHBondContact OG1-CB 3.3Å; T904-E906 PolarHBondContact OG1-N 3.48Å; T904-E906 PolarHBondContact OG1-OE1 2.98Å
905	L	78.7	Confident	86.1	Confident	22 Å²	22	48.3 Å²	48.3	12%	0.115	24%	0.243	C	C	.	.			trans	54.1	18.8	-166.9	-57.2	-178.8	0	0	0	113.3	P799 A829 M864 Y901 C907	P799-L905 HydrophobicContact CG-CD1 3.97Å; A829-L905 HydrophobicContact CB-CB 4.47Å; A829-L905 WeakPolarHBondContact CB-O 3.34Å; M864-L905 HydrophobicContact CE-CB 4.49Å; M864-L905 HydrophobicContact CE-CD2 3.99Å; Y901-L905 WeakPolarHBondContact O-CA 3.46Å; Y901-L905 PolarHBondContact O-N 2.87Å; L905-C907 PolarHBondContact O-SG 3.41Å
906	E	86.3	Confident	84.6	Confident	59 Å²	59	52.9 Å²	52.9	28%	0.276	27%	0.267	S	S	.	.			trans	-65	140.6	160.1	-70.2	159.2	-117.6	0	0	108.9	P830 N832 I835 C900 Y901 T904	P830-E906 HydrophobicContact CG-CG 4Å; P830-E906 WeakPolarHBondContact O-CA 3.44Å; N832-E906 HydrophobicContact CB-CB 4.06Å; N832-E906 PolarHBondContact ND2-OE2 2.03Å; I835-E906 HydrophobicContact CD1-CB 4.35Å; I835-E906 VanDerWaalsContact CD1-O 3.25Å; I835-E906 WeakPolarHBondContact CD1-O 3.43Å; C900-E906 CarbonylContact C-O 3.52Å; C900-E906 VanDerWaalsContact CA-O 3.22Å; C900-E906 WeakPolarHBondContact CA-O 3.47Å; Y901-E906 HydrophobicContact CD2-CB 4.33Å; Y901-E906 PolarHBondContact N-O 3.26Å; T904-E906 WeakPolarHBondContact CB-OE1 3.45Å; T904-E906 WeakPolarHBondContact CG2-OE1 3.26Å; T904-E906 PolarHBondContact O-N 2.96Å; T904-E906 WeakPolarHBondContact OG1-CB 3.3Å; T904-E906 PolarHBondContact OG1-N 3.48Å; T904-E906 PolarHBondContact OG1-OE1 2.98Å
907	C	90.6	Very high	82.9	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-131.8	162.9	-169.9	-62.3	0	0	0	0	112.8	P830 T831 N832 R898 N899 C900 L905	P830-C907 PolarHBondContact O-N 2.84Å; T831-C907 CarbonylContact C-O 3.51Å; T831-C907 VanDerWaalsContact CA-O 3.27Å; T831-C907 WeakPolarHBondContact CA-O 3.47Å; N832-C907 PolarHBondContact N-O 2.91Å; R898-C907 HydrophobicContact CG-CB 4.03Å; R898-C907 VanDerWaalsContact NH1-CB 3.35Å; N899-C907 CarbonylContact O-C 3.56Å; N899-C907 WeakPolarHBondContact O-CA 3.27Å; C900-C907 HydrophobicContact CB-CB 4.01Å; C900-C907 WeakPolarHBondContact CB-SG 3.47Å; C900-C907 WeakPolarHBondContact SG-CB 3.34Å; C900-C907 CovalentContact SG-SG 2.03Å; C900-C907 PolarHBondContact SG-SG 3.32Å; L905-C907 PolarHBondContact O-SG 3.41Å
908	S	91.8	Very high	80.7	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-66	173	163.3	70.4	0	0	0	0	111.7	I835 P837 R898 N899	I835-S908 VanDerWaalsContact O-CB 3.27Å; I835-S908 WeakPolarHBondContact O-CB 3.3Å; P837-S908 WeakPolarHBondContact CA-OG 3.37Å; R898-S908 WeakPolarHBondContact CB-OG 3.33Å; R898-S908 WeakPolarHBondContact CD-O 3.38Å; N899-S908 PolarHBondContact N-OG 2.84Å; N899-S908 VanDerWaalsContact N-OG 3.15Å; N899-S908 PolarHBondContact O-N 3.48Å
909	E	89.5	Confident	78.4	Confident	113 Å²	113	62.5 Å²	62.5	53%	0.528	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-55.8	149.6	157.2	-67.5	-56.8	138.2	0	0	111.2	T831	T831-E909 WeakPolarHBondContact CB-OE1 3.35Å; T831-E909 WeakPolarHBondContact CG2-OE1 3.3Å; T831-E909 PolarHBondContact OG1-OE1 3.12Å
910	P	90.1	Very high	76.1	Confident	63 Å²	63	66.5 Å²	66.5	41%	0.409	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-82.2	140.6	-179.3	32.2	-33.8	0	0	0	113.6
911	L	91.1	Very high	74.3	Confident	46 Å²	46	71.8 Å²	71.8	24%	0.241	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	133.8	167.5	-178.5	68.5	0	0	0	109.8	P838 A841 R896 V897	P838-L911 HydrophobicContact CB-CB 4.42Å; P838-L911 HydrophobicContact CB-CD2 3.88Å; A841-L911 HydrophobicContact CB-CD2 3.9Å; R896-L911 CarbonylContact C-O 3.42Å; R896-L911 WeakPolarHBondContact CA-O 3.5Å; V897-L911 HydrophobicContact CG2-CB 4.1Å; V897-L911 HydrophobicContact CG2-CD2 4.48Å; V897-L911 PolarHBondContact N-O 3.02Å; V897-L911 PolarHBondContact O-N 3.18Å
912	E	89.3	Confident	72.6	Confident	121 Å²	121	70.4 Å²	70.4	57%	0.565	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	132.5	167.9	-56.9	-156.8	136.8	0	0	110.2	R896	R896-E912 HydrophobicContact CG-CB 4.48Å; R896-E912 HydrophobicContact CG-CG 3.91Å; R896-E912 IonicContact CZ-OE1 2.76Å; R896-E912 IonicContact NE-OE1 3.9Å; R896-E912 PolarHBondContact NE-OE1 2.99Å; R896-E912 IonicContact NH2-OE1 3.5Å; R896-E912 PolarHBondContact NH2-OE1 2.95Å
913	V	87.4	Confident	71.7	Confident	14 Å²	14	76.2 Å²	76.2	9%	0.085	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-83.5	134.1	-172.3	-178.3	0	0	0	0	110.9	A841 L850 L895 V897 V915	A841-V913 HydrophobicContact CB-CB 4.5Å; A841-V913 HydrophobicContact CB-CG1 4.23Å; A841-V913 HydrophobicContact CB-CG2 4.02Å; L850-V913 HydrophobicContact CD1-CG1 3.68Å; L850-V913 HydrophobicContact CD1-CG2 4.09Å; L895-V913 HydrophobicContact CB-CB 3.77Å; L895-V913 HydrophobicContact CB-CG1 4.47Å; L895-V913 HydrophobicContact CB-CG2 3.89Å; L895-V913 PolarHBondContact O-N 2.99Å; V897-V913 HydrophobicContact CB-CG2 4.35Å; V897-V913 HydrophobicContact CG1-CG2 3.67Å; V897-V913 HydrophobicContact CG2-CG2 3.92Å; V913-V915 PolarHBondContact O-N 2.91Å; V913-V915 VanDerWaalsContact O-N 3.12Å
914	A	73.1	Confident	71.4	Confident	49 Å²	49	74.1 Å²	74.1	41%	0.405	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	104.7	171.6	0	0	0	0	0	110.5	A841 T842 Y843 N916	A841-A914 PolarHBondContact O-N 2.83Å; T842-A914 WeakPolarHBondContact CA-O 3.36Å; T842-A914 HydrophobicContact CG2-CB 4.08Å; Y843-A914 PolarHBondContact N-O 2.81Å; A914-N916 PolarHBondContact O-N 3.37Å
915	V	71.3	Confident	70.9	Confident	54 Å²	54	75.3 Å²	75.3	33%	0.327	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	100.8	175.8	179.7	0	0	0	0	109.4	Y843 L895 V913 V917	Y843-V915 HydrophobicContact CD1-CG1 4.21Å; Y843-V915 HydrophobicContact CD1-CG2 4.31Å; L895-V915 HydrophobicContact CD1-CG2 4.47Å; V913-V915 PolarHBondContact O-N 2.91Å; V913-V915 VanDerWaalsContact O-N 3.12Å; V915-V917 HydrophobicContact CG1-CG2 4.05Å; V915-V917 PolarHBondContact O-N 2.94Å
916	N	59	Low	70.5	Confident	99 Å²	99	78.8 Å²	78.8	53%	0.529	44%	0.444	S	S	.	.			trans	-80	82.5	-178.5	-80.7	-27.2	0	0	0	111	Y843 A914 A918	Y843-N916 PolarHBondContact O-N 2.89Å; A914-N916 PolarHBondContact O-N 3.37Å; N916-A918 PolarHBondContact O-N 2.78Å
917	V	54.9	Low	69.9	Low	99 Å²	99	78.3 Å²	78.3	60%	0.6	45%	0.45	S	S	*	.			trans	-69.9	99.9	171.6	-174.3	0	0	0	0	109.4	V915 T919	V915-V917 HydrophobicContact CG1-CG2 4.05Å; V915-V917 PolarHBondContact O-N 2.94Å; V917-T919 PolarHBondContact O-N 2.87Å
918	A	46.3	Very low	69.4	Low	55 Å²	55	81 Å²	81	46%	0.455	47%	0.473	S	S	.	.			trans	-64.9	102.8	174.8	0	0	0	0	0	110.5	M846 N916 A920	M846-A918 HydrophobicContact CE-CB 3.59Å; M846-A918 HydrophobicContact SD-CB 4.31Å; N916-A918 PolarHBondContact O-N 2.78Å; A918-A920 PolarHBondContact O-N 2.96Å
919	T	43.4	Very low	68.8	Low	131 Å²	131	85.7 Å²	85.7	80%	0.804	50%	0.496	S	S	*	.			trans	-76.4	49	179.9	48.7	0	0	0	0	112.8	V917 I921	V917-T919 PolarHBondContact O-N 2.87Å; T919-I921 PolarHBondContact O-N 2.78Å
920	A	42.9	Very low	68.6	Low	92 Å²	92	83.8 Å²	83.8	76%	0.76	50%	0.495	S	S	*	.			trans	-76.4	33.1	179.2	0	0	0	0	0	113.7	A918 G922	A918-A920 PolarHBondContact O-N 2.96Å; A920-G922 PolarHBondContact O-N 3.03Å
921	I	52.5	Low	68.3	Low	110 Å²	110	85 Å²	85	56%	0.564	50%	0.504	S	S	*	.			trans	-88.5	94.6	167.6	-56.1	-177.8	0	0	0	107.2	T919 V925 I926	T919-I921 PolarHBondContact O-N 2.78Å; I921-V925 HydrophobicContact CG2-CB 3.77Å; I921-V925 HydrophobicContact CG2-CG1 3.84Å; I921-I926 HydrophobicContact CG2-CD1 4.5Å; I921-I926 HydrophobicContact CG2-CG1 3.86Å
922	G	52.5	Low	68.1	Low	42 Å²	42	86.7 Å²	86.7	43%	0.433	52%	0.516	S	S	.	.			trans	-53.9	144.3	176.1	0	0	0	0	0	112	A920 E924 V925	A920-G922 PolarHBondContact O-N 3.03Å; G922-E924 PolarHBondContact O-N 3Å; G922-V925 PolarHBondContact O-N 2.82Å
923	W	62.5	Low	68	Low	202 Å²	202	84.6 Å²	84.6	77%	0.765	51%	0.511	S	S	*	.	H	α-helix	trans	-52.4	-29.7	-172.6	62.8	-81.3	0	0	0	114.3	V925 I926 A927	W923-V925 VanDerWaalsContact C-N 3.35Å; W923-V925 PolarHBondContact O-N 2.86Å; W923-I926 PolarHBondContact O-N 2.84Å; W923-A927 PolarHBondContact O-N 2.82Å; W923-A927 VanDerWaalsContact O-N 3.12Å
924	E	67.3	Low	68	Low	133 Å²	133	89.1 Å²	89.1	62%	0.621	54%	0.535	S	S	*	.	H	α-helix	trans	-60.6	-37.7	174.8	-57.7	-171.9	173.9	0	0	113.4	G922 A927 A928	G922-E924 PolarHBondContact O-N 3Å; E924-A927 PolarHBondContact O-N 2.65Å; E924-A928 PolarHBondContact O-N 3.33Å
925	V	68.2	Low	68.7	Low	78 Å²	78	92.8 Å²	92.8	47%	0.473	54%	0.542	S	S	.	.	H	α-helix	trans	-71	-38.5	-179.6	179.7	0	0	0	0	110.9	I921 G922 W923 A927 A928 I929	I921-V925 HydrophobicContact CG2-CB 3.77Å; I921-V925 HydrophobicContact CG2-CG1 3.84Å; G922-V925 PolarHBondContact O-N 2.82Å; W923-V925 VanDerWaalsContact C-N 3.35Å; W923-V925 PolarHBondContact O-N 2.86Å; V925-A927 VanDerWaalsContact C-N 3.33Å; V925-A928 PolarHBondContact O-N 2.89Å; V925-I929 HydrophobicContact CG1-CD1 4.18Å; V925-I929 WeakPolarHBondContact O-CG1 3.34Å; V925-I929 PolarHBondContact O-N 3.26Å; V925-I929 VanDerWaalsContact O-N 3.13Å
926	I	70.5	Confident	69.5	Low	94 Å²	94	97 Å²	97	48%	0.482	56%	0.556	S	S	.	*	H	α-helix	trans	-62.9	-43	174.5	-58.5	173.5	0	0	0	109.7	I921 W923 A928 I929 C930	I921-I926 HydrophobicContact CG2-CD1 4.5Å; I921-I926 HydrophobicContact CG2-CG1 3.86Å; W923-I926 PolarHBondContact O-N 2.84Å; I926-A928 PolarHBondContact O-N 2.86Å; I926-I929 PolarHBondContact O-N 3.23Å; I926-C930 PolarHBondContact O-N 2.99Å; I926-C930 VanDerWaalsContact O-N 3.07Å; I926-C930 PolarHBondContact O-SG 2.98Å; I926-C930 VanDerWaalsContact O-SG 3.41Å
927	A	74.6	Confident	70.8	Confident	49 Å²	49	97.5 Å²	97.5	41%	0.405	56%	0.558	S	S	.	*	H	α-helix	trans	-60.3	-44	176.4	0	0	0	0	0	112.5	W923 E924 V925 I929 C930 C931	W923-A927 PolarHBondContact O-N 2.82Å; W923-A927 VanDerWaalsContact O-N 3.12Å; E924-A927 PolarHBondContact O-N 2.65Å; V925-A927 VanDerWaalsContact C-N 3.33Å; A927-I929 PolarHBondContact O-N 2.86Å; A927-C930 PolarHBondContact O-N 3.07Å; A927-C931 PolarHBondContact O-N 3.35Å; A927-C931 VanDerWaalsContact O-N 3.09Å; A927-C931 PolarHBondContact O-SG 2.8Å; A927-C931 VanDerWaalsContact O-SG 3.42Å
928	A	78.9	Confident	72.3	Confident	57 Å²	57	98.4 Å²	98.4	47%	0.471	56%	0.559	S	S	.	*	H	α-helix	trans	-61.7	-42.7	177.9	0	0	0	0	0	113	E924 V925 I926 C931 T932	E924-A928 PolarHBondContact O-N 3.33Å; V925-A928 PolarHBondContact O-N 2.89Å; I926-A928 PolarHBondContact O-N 2.86Å; A928-C931 PolarHBondContact O-N 3.03Å; A928-T932 PolarHBondContact O-N 3.17Å; A928-T932 PolarHBondContact O-OG1 2.83Å
929	I	80.6	Confident	74.2	Confident	98 Å²	98	100.3 Å²	100.3	50%	0.503	56%	0.561	S	S	.	*	H	α-helix	trans	-64	-46.5	177.3	-66.1	167.2	0	0	0	110.5	V925 I926 A927 C931 T932 V933	V925-I929 HydrophobicContact CG1-CD1 4.18Å; V925-I929 WeakPolarHBondContact O-CG1 3.34Å; V925-I929 PolarHBondContact O-N 3.26Å; V925-I929 VanDerWaalsContact O-N 3.13Å; I926-I929 PolarHBondContact O-N 3.23Å; A927-I929 PolarHBondContact O-N 2.86Å; I929-C931 VanDerWaalsContact C-N 3.34Å; I929-C931 PolarHBondContact O-N 2.95Å; I929-T932 PolarHBondContact O-N 3.26Å; I929-T932 PolarHBondContact O-OG1 3.37Å; I929-V933 HydrophobicContact CG2-CG2 4.45Å; I929-V933 WeakPolarHBondContact O-CG2 3.47Å; I929-V933 PolarHBondContact O-N 2.98Å; I929-V933 VanDerWaalsContact O-N 3.11Å
930	C	84.5	Confident	76.3	Confident	74 Å²	74	100.1 Å²	100.1	50%	0.5	55%	0.549	S	S	.	.	H	α-helix	trans	-58.4	-42.3	177.6	-73.2	0	0	0	0	113	I926 A927 L934	I926-C930 PolarHBondContact O-N 2.99Å; I926-C930 VanDerWaalsContact O-N 3.07Å; I926-C930 PolarHBondContact O-SG 2.98Å; I926-C930 VanDerWaalsContact O-SG 3.41Å; A927-C930 PolarHBondContact O-N 3.07Å; C930-L934 PolarHBondContact O-N 3.39Å
931	C	84.5	Confident	78.2	Confident	88 Å²	88	98.1 Å²	98.1	60%	0.595	53%	0.533	S	S	*	.	H	α-helix	trans	-64.3	-41.9	177.9	-73.7	0	0	0	0	113.1	A927 A928 I929 F935	A927-C931 PolarHBondContact O-N 3.35Å; A927-C931 VanDerWaalsContact O-N 3.09Å; A927-C931 PolarHBondContact O-SG 2.8Å; A927-C931 VanDerWaalsContact O-SG 3.42Å; A928-C931 PolarHBondContact O-N 3.03Å; I929-C931 VanDerWaalsContact C-N 3.34Å; I929-C931 PolarHBondContact O-N 2.95Å; C931-F935 PolarHBondContact O-N 2.59Å
932	T	85.8	Confident	79.8	Confident	81 Å²	81	99.9 Å²	99.9	50%	0.497	54%	0.54	S	S	.	.	H	α-helix	trans	-69.6	-40.6	-179.6	52.8	0	0	0	0	112.6	A928 I929 L934 F935 F936	A928-T932 PolarHBondContact O-N 3.17Å; A928-T932 PolarHBondContact O-OG1 2.83Å; I929-T932 PolarHBondContact O-N 3.26Å; I929-T932 PolarHBondContact O-OG1 3.37Å; T932-L934 PolarHBondContact O-N 3.5Å; T932-F935 PolarHBondContact O-N 2.85Å; T932-F936 WeakPolarHBondContact O-CD2 3.4Å; T932-F936 PolarHBondContact O-N 2.84Å
933	V	86.8	Confident	81.2	Confident	77 Å²	77	103.3 Å²	103.3	47%	0.467	55%	0.546	S	S	.	.	H	α-helix	trans	-61.9	-43	176.2	173.2	0	0	0	0	111.5	I929 F935 F936 L937	I929-V933 HydrophobicContact CG2-CG2 4.45Å; I929-V933 WeakPolarHBondContact O-CG2 3.47Å; I929-V933 PolarHBondContact O-N 2.98Å; I929-V933 VanDerWaalsContact O-N 3.11Å; V933-F935 VanDerWaalsContact C-N 3.32Å; V933-F935 PolarHBondContact O-N 2.86Å; V933-F936 PolarHBondContact O-N 3.26Å; V933-L937 HydrophobicContact CG1-CD1 3.94Å; V933-L937 HydrophobicContact CG1-CG 4.41Å; V933-L937 WeakPolarHBondContact O-CG 3.31Å; V933-L937 PolarHBondContact O-N 3.27Å; V933-L937 VanDerWaalsContact O-N 3.08Å
934	L	88	Confident	82	Confident	110 Å²	110	96.2 Å²	96.2	58%	0.576	53%	0.527	S	S	*	.	H	α-helix	trans	-58.5	-41.2	176.1	-98.2	162.9	0	0	0	112.6	C930 T932 L938	C930-L934 PolarHBondContact O-N 3.39Å; T932-L934 PolarHBondContact O-N 3.5Å; L934-L938 WeakPolarHBondContact O-CG 3.35Å; L934-L938 PolarHBondContact O-N 3.46Å
935	F	87.3	Confident	82.6	Confident	126 Å²	126	97.7 Å²	97.7	55%	0.553	53%	0.532	S	S	*	.	H	α-helix	trans	-63.9	-46.2	178.7	-175.3	-102.4	0	0	0	112.4	C931 T932 V933 L938 L939	C931-F935 PolarHBondContact O-N 2.59Å; T932-F935 PolarHBondContact O-N 2.85Å; V933-F935 VanDerWaalsContact C-N 3.32Å; V933-F935 PolarHBondContact O-N 2.86Å; F935-L938 PolarHBondContact O-N 3.44Å; F935-L939 HydrophobicContact CD1-CD1 4Å; F935-L939 HydrophobicContact CE1-CD1 3.59Å; F935-L939 HydrophobicContact CZ-CD1 4.12Å; F935-L939 PolarHBondContact O-N 2.67Å
936	F	87.6	Confident	83.2	Confident	143 Å²	143	102.5 Å²	102.5	63%	0.627	54%	0.543	S	S	*	.	H	α-helix	trans	-67.3	-36	178.8	-81	-70.9	0	0	0	113.4	T932 V933 L938 L939 F940	T932-F936 WeakPolarHBondContact O-CD2 3.4Å; T932-F936 PolarHBondContact O-N 2.84Å; V933-F936 PolarHBondContact O-N 3.26Å; F936-L938 VanDerWaalsContact C-N 3.34Å; F936-L938 PolarHBondContact O-N 2.87Å; F936-L939 PolarHBondContact O-N 3.48Å; F936-F940 PolarHBondContact O-N 3.02Å
937	L	87.2	Confident	83.3	Confident	108 Å²	108	101.1 Å²	101.1	57%	0.565	54%	0.541	S	S	*	.	H	α-helix	trans	-62.3	-39.6	176.3	-74.2	171.1	0	0	0	112.4	V933 F940 A941	V933-L937 HydrophobicContact CG1-CD1 3.94Å; V933-L937 HydrophobicContact CG1-CG 4.41Å; V933-L937 WeakPolarHBondContact O-CG 3.31Å; V933-L937 PolarHBondContact O-N 3.27Å; V933-L937 VanDerWaalsContact O-N 3.08Å; L937-F940 PolarHBondContact O-N 2.96Å; L937-A941 WeakPolarHBondContact O-CB 3.5Å; L937-A941 PolarHBondContact O-N 2.85Å
938	L	87.3	Confident	83.3	Confident	119 Å²	119	107.7 Å²	107.7	62%	0.623	56%	0.555	S	S	*	*	H	α-helix	trans	-65.4	-42.1	176.9	-70.9	168.8	0	0	0	112.2	L934 F935 F936 A941 M942	L934-L938 WeakPolarHBondContact O-CG 3.35Å; L934-L938 PolarHBondContact O-N 3.46Å; F935-L938 PolarHBondContact O-N 3.44Å; F936-L938 VanDerWaalsContact C-N 3.34Å; F936-L938 PolarHBondContact O-N 2.87Å; L938-A941 PolarHBondContact O-N 2.91Å; L938-M942 WeakPolarHBondContact O-CG 3.35Å; L938-M942 PolarHBondContact O-N 2.69Å
939	L	86.3	Confident	83.1	Confident	94 Å²	94	112.7 Å²	112.7	49%	0.492	57%	0.566	S	S	.	*	H	α-helix	trans	-63	-42.7	174.9	-70.5	173.9	0	0	0	112.1	F935 F936 M942 M943	F935-L939 HydrophobicContact CD1-CD1 4Å; F935-L939 HydrophobicContact CE1-CD1 3.59Å; F935-L939 HydrophobicContact CZ-CD1 4.12Å; F935-L939 PolarHBondContact O-N 2.67Å; F936-L939 PolarHBondContact O-N 3.48Å; L939-M942 PolarHBondContact O-N 2.71Å; L939-M943 PolarHBondContact O-N 3.11Å
940	F	85.7	Confident	82.4	Confident	128 Å²	128	113.6 Å²	113.6	56%	0.561	57%	0.568	S	S	*	*	H	α-helix	trans	-66.2	-41.5	178.8	-168.5	-102.5	0	0	0	112.1	F936 L937 M942 M943 C944	F936-F940 PolarHBondContact O-N 3.02Å; L937-F940 PolarHBondContact O-N 2.96Å; F940-M942 VanDerWaalsContact C-N 3.34Å; F940-M942 PolarHBondContact O-N 3.24Å; F940-M943 HydrophobicContact CE2-CE 4.44Å; F940-M943 PolarHBondContact O-N 3.02Å; F940-C944 WeakPolarHBondContact CE1-SG 3.21Å; F940-C944 PolarHBondContact O-N 2.83Å; F940-C944 PolarHBondContact O-SG 3.5Å; F940-C944 VanDerWaalsContact O-SG 3.39Å
941	A	84.5	Confident	81.4	Confident	50 Å²	50	119.5 Å²	119.5	41%	0.413	58%	0.58	S	S	.	*	H	α-helix	trans	-59.5	-42.4	176.6	0	0	0	0	0	112.6	L937 L938 C944 F945	L937-A941 WeakPolarHBondContact O-CB 3.5Å; L937-A941 PolarHBondContact O-N 2.85Å; L938-A941 PolarHBondContact O-N 2.91Å; A941-C944 PolarHBondContact O-N 2.92Å; A941-F945 PolarHBondContact O-N 3.23Å; A941-F945 VanDerWaalsContact O-N 3.07Å
942	M	84.8	Confident	80.3	Confident	146 Å²	146	121.2 Å²	121.2	72%	0.719	58%	0.582	S	S	*	*	H	α-helix	trans	-58.1	-49.1	173.8	-75.7	-88.1	-80.1	0	0	111.8	L938 L939 F940 C944 F945 Y946	L938-M942 WeakPolarHBondContact O-CG 3.35Å; L938-M942 PolarHBondContact O-N 2.69Å; L939-M942 PolarHBondContact O-N 2.71Å; F940-M942 VanDerWaalsContact C-N 3.34Å; F940-M942 PolarHBondContact O-N 3.24Å; M942-C944 PolarHBondContact O-N 2.83Å; M942-F945 PolarHBondContact O-N 2.9Å; M942-Y946 PolarHBondContact O-N 2.81Å
943	M	83	Confident	79	Confident	114 Å²	114	123.5 Å²	123.5	56%	0.562	59%	0.592	S	S	*	*	H	α-helix	trans	-64.8	-41.2	179.9	-162.1	-175.1	77.2	0	0	111.9	L939 F940 F945 Y946 C947	L939-M943 PolarHBondContact O-N 3.11Å; F940-M943 HydrophobicContact CE2-CE 4.44Å; F940-M943 PolarHBondContact O-N 3.02Å; M943-F945 VanDerWaalsContact C-N 3.34Å; M943-F945 PolarHBondContact O-N 3.04Å; M943-Y946 WeakPolarHBondContact O-CB 3.42Å; M943-Y946 PolarHBondContact O-N 2.97Å; M943-C947 PolarHBondContact O-N 2.66Å; M943-C947 VanDerWaalsContact O-N 3.08Å; M943-C947 PolarHBondContact O-SG 3.12Å
944	C	79	Confident	77.5	Confident	54 Å²	54	126.6 Å²	126.6	37%	0.365	60%	0.603	S	S	.	*	H	α-helix	trans	-59.6	-41.1	175.2	-74.7	0	0	0	0	112.7	F940 A941 M942 Y946 C947 R948	F940-C944 WeakPolarHBondContact CE1-SG 3.21Å; F940-C944 PolarHBondContact O-N 2.83Å; F940-C944 PolarHBondContact O-SG 3.5Å; F940-C944 VanDerWaalsContact O-SG 3.39Å; A941-C944 PolarHBondContact O-N 2.92Å; M942-C944 PolarHBondContact O-N 2.83Å; C944-Y946 VanDerWaalsContact C-N 3.34Å; C944-Y946 PolarHBondContact O-N 2.75Å; C944-C947 PolarHBondContact O-N 2.92Å; C944-R948 VanDerWaalsContact O-CB 3.27Å; C944-R948 WeakPolarHBondContact O-CB 3.24Å; C944-R948 PolarHBondContact O-N 2.91Å
945	F	79.5	Confident	75.9	Confident	164 Å²	164	130.1 Å²	130.1	72%	0.719	61%	0.613	S	S	*	*	H	α-helix	trans	-61.1	-42.5	176.5	-111.4	-83.9	0	0	0	112.2	A941 M942 M943 R948 K949	A941-F945 PolarHBondContact O-N 3.23Å; A941-F945 VanDerWaalsContact O-N 3.07Å; M942-F945 PolarHBondContact O-N 2.9Å; M943-F945 VanDerWaalsContact C-N 3.34Å; M943-F945 PolarHBondContact O-N 3.04Å; F945-R948 PolarHBondContact O-N 3.25Å; F945-K949 PolarHBondContact O-N 3.31Å; F945-K949 VanDerWaalsContact O-N 3.07Å
946	Y	80.4	Confident	74	Confident	179 Å²	179	132.9 Å²	132.9	70%	0.702	63%	0.625	S	S	*	*	H	α-helix	trans	-61	-51.8	176.6	-168.8	-89.4	0	0	0	111.8	M942 M943 C944 R948 K949 H950	M942-Y946 PolarHBondContact O-N 2.81Å; M943-Y946 WeakPolarHBondContact O-CB 3.42Å; M943-Y946 PolarHBondContact O-N 2.97Å; C944-Y946 VanDerWaalsContact C-N 3.34Å; C944-Y946 PolarHBondContact O-N 2.75Å; Y946-R948 VanDerWaalsContact C-N 3.33Å; Y946-R948 PolarHBondContact O-N 2.71Å; Y946-K949 PolarHBondContact O-N 3.39Å; Y946-H950 PolarHBondContact O-N 2.88Å; Y946-H950 VanDerWaalsContact O-N 3.13Å
947	C	74.1	Confident	72.1	Confident	65 Å²	65	135.1 Å²	135.1	44%	0.439	64%	0.635	S	S	.	*	H	α-helix	trans	-62.7	-36.5	178.6	-64.5	0	0	0	0	113.1	M943 C944 H950 R951	M943-C947 PolarHBondContact O-N 2.66Å; M943-C947 VanDerWaalsContact O-N 3.08Å; M943-C947 PolarHBondContact O-SG 3.12Å; C944-C947 PolarHBondContact O-N 2.92Å; C947-H950 PolarHBondContact O-N 2.97Å; C947-R951 PolarHBondContact O-N 2.88Å
948	R	74	Confident	70	Confident	187 Å²	187	138.4 Å²	138.4	71%	0.706	65%	0.647	S	S	*	*	H	α-helix	trans	-67.7	-40.3	178.8	-158.4	172.2	-168.2	171.4	3	111.4	C944 F945 Y946 R951 L952	C944-R948 VanDerWaalsContact O-CB 3.27Å; C944-R948 WeakPolarHBondContact O-CB 3.24Å; C944-R948 PolarHBondContact O-N 2.91Å; F945-R948 PolarHBondContact O-N 3.25Å; Y946-R948 VanDerWaalsContact C-N 3.33Å; Y946-R948 PolarHBondContact O-N 2.71Å; R948-R951 PolarHBondContact O-N 3.29Å; R948-L952 WeakPolarHBondContact O-CG 3.44Å; R948-L952 PolarHBondContact O-N 2.89Å
949	K	74.8	Confident	67.6	Low	161 Å²	161	141.1 Å²	141.1	70%	0.7	66%	0.658	S	S	*	*	H	α-helix	trans	-61.4	-41.8	172.9	-168.2	174.7	-177.1	178.1	0	111.7	F945 Y946 L952	F945-K949 PolarHBondContact O-N 3.31Å; F945-K949 VanDerWaalsContact O-N 3.07Å; Y946-K949 PolarHBondContact O-N 3.39Å; K949-L952 PolarHBondContact O-N 3.02Å
950	H	66.1	Low	65.4	Low	118 Å²	118	142 Å²	142	55%	0.546	67%	0.668	S	S	.	*	H	α-helix	trans	-66.6	-44.8	178.3	-162.2	-99.1	0	0	0	113	Y946 C947 L952 N953	Y946-H950 PolarHBondContact O-N 2.88Å; Y946-H950 VanDerWaalsContact O-N 3.13Å; C947-H950 PolarHBondContact O-N 2.97Å; H950-L952 VanDerWaalsContact C-N 3.3Å; H950-L952 PolarHBondContact O-N 3Å; H950-N953 PolarHBondContact O-N 3.3Å
951	R	63.7	Low	63.1	Low	198 Å²	198	143.6 Å²	143.6	75%	0.747	68%	0.682	S	S	*	*	H	α-helix	trans	-63.1	-31.9	177.7	-82.2	-173.8	169.7	-175.3	-2.1	113.6	C947 R948 M954 K955	C947-R951 PolarHBondContact O-N 2.88Å; R948-R951 PolarHBondContact O-N 3.29Å; R951-M954 PolarHBondContact O-N 2.62Å; R951-K955 PolarHBondContact O-N 2.94Å
952	L	60.1	Low	60.8	Low	123 Å²	123	145 Å²	145	64%	0.644	70%	0.701	S	S	*	*	H	α-helix	trans	-69.4	-31.1	179.2	-75.4	167	0	0	0	113.4	R948 K949 H950	R948-L952 WeakPolarHBondContact O-CG 3.44Å; R948-L952 PolarHBondContact O-N 2.89Å; K949-L952 PolarHBondContact O-N 3.02Å; H950-L952 VanDerWaalsContact C-N 3.3Å; H950-L952 PolarHBondContact O-N 3Å
953	N	58.4	Low	58.3	Low	130 Å²	130	145.3 Å²	145.3	70%	0.695	71%	0.706	S	S	*	*	H	α-helix	trans	-71.3	-36.8	174.7	-85.3	-3.8	0	0	0	112.7	H950	H950-N953 PolarHBondContact O-N 3.3Å
954	M	55.9	Low	56.3	Low	142 Å²	142	146.4 Å²	146.4	70%	0.7	72%	0.718	S	S	*	*	H	α-helix	trans	-66.8	-40	179.2	-75.4	-66.3	-169.5	0	0	112.9	R951 K956	R951-M954 PolarHBondContact O-N 2.62Å; M954-K956 PolarHBondContact O-N 2.93Å
955	K	54	Low	54.5	Low	183 Å²	183	149.6 Å²	149.6	80%	0.796	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	6.9	-177.1	-73.4	-160.1	170.6	-162.4	0	115.3	R951	R951-K955 PolarHBondContact O-N 2.94Å
956	K	48.5	Very low	52.5	Low	185 Å²	185	147.7 Å²	147.7	80%	0.804	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	5.1	-176.3	-138	178.3	-175.1	-177.5	0	115	M954	M954-K956 PolarHBondContact O-N 2.93Å
957	K	47.8	Very low	50.4	Low	190 Å²	190	147.3 Å²	147.3	83%	0.826	73%	0.73	S	S	*	*	S	Bend	trans	-111.8	-1.9	-176.4	-81.8	-169.8	171.5	-174	0	116.4
958	Q	43	Very low	48.6	Very low	177 Å²	177	150.8 Å²	150.8	83%	0.827	74%	0.744	S	S	*	*			trans	-134.3	106.4	169.1	-72.3	170.6	-44.8	0	0	104.8
959	M	35.5	Very low	46.9	Very low	175 Å²	175	149.1 Å²	149.1	86%	0.862	75%	0.749	S	S	*	*			cis	54.2	128.7	42.7	-70.9	-161.2	-168.2	0	0	113.7
960	V	40.6	Very low	45.2	Very low	114 Å²	114	144.8 Å²	144.8	69%	0.691	75%	0.75	S	S	*	*			cis	-164.3	158.5	-18.8	99.2	0	0	0	0	109.1
961	N	37.3	Very low	43.9	Very low	161 Å²	161	145.3 Å²	145.3	86%	0.861	76%	0.764	S	S	*	*			trans	66.1	145.3	173.8	-64	-13.5	0	0	0	119.4
962	G	36	Very low	42.6	Very low	78 Å²	78	142.5 Å²	142.5	80%	0.804	76%	0.764	S	S	*	*			trans	141.6	22.4	140.3	0	0	0	0	0	122.5
963	N	33.9	Very low	41.3	Very low	154 Å²	154	142.8 Å²	142.8	82%	0.824	77%	0.77	S	S	*	*			trans	-76.6	141.2	175.9	-81	12.2	0	0	0	113.9
964	V	40.4	Very low	40.3	Very low	136 Å²	136	144.6 Å²	144.6	82%	0.824	77%	0.772	S	S	*	*			trans	-145.4	107.3	144.9	-179.7	0	0	0	0	104.8
965	D	40.7	Very low	39.4	Very low	121 Å²	121	148.1 Å²	148.1	65%	0.647	78%	0.778	S	S	*	*				74.2	139.3	70.9	-80.5	8.7	0	0	0	113.5
966	L	37.9	Very low	38.5	Very low	124 Å²	124	146 Å²	146	65%	0.649	77%	0.774	S	S	*	*			cis	-161.4	168.4	-1.9	-126.1	176.2	0	0	0	110.7
967	K	36.8	Very low	37.8	Very low	172 Å²	172	147 Å²	147	75%	0.748	77%	0.772	S	S	*	*			trans	73.6	151.9	162.5	-65.5	164.1	-175.3	166.8	0	115.3
968	L	35.2	Very low	37.1	Very low	137 Å²	137	144 Å²	144	72%	0.717	76%	0.761	S	S	*	*			cis	-148.8	-170.1	-3.6	-123	168.5	0	0	0	112.4
969	N	38.2	Very low	36.6	Very low	152 Å²	152	142.5 Å²	142.5	81%	0.813	76%	0.757	S	S	*	*			trans	-67.5	167.5	-174.5	-59	-12.4	0	0	0	115.9
970	G	38.5	Very low	36.5	Very low	70 Å²	70	139.7 Å²	139.7	72%	0.722	76%	0.755	S	S	*	*			cis	146.2	129.5	-4.1	0	0	0	0	0	112.6
971	P	40.5	Very low	36.1	Very low	129 Å²	129	138.6 Å²	138.6	84%	0.838	76%	0.758	S	S	*	*			trans	-102.1	173.6	-171.8	40.1	-36.8	0	0	0	114.1
972	D	36.3	Very low	36.1	Very low	140 Å²	140	136 Å²	136	75%	0.749	75%	0.75	S	S	*	*			trans	-146.4	143.9	161.3	-138.5	-26.9	0	0	0	114.2
973	V	31.4	Very low	35.8	Very low	129 Å²	129	138.9 Å²	138.9	78%	0.782	75%	0.745	S	S	*	*			trans	-154.6	119	-177.8	174.2	0	0	0	0	109.8
974	K	38.1	Very low	35.9	Very low	168 Å²	168	142.2 Å²	142.2	73%	0.73	75%	0.748	S	S	*	*			trans	177.1	146.8	178.2	-99.9	136	-163.4	162.5	0	108.8
975	R	37.2	Very low	35.9	Very low	216 Å²	216	140.1 Å²	140.1	82%	0.815	74%	0.739	S	S	*	*			cis	-140.3	150.9	-7.7	-62	-172.6	-166.4	-171.1	3.3	105.7
976	I	34.2	Very low	35.8	Very low	139 Å²	139	141.5 Å²	141.5	71%	0.713	75%	0.746	S	S	*	*				69.9	111	51.6	-63.2	177.7	0	0	0	113.7
977	R	34.2	Very low	35.9	Very low	205 Å²	205	143.7 Å²	143.7	77%	0.774	75%	0.753	S	S	*	*			trans	72.4	150.5	160.6	-68.9	165.1	-179.4	-119.7	7.1	116.9
978	E	34.1	Very low	36	Very low	128 Å²	128	142.5 Å²	142.5	60%	0.598	76%	0.755	S	S	*	*			cis	-159.7	147.7	3.5	-123	149.9	-153.6	0	0	113.1
979	I	32.6	Very low	36.1	Very low	145 Å²	145	143.1 Å²	143.1	74%	0.744	76%	0.756	S	S	*	*			trans	58.6	135.5	143.6	-67.9	165.7	0	0	0	122.7
980	S	33.3	Very low	36	Very low	116 Å²	116	144 Å²	144	81%	0.811	76%	0.76	S	S	*	*			trans	78.8	150.7	154.8	69.6	0	0	0	0	121.1
981	A	30.7	Very low	36	Very low	91 Å²	91	145 Å²	145	75%	0.752	76%	0.761	S	S	*	*			trans	-134.3	-176.5	178.5	0	0	0	0	0	107.8
982	P	37.5	Very low	36	Very low	107 Å²	107	142.8 Å²	142.8	70%	0.695	75%	0.754	S	S	*	*			cis	-138	-160.4	0	33.7	-9.4	0	0	0	113.8
983	I	30.9	Very low	36.1	Very low	137 Å²	137	142.9 Å²	142.9	70%	0.703	76%	0.755	S	S	*	*			trans	82.3	117.8	155.7	-63.7	164.9	0	0	0	119.3
984	Y	36.3	Very low	36.4	Very low	224 Å²	224	143.7 Å²	143.7	88%	0.878	75%	0.754	S	S	*	*			trans	54.7	149.7	159	-70.3	-48.5	0	0	0	120.1
985	S	38.8	Very low	36.3	Very low	92 Å²	92	138.6 Å²	138.6	64%	0.643	75%	0.749	S	S	*	*			cis	-160.9	152.9	-8.8	48.2	0	0	0	0	111
986	D	39.9	Very low	36.4	Very low	150 Å²	150	134.9 Å²	134.9	80%	0.802	75%	0.75	S	S	*	*			trans	27.4	136.7	149.1	-55.6	-12.1	0	0	0	122.1
987	Q	40.3	Very low	36.6	Very low	170 Å²	170	133.4 Å²	133.4	79%	0.794	74%	0.744	S	S	*	*				-173.1	155.1	101.9	-104.8	-173.2	16.5	0	0	115.5
988	L	37.4	Very low	36.6	Very low	148 Å²	148	133 Å²	133	78%	0.775	74%	0.742	S	S	*	*			trans	69.7	139.9	158.7	-62.8	147	0	0	0	119.1
989	M	38	Very low	36.8	Very low	150 Å²	150	133.4 Å²	133.4	74%	0.739	75%	0.749	S	S	*	*			cis	-175.4	142.2	-32.8	-119.2	-69.8	-173.1	0	0	108.8
990	N	35.3	Very low	36.8	Very low	170 Å²	170	132.4 Å²	132.4	91%	0.909	75%	0.749	S	S	*	*			trans	-169.4	131.8	145.8	-101.4	-25.4	0	0	0	109.1
991	A	39.3	Very low	36.7	Very low	90 Å²	90	131.4 Å²	131.4	74%	0.744	75%	0.748	S	S	*	*			trans	-123	164.6	-177.5	0	0	0	0	0	109.5
992	A	39.4	Very low	36.7	Very low	84 Å²	84	133 Å²	133	69%	0.694	75%	0.754	S	S	*	*			cis	-147.8	-164.7	2.7	0	0	0	0	0	107.8
993	N	38.7	Very low	36.4	Very low	142 Å²	142	132.1 Å²	132.1	76%	0.759	75%	0.75	S	S	*	*			cis	-166.8	176.4	3.7	-133.3	-2.1	0	0	0	106.7
994	L	37.8	Very low	36.4	Very low	146 Å²	146	134.1 Å²	134.1	76%	0.764	75%	0.754	S	S	*	*			cis	-160.5	149.6	-3.6	-149.5	176.4	0	0	0	106.6
995	G	37	Very low	36.2	Very low	61 Å²	61	130.1 Å²	130.1	63%	0.629	75%	0.747	S	S	*	*			trans	96.8	103.1	169.3	0	0	0	0	0	114
996	V	38.3	Very low	35.7	Very low	137 Å²	137	131.8 Å²	131.8	83%	0.83	76%	0.759	S	S	*	*				78.4	119.9	55.6	-179.8	0	0	0	0	111.1
997	D	38.5	Very low	35.3	Very low	109 Å²	109	128.1 Å²	128.1	58%	0.583	76%	0.757	S	S	*	*			cis	-150.3	166.3	6.5	-148.5	-1.4	0	0	0	114.3
998	R	34.8	Very low	34.7	Very low	196 Å²	196	125.8 Å²	125.8	74%	0.74	75%	0.754	S	S	*	*			trans	24.8	128.8	149.8	-79.5	165.4	-177.1	134.7	-11.1	120.6
999	N	37.4	Very low	34.1	Very low	137 Å²	137	127.2 Å²	127.2	73%	0.733	75%	0.754	S	S	*	*				-175.5	148.5	60.3	-107.8	-20.7	0	0	0	115.4
1000	T	34.1	Very low	33.6	Very low	124 Å²	124	125.9 Å²	125.9	76%	0.761	75%	0.754	S	S	*	*			trans	45.8	109.5	149.1	57	0	0	0	0	124.4
1001	A	30.2	Very low	33.2	Very low	95 Å²	95	127.8 Å²	127.8	79%	0.785	76%	0.755	S	S	*	*				85.5	123.7	121.5	0	0	0	0	0	123.8
1002	S	31	Very low	32.8	Very low	125 Å²	125	128.2 Å²	128.2	87%	0.874	75%	0.752	S	S	*	*			trans	68.8	143.8	144.3	-123.6	0	0	0	0	120
1003	S	31.1	Very low	32.4	Very low	87 Å²	87	129.6 Å²	129.6	61%	0.608	75%	0.748	S	S	*	*			cis	-169.8	128.2	-20.9	156.5	0	0	0	0	111
1004	K	31.3	Very low	32.1	Very low	179 Å²	179	132.9 Å²	132.9	78%	0.778	75%	0.752	S	S	*	*			trans	70.2	154.7	148.8	-76.5	-175.6	178	-172	0	122.8
1005	D	32.2	Very low	31.8	Very low	140 Å²	140	131.2 Å²	131.2	75%	0.749	75%	0.75	S	S	*	*			trans	60.6	73.6	147	-53.7	-15.6	0	0	0	120.2	G1007	D1005-G1007 VanDerWaalsContact C-N 3.27Å; D1005-G1007 PolarHBondContact O-N 2.87Å
1006	S	28.3	Very low	31.5	Very low	127 Å²	127	139 Å²	139	89%	0.888	76%	0.761	S	S	*	*			trans	-71.1	78.1	154.3	56.8	0	0	0	0	111.4
1007	G	31.2	Very low	31.2	Very low	73 Å²	73	140.3 Å²	140.3	75%	0.753	76%	0.764	S	S	*	*			trans	-75.3	166.2	173.7	0	0	0	0	0	113.8	D1005	D1005-G1007 VanDerWaalsContact C-N 3.27Å; D1005-G1007 PolarHBondContact O-N 2.87Å
1008	V	26.7	Very low	30.7	Very low	121 Å²	121	138 Å²	138	73%	0.733	77%	0.766	S	S	*	*			trans	-120.6	155.2	-172.9	-169.9	0	0	0	0	110.7
1009	F	25.5	Very low	30.6	Very low	179 Å²	179	139.6 Å²	139.6	79%	0.785	77%	0.773	S	S	*	*			trans	110	130.4	159	-71.1	-80.8	0	0	0	119.6
1010	T	28	Very low	30.3	Very low	121 Å²	121	139.3 Å²	139.3	74%	0.742	78%	0.776	S	S	*	*			trans	51.5	107.4	149.3	50.7	0	0	0	0	120.2
1011	F	26	Very low	30.4	Very low	211 Å²	211	139.3 Å²	139.3	93%	0.925	78%	0.779	S	S	*	*			trans	-67.6	143.9	139.5	-75.5	-99.8	0	0	0	110
1012	S	31.7	Very low	30.4	Very low	98 Å²	98	142.8 Å²	142.8	69%	0.685	78%	0.779	S	S	*	*			trans	-135.9	135.9	165.2	47.6	0	0	0	0	109.6
1013	N	31	Very low	30.5	Very low	114 Å²	114	144.2 Å²	144.2	61%	0.61	77%	0.774	S	S	*	*			trans	-77.4	142.6	-177.5	-65.1	-8	0	0	0	110.9
1014	Y	31.3	Very low	30.5	Very low	211 Å²	211	147 Å²	147	83%	0.827	78%	0.781	S	S	*	*			trans	-128	126.2	154.5	-94.1	-83.4	0	0	0	108.9
1015	P	33.1	Very low	30.4	Very low	111 Å²	111	141.7 Å²	141.7	72%	0.721	78%	0.778	S	S	*	*			trans	-87	164.5	-178.5	35.8	-35.6	0	0	0	112.5
1016	Y	29.6	Very low	30.5	Very low	224 Å²	224	144 Å²	144	88%	0.878	78%	0.784	S	S	*	*			trans	10.8	122.9	152.9	-85.2	-100.8	0	0	0	118.5
1017	D	33.3	Very low	30.7	Very low	165 Å²	165	142.2 Å²	142.2	88%	0.882	78%	0.777	S	S	*	*				-142.9	148.6	121.6	-132	-23.5	0	0	0	110.9
1018	G	27.4	Very low	30.9	Very low	60 Å²	60	149.8 Å²	149.8	62%	0.619	78%	0.784	S	S	*	*			trans	-106.9	135	-172	0	0	0	0	0	113
1019	Y	32.6	Very low	31	Very low	229 Å²	229	149.2 Å²	149.2	90%	0.898	79%	0.786	S	S	*	*			trans	-116.9	104.8	173.8	-108	-94.2	0	0	0	112.1
1020	T	31.9	Very low	31.5	Very low	131 Å²	131	150.5 Å²	150.5	80%	0.804	79%	0.794	S	S	*	*			trans	-91.1	119.2	160.9	47.7	0	0	0	0	109.6
1021	P	34.8	Very low	31.7	Very low	125 Å²	125	148.5 Å²	148.5	81%	0.812	80%	0.798	S	S	*	*			trans	-95.2	101.7	171.9	33.6	-28.5	0	0	0	111.1
1022	E	30.5	Very low	32.2	Very low	167 Å²	167	143.5 Å²	143.5	78%	0.78	80%	0.796	S	S	*	*			trans	-123.8	147.2	163.1	-85.3	-157.7	149.6	0	0	110.9
1023	M	32.4	Very low	32.4	Very low	156 Å²	156	145.2 Å²	145.2	77%	0.768	80%	0.802	S	S	*	*			trans	69.7	140	172.7	-52.1	-160.4	-167.1	0	0	116.9
1024	N	33	Very low	32.6	Very low	144 Å²	144	147.7 Å²	147.7	77%	0.77	81%	0.814	S	S	*	*			cis	-164.5	147.5	-13.5	-112.5	-28.9	0	0	0	111.6
1025	G	29	Very low	32.8	Very low	69 Å²	69	143 Å²	143	71%	0.711	81%	0.809	S	S	*	*			trans	75.1	142.3	165.5	0	0	0	0	0	115.7
1026	H	33.7	Very low	32.7	Very low	188 Å²	188	149.3 Å²	149.3	87%	0.87	82%	0.819	S	S	*	*			cis	-138.5	147.1	25.6	-97.6	-98.5	0	0	0	112.7
1027	A	31.5	Very low	32.9	Very low	89 Å²	89	144.5 Å²	144.5	74%	0.736	82%	0.815	S	S	*	*			trans	-95.7	128.4	170.9	0	0	0	0	0	111.7
1028	Y	36	Very low	33	Very low	232 Å²	232	141.3 Å²	141.3	91%	0.91	81%	0.812	S	S	*	*			trans	-143	129.6	151	-92.5	-78.5	0	0	0	107.1
1029	S	29.7	Very low	33.3	Very low	110 Å²	110	143.5 Å²	143.5	77%	0.769	82%	0.818	S	S	*	*			trans	-140.1	113.3	-170.4	57	0	0	0	0	111.1
1030	E	34.7	Very low	33.4	Very low	205 Å²	205	142.6 Å²	142.6	96%	0.958	81%	0.814	S	S	*	*			trans	-157.8	132.7	165.4	-127.9	169.8	-140.9	0	0	112.1
1031	G	32.3	Very low	33.5	Very low	79 Å²	79	143.2 Å²	143.2	81%	0.814	81%	0.812	S	S	*	*			trans	75.9	71	146.8	0	0	0	0	0	121.4
1032	A	36.6	Very low	33.5	Very low	107 Å²	107	144.6 Å²	144.6	88%	0.884	81%	0.813	S	S	*	*			trans	-158.7	110.1	144.7	0	0	0	0	0	111.9
1033	T	35.8	Very low	33.7	Very low	134 Å²	134	142.8 Å²	142.8	82%	0.822	81%	0.814	S	S	*	*			trans	-108.6	149	178.2	48.4	0	0	0	0	112.2
1034	L	34.9	Very low	33.9	Very low	166 Å²	166	141.8 Å²	141.8	87%	0.869	81%	0.812	S	S	*	*			trans	178.8	154.3	133.1	-91.6	168.7	0	0	0	108.3
1035	P	35.5	Very low	33.9	Very low	111 Å²	111	140.6 Å²	140.6	72%	0.721	80%	0.801	S	S	*	*				-131.1	168	-120	39.8	-24.9	0	0	0	116.8
1036	R	31.5	Very low	34	Very low	244 Å²	244	147.8 Å²	147.8	92%	0.921	81%	0.807	S	S	*	*			trans	-119.6	157.5	150.3	-104.1	-172.2	169.5	-177.7	-2.6	109.7
1037	P	34	Very low	34	Very low	124 Å²	124	143.6 Å²	143.6	81%	0.805	81%	0.805	S	S	*	*			trans	-90.3	158.1	-152.2	34.5	-37.4	0	0	0	114.8
1038	A	35.4	Very low	34.2	Very low	98 Å²	98	144.2 Å²	144.2	81%	0.81	80%	0.804	S	S	*	*			trans	-127	150.3	162.3	0	0	0	0	0	109.8
1039	S	33.9	Very low	34.3	Very low	106 Å²	106	139.3 Å²	139.3	74%	0.741	80%	0.804	S	S	*	*			trans	-42.8	146.1	179.5	52.7	0	0	0	0	116.8
1040	Y	34.8	Very low	34.6	Very low	209 Å²	209	137.7 Å²	137.7	82%	0.82	80%	0.804	S	S	*	*				-153.8	150.3	128	-125.9	-88.4	0	0	0	111.1
1041	D	34	Very low	34.5	Very low	144 Å²	144	134.5 Å²	134.5	77%	0.77	80%	0.803	S	S	*	*			trans	33.1	113.8	173.6	-61.6	-18.7	0	0	0	121
1042	D	35.3	Very low	34.5	Very low	154 Å²	154	141.7 Å²	141.7	82%	0.824	81%	0.805	S	S	*	*			trans	-136.5	164.2	140.3	-161.4	-7	0	0	0	107.5
1043	T	34.8	Very low	34.5	Very low	130 Å²	130	145 Å²	145	80%	0.798	81%	0.806	S	S	*	*			trans	69.4	81.2	-176.3	67.4	0	0	0	0	117.2
1044	D	34.7	Very low	34.3	Very low	135 Å²	135	143.8 Å²	143.8	72%	0.722	80%	0.803	S	S	*	*			trans	-86.2	154.4	143.5	-174.9	23.2	0	0	0	108.9
1045	Q	33.4	Very low	34.3	Very low	119 Å²	119	139.5 Å²	139.5	56%	0.556	80%	0.799	S	S	*	*			trans	61.5	122	172.2	-65.4	161.3	54.6	0	0	116.7
1046	W	32.3	Very low	34.4	Very low	220 Å²	220	141.3 Å²	141.3	83%	0.833	80%	0.803	S	S	*	*			cis	-160.9	149.4	13.2	-86.8	-60.7	0	0	0	112.1
1047	A	34	Very low	34.7	Very low	99 Å²	99	136 Å²	136	82%	0.818	79%	0.792	S	S	*	*			trans	63.3	157.3	150.9	0	0	0	0	0	120.5
1048	S	34.5	Very low	34.8	Very low	102 Å²	102	136.4 Å²	136.4	71%	0.713	79%	0.787	S	S	*	*			cis	-166.5	160.2	-32.6	59.3	0	0	0	0	110.8
1049	S	38.5	Very low	34.9	Very low	130 Å²	130	138.7 Å²	138.7	91%	0.909	79%	0.786	S	S	*	*			trans	64.9	157.6	-179.3	78.4	0	0	0	0	116
1050	G	35	Very low	35	Very low	75 Å²	75	137.8 Å²	137.8	77%	0.773	78%	0.78	S	S	*	*			cis	151.5	146.4	-1.1	0	0	0	0	0	109.3
1051	C	33.5	Very low	35.2	Very low	138 Å²	138	136 Å²	136	93%	0.932	78%	0.784	S	S	*	*			cis	-156	176	1.7	-160.2	0	0	0	0	110.9
1052	R	31.2	Very low	35.2	Very low	230 Å²	230	132.7 Å²	132.7	87%	0.868	78%	0.784	S	S	*	*			trans	-105.8	149.6	179	-68.5	178.1	174.1	177.5	-2.2	113.5
1053	I	36.7	Very low	35.2	Very low	177 Å²	177	132.2 Å²	132.2	91%	0.908	79%	0.787	S	S	*	*			trans	-145.5	156.4	149.7	-50.9	-178.8	0	0	0	108.8
1054	S	32.7	Very low	35	Very low	109 Å²	109	133.9 Å²	133.9	76%	0.762	79%	0.789	S	S	*	*				167.9	89.3	-73.5	179.5	0	0	0	0	112.8
1055	G	34.9	Very low	35	Very low	76 Å²	76	133.2 Å²	133.2	78%	0.784	79%	0.794	S	S	*	*			trans	101.2	172.1	160.4	0	0	0	0	0	118.1
1056	N	38	Very low	35.1	Very low	149 Å²	149	132.8 Å²	132.8	80%	0.797	80%	0.804	S	S	*	*			cis	-167.1	177.2	-14.6	-158.7	4.6	0	0	0	111.3
1057	L	37.4	Very low	35	Very low	131 Å²	131	129.7 Å²	129.7	69%	0.686	80%	0.804	S	S	*	*			trans	95.6	110	157.3	-59.3	163.3	0	0	0	121.4
1058	N	36.5	Very low	35.5	Very low	133 Å²	133	129.8 Å²	129.8	71%	0.711	80%	0.796	S	S	*	*				64.5	108	122.9	-60.1	11.8	0	0	0	123.1
1059	N	37.2	Very low	35.6	Very low	147 Å²	147	131.4 Å²	131.4	79%	0.786	80%	0.801	S	S	*	*				176.8	114.6	101.3	-99.6	9.6	0	0	0	109.2
1060	S	35	Very low	35.3	Very low	86 Å²	86	133.3 Å²	133.3	60%	0.601	80%	0.796	S	S	*	*				81.6	92.5	80.1	76	0	0	0	0	114.3
1061	D	39.7	Very low	35.3	Very low	172 Å²	172	137.7 Å²	137.7	92%	0.92	80%	0.8	S	S	*	*				-179.2	160.6	121.4	-85.4	-13.4	0	0	0	109.2
1062	G	33.9	Very low	35.2	Very low	75 Å²	75	140.3 Å²	140.3	77%	0.773	80%	0.796	S	S	*	*			trans	-155.1	157.3	-169.5	0	0	0	0	0	116.2
1063	V	35.1	Very low	35.7	Very low	144 Å²	144	134.9 Å²	134.9	87%	0.873	79%	0.791	S	S	*	*			trans	-143.4	140.7	177.3	-179.6	0	0	0	0	109
1064	I	31.2	Very low	35.6	Very low	164 Å²	164	131.1 Å²	131.1	84%	0.841	79%	0.786	S	S	*	*			trans	-139.1	122.5	177.4	-61.7	176.9	0	0	0	109.7
1065	C	34.5	Very low	35.7	Very low	122 Å²	122	130.5 Å²	130.5	82%	0.824	79%	0.788	S	S	*	*			trans	-175.6	159.9	167.6	-93.7	0	0	0	0	109
1066	S	34.7	Very low	35.6	Very low	109 Å²	109	131.5 Å²	131.5	76%	0.762	79%	0.788	S	S	*	*			cis	-168.8	136.1	-19	50.3	0	0	0	0	111
1067	D	31.2	Very low	35.3	Very low	156 Å²	156	132.3 Å²	132.3	83%	0.834	79%	0.792	S	S	*	*			trans	-80.6	-176.4	166.2	-121.2	-30.8	0	0	0	111.2
1068	P	44.6	Very low	34.9	Very low	101 Å²	101	131.1 Å²	131.1	66%	0.656	80%	0.801	S	S	*	*			cis	-136.8	-159.9	-18.5	38.5	-18.3	0	0	0	113
1069	V	37.2	Very low	34.6	Very low	136 Å²	136	128.1 Å²	128.1	82%	0.824	80%	0.801	S	S	*	*				165.7	149.8	126.7	155.6	0	0	0	0	113.5
1070	Q	31.6	Very low	34.3	Very low	169 Å²	169	128.4 Å²	128.4	79%	0.79	80%	0.802	S	S	*	*			trans	-113.7	161.8	171.8	-59.4	-175.8	5.1	0	0	112.6
1071	L	34.7	Very low	34	Very low	167 Å²	167	133.7 Å²	133.7	87%	0.874	81%	0.81	S	S	*	*				176	175.7	120.1	-93.6	161.5	0	0	0	114.5
1072	K	31.7	Very low	33.7	Very low	193 Å²	193	132.7 Å²	132.7	84%	0.839	81%	0.805	S	S	*	*			trans	-103.9	-170.6	-173.5	-58.1	179.5	176.4	178.3	0	112
1073	P	40.4	Very low	33.5	Very low	117 Å²	117	136.3 Å²	136.3	76%	0.76	80%	0.801	S	S	*	*				-134.5	-176.4	-72.3	42	-25.9	0	0	0	114.7
1074	A	34.9	Very low	33.5	Very low	98 Å²	98	138.3 Å²	138.3	81%	0.81	80%	0.801	S	S	*	*			trans	89.1	144.5	146.5	0	0	0	0	0	122.5
1075	A	35.2	Very low	33.4	Very low	96 Å²	96	136.2 Å²	136.2	79%	0.793	79%	0.791	S	S	*	*			trans	80.1	95.8	152.8	0	0	0	0	0	122.4
1076	A	33.4	Very low	33.3	Very low	97 Å²	97	138.4 Å²	138.4	80%	0.802	79%	0.794	S	S	*	*				92.2	147.9	121	0	0	0	0	0	122.8
1077	L	31.9	Very low	33.1	Very low	166 Å²	166	138.6 Å²	138.6	87%	0.869	79%	0.79	S	S	*	*			trans	73.9	82.9	160.8	-65.9	163.9	0	0	0	120.6
1078	A	29.1	Very low	32.9	Very low	105 Å²	105	138.1 Å²	138.1	87%	0.868	79%	0.788	S	S	*	*				38.1	127.5	121.9	0	0	0	0	0	121.8
1079	G	30	Very low	32.2	Very low	70 Å²	70	141 Å²	141	72%	0.722	79%	0.794	S	S	*	*			trans	-178.5	90.2	164.5	0	0	0	0	0	117.9
1080	L	30.4	Very low	31.8	Very low	154 Å²	154	140.4 Å²	140.4	81%	0.806	79%	0.786	S	S	*	*			trans	59.8	124.7	139.7	-58.4	164.2	0	0	0	122.2
1081	Y	29.7	Very low	31.7	Very low	196 Å²	196	137 Å²	137	77%	0.769	78%	0.779	S	S	*	*			trans	48.8	122.6	140.5	-72.2	-100.9	0	0	0	120.1
1082	N	32.2	Very low	31.4	Very low	151 Å²	151	132.9 Å²	132.9	81%	0.807	77%	0.769	S	S	*	*				-164.3	160.8	65.1	-99.6	-39.8	0	0	0	113.8
1083	H	30.3	Very low	31.2	Very low	152 Å²	152	127.8 Å²	127.8	70%	0.704	77%	0.771	S	S	*	*			trans	-77.1	153.5	167.2	-93.2	-120.3	0	0	0	112.2	D1085	H1083-D1085 IonicContact CE1-OD2 2.66Å; H1083-D1085 IonicContact CG-OD2 2.62Å; H1083-D1085 IonicContact ND1-OD2 3.78Å; H1083-D1085 PolarHBondContact ND1-OD2 2.89Å
1084	H	34	Very low	30.5	Very low	186 Å²	186	125.3 Å²	125.3	86%	0.861	77%	0.767	S	S	*	*			trans	-144.6	92.6	147.7	-113.8	-64.6	0	0	0	109.6
1085	D	30.5	Very low	30	Very low	120 Å²	120	124.8 Å²	124.8	64%	0.642	76%	0.758	S	S	*	*			trans	-73	136	165.5	-64.4	-87.7	0	0	0	109.7	H1083	H1083-D1085 IonicContact CE1-OD2 2.66Å; H1083-D1085 IonicContact CG-OD2 2.62Å; H1083-D1085 IonicContact ND1-OD2 3.78Å; H1083-D1085 PolarHBondContact ND1-OD2 2.89Å
1086	L	31	Very low	29.6	Very low	168 Å²	168	127.6 Å²	127.6	88%	0.88	76%	0.758	S	S	*	*			trans	-147.1	110.9	159.5	-113	170.5	0	0	0	108.7
1087	V	30.1	Very low	29.4	Very low	112 Å²	112	134.5 Å²	134.5	68%	0.679	77%	0.765	S	S	*	*			trans	-82	133.2	178.7	173.8	0	0	0	0	109.3	M1089	V1087-M1089 HydrophobicContact CG1-CB 4.24Å; V1087-M1089 HydrophobicContact CG1-CG 3.9Å
1088	D	28.7	Very low	29.1	Very low	147 Å²	147	129.3 Å²	129.3	79%	0.786	75%	0.747	S	S	*	*			trans	-131.6	72.9	163	-154.4	-9.8	0	0	0	109.9	N1090	D1088-N1090 PolarHBondContact O-N 2.92Å
1089	M	29.4	Very low	29.2	Very low	160 Å²	160	129.5 Å²	129.5	79%	0.788	74%	0.741	S	S	*	*			trans	-77.9	102.9	169.4	-77.8	-169.6	-175.4	0	0	108.8	V1087 P1091	V1087-M1089 HydrophobicContact CG1-CB 4.24Å; V1087-M1089 HydrophobicContact CG1-CG 3.9Å; M1089-P1091 VanDerWaalsContact C-CD 3.46Å; M1089-P1091 WeakPolarHBondContact O-CD 3.49Å
1090	N	28.7	Very low	29.1	Very low	124 Å²	124	136.3 Å²	136.3	66%	0.663	75%	0.745	S	S	*	*			trans	-113.3	80.8	177.9	-166	-4.2	0	0	0	111.8	D1088 A1092	D1088-N1090 PolarHBondContact O-N 2.92Å; N1090-A1092 VanDerWaalsContact C-N 3.25Å; N1090-A1092 PolarHBondContact O-N 3.16Å
1091	P	30.4	Very low	29	Very low	99 Å²	99	136.5 Å²	136.5	64%	0.643	74%	0.742	S	S	*	*			trans	-82.7	58.5	-177.1	35.8	-37.8	0	0	0	112.2	M1089	M1089-P1091 VanDerWaalsContact C-CD 3.46Å; M1089-P1091 WeakPolarHBondContact O-CD 3.49Å
1092	A	27.5	Very low	28.9	Very low	79 Å²	79	130.7 Å²	130.7	65%	0.653	74%	0.742	S	S	*	*			trans	-149	124.5	-179.1	0	0	0	0	0	114.4	N1090	N1090-A1092 VanDerWaalsContact C-N 3.25Å; N1090-A1092 PolarHBondContact O-N 3.16Å
1093	G	27.1	Very low	28.7	Very low	87 Å²	87	128.8 Å²	128.8	90%	0.897	74%	0.74	S	S	*	*			trans	92.6	132.8	168.2	0	0	0	0	0	114.9
1094	G	25.6	Very low	28.8	Very low	65 Å²	65	127.4 Å²	127.4	67%	0.67	74%	0.742	S	S	*	*			cis	-177.7	142.1	-7	0	0	0	0	0	113.4	L1096	G1094-L1096 PolarHBondContact O-N 3.42Å
1095	S	24.4	Very low	28.4	Very low	87 Å²	87	127.6 Å²	127.6	61%	0.608	74%	0.743	S	S	*	*			trans	-71.6	107.5	169.1	61.7	0	0	0	0	110.3	K518	K518-S1095 PolarHBondContact NZ-OG 3.15Å
1096	L	26.3	Very low	28.4	Very low	154 Å²	154	126.6 Å²	126.6	81%	0.806	75%	0.746	S	S	*	*			trans	-103.7	75	174.5	-97.8	164.9	0	0	0	111.7	G1094 A1098	G1094-L1096 PolarHBondContact O-N 3.42Å; L1096-A1098 HydrophobicContact CD2-CB 4.17Å; L1096-A1098 PolarHBondContact O-N 3.36Å
1097	Y	29.8	Very low	28.4	Very low	242 Å²	242	120.9 Å²	120.9	95%	0.949	73%	0.727	S	S	*	*			trans	-75.1	74.8	155	-109.9	-79.4	0	0	0	109
1098	A	25.9	Very low	28.3	Very low	58 Å²	58	125.4 Å²	125.4	48%	0.479	73%	0.734	S	S	.	*			trans	-159.7	119	164.9	0	0	0	0	0	106.2	L1096	L1096-A1098 HydrophobicContact CD2-CB 4.17Å; L1096-A1098 PolarHBondContact O-N 3.36Å
1099	S	31.4	Very low	28.6	Very low	108 Å²	108	122.3 Å²	122.3	76%	0.755	72%	0.723	S	S	*	*			cis	67.4	142.6	37.2	104.6	0	0	0	0	113.6
1100	R	27.5	Very low	29	Very low	213 Å²	213	120.4 Å²	120.4	80%	0.804	72%	0.721	S	S	*	*			trans	85.5	147.1	168	-130.4	174.8	-175.6	-146.4	11.8	117.4
1101	E	28.8	Very low	29.3	Very low	159 Å²	159	120.8 Å²	120.8	74%	0.743	73%	0.73	S	S	*	*			trans	62.1	125.9	166.8	-70.7	146	-128.7	0	0	116.6
1102	G	27.5	Very low	29.6	Very low	74 Å²	74	120.8 Å²	120.8	76%	0.763	73%	0.733	S	S	*	*			cis	174.5	177.9	-3	0	0	0	0	0	109
1103	S	27.8	Very low	29.7	Very low	110 Å²	110	121.5 Å²	121.5	77%	0.769	72%	0.723	S	S	*	*			cis	-173.3	-167.8	-10.4	54.5	0	0	0	0	106.7
1104	V	31.7	Very low	30	Very low	123 Å²	123	126.6 Å²	126.6	75%	0.745	72%	0.72	S	S	*	*			trans	64.4	82.3	174.6	-167.9	0	0	0	0	114
1105	H	26.7	Very low	30.4	Very low	190 Å²	190	134.4 Å²	134.4	88%	0.88	73%	0.729	S	S	*	*				50.7	94.4	69.8	-82.1	-68	0	0	0	117.3
1106	S	30.9	Very low	30.8	Very low	100 Å²	100	135.7 Å²	135.7	70%	0.699	73%	0.733	S	S	*	*			trans	-157	128.2	135.7	49.7	0	0	0	0	108.9	Q1113	S1106-Q1113 PolarHBondContact O-NE2 2.71Å
1107	G	29.6	Very low	31.1	Very low	48 Å²	48	135.7 Å²	135.7	50%	0.495	73%	0.732	S	S	.	*				67.5	103.4	73.9	0	0	0	0	0	108.7
1108	Y	29.6	Very low	30.9	Very low	206 Å²	206	133.5 Å²	133.5	81%	0.808	72%	0.722	S	S	*	*			cis	-129.2	156.8	42.5	-82.9	-101.3	0	0	0	116.5	Q1113	Y1108-Q1113 WeakPolarHBondContact O-CG 3.48Å; Y1108-Q1113 PolarHBondContact O-OE1 2.83Å
1109	S	34.9	Very low	31	Very low	82 Å²	82	137 Å²	137	57%	0.573	73%	0.729	S	S	*	*			trans	58.4	96	154.5	60.8	0	0	0	0	117.3
1110	T	37.4	Very low	31	Very low	121 Å²	121	138.6 Å²	138.6	74%	0.742	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn		25.9	120.6	114.2	54.8	0	0	0	0	117.5
1111	P	35.4	Very low	31.1	Very low	131 Å²	131	135.5 Å²	135.5	85%	0.851	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	cis	-132.1	96.2	-14.5	28.1	-5.5	0	0	0	112.7
1112	S	36.9	Very low	31.4	Very low	100 Å²	100	138.1 Å²	138.1	70%	0.699	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	cis	-164.1	122.3	-11.1	15.5	0	0	0	0	112.9
1113	Q	28.4	Very low	31.6	Very low	94 Å²	94	141.3 Å²	141.3	44%	0.439	75%	0.751	S	S	.	*			trans	54.2	97.6	152.8	-63.4	-167.3	-114.3	0	0	124.3	S1106 Y1108	S1106-Q1113 PolarHBondContact O-NE2 2.71Å; Y1108-Q1113 WeakPolarHBondContact O-CG 3.48Å; Y1108-Q1113 PolarHBondContact O-OE1 2.83Å
1114	K	32.7	Very low	31.8	Very low	194 Å²	194	142.9 Å²	142.9	84%	0.843	75%	0.75	S	S	*	*				41.3	126.7	117.1	-69.5	179.7	177	172.7	0	124.7
1115	R	35.2	Very low	31.8	Very low	229 Å²	229	144.1 Å²	144.1	86%	0.864	75%	0.75	S	S	*	*				85.1	119.3	124.9	-86.3	-157	165.5	176.7	-4.5	125.1
1116	V	32.3	Very low	32.1	Very low	114 Å²	114	141.4 Å²	141.4	69%	0.691	74%	0.743	S	S	*	*				80.5	107.3	117.8	173.4	0	0	0	0	123.3
1117	I	31.9	Very low	32.1	Very low	153 Å²	153	143.9 Å²	143.9	79%	0.785	75%	0.745	S	S	*	*				7.4	130.5	128.7	-51.2	162.6	0	0	0	119.6
1118	R	26.1	Very low	32.3	Very low	197 Å²	197	150.3 Å²	150.3	74%	0.743	76%	0.762	S	S	*	*				178.6	149.4	127.7	-104.7	177.9	177.9	-125.6	4.4	113.6
1119	E	28.5	Very low	32.5	Very low	131 Å²	131	146.4 Å²	146.4	61%	0.612	76%	0.759	S	S	*	*			trans	52.7	137.6	146.4	-75.7	139.7	-139	0	0	119.5
1120	I	30.5	Very low	32.3	Very low	141 Å²	141	151.3 Å²	151.3	72%	0.723	77%	0.773	S	S	*	*			cis	-150.1	121.7	9.6	-95.8	144.6	0	0	0	106.2
1121	I	29.6	Very low	31.9	Very low	149 Å²	149	153.8 Å²	153.8	76%	0.764	78%	0.775	S	S	*	*				52.5	89.9	94	-51.4	169.3	0	0	0	114.2
1122	V	35.3	Very low	31.6	Very low	213 Å²	213	155.9 Å²	155.9	100%	1.291	77%	0.769	S	S	*	*				-121.6	0	94.8	175.1	0	0	0	0	107.2

Retrieved 1,122 of 1,122 residues in 171.7 ms (Link to these results)

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