A0A5K4EUL5_SCHMA Loading...

Putative cadherin

AlphaFold DB , UniProt , Accession A0A5K4EUL5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,085 aa.

						>A0A5K4EUL5_SCHMA|A0A5K4EUL5
MTNLPYILISLFVHIKPVYLLLTVQFTILEELPIKTIIGNLTSKLPATLQLDIQQLRFRIITSEYSRYFSVNVTTGLIQINQRLDHEKICPKTLFHTNSNIHDPVTNSDSLCQITLNANILRVMNSGVDIVEVMHLIITIKDIDDNVCEFLPANEQEIYVMEGLLDQTNMIKVPINQLVDLDTGPGNGIHRSSIKLKLDQKSNVSLNEIFDLKITNTSSKVSPYALSLLIKQSLDYESIQEFRMTIVASSSTEKPKSTISTGDFISYPEDLNAEKNECFLNVIVHVIDVNDHSPTFLQKNVYLSILENTETNKLIYTPEARDLDAGPIHSQLIFELSFRNSPYISSHFYINPQNGSLFLKQTLDYKEMPKLNILITVRNPRTEEIDDKTMNNNLTHELFDRHYYYKSLVSNMDSSMIDSLLHDTMELFIQVIDVNNHKPVISAYTPNGSHELIIQEHLPVSIFPVDFALVSVTDDDSGRNGQVKCELDRNSSDLFKLTLIGYESSGDKLVADNYDRDQLSDLQTNDLIIYKMSAVVSFDREKNATVYATIRCTDLGDNPLITDYVAQIHIADINDNEPRFPQTNEYIKLMEDSDPLRAEVNYYVMQVIATDADSGKNAEIIYYIAEESVRNIIQINQTNGIIQTTGQLDREMNTSLSFTVIAKDLGEVSKSSSVYIHLTIQDYNDEYPEFDKKIYEFSIHENSIQGYYIDTINVIDKDIDINSQLTFYLNYEKDENVNYLNKDYSYYSNKLRFSSLKKIIPFKITSKRLNNQHNYELNLYTNGKIDREELIRFNQRKLKTIDYAYLNIDNNNNNNNNNNYIYNELSHYKLLLTAEDSGIPKRIATVLIYINVIDVNDEAPIFMNPIQDDIIYTISMNEIPGYQIIKFKANDPDEGLNSKIKYSLIESIQDNSDTGNGSSSTCKNLNRKSLMDHNQSCNLLEYLYLNQTTGSLFLSKQLPNHLSNVTCRLCVVASDMGIPSLNSTRYFCLHLMDTIESSQLKWISSQTNNNEYSPIYIYTITGAIGISLILSIVFLCIACTIWKYPKLKLKSKIIKETKSSDDNQISKIHCVAEKLTNKSKLPNRY
					

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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	42.5	Very low	38	Very low	237 Å²	237	149.2 Å²	149.2	100%	1.167	78%	0.78	S	S	*	*				0	116.3	0	-65.2	-178	104.9	0	0	106.7
2	T	40.4	Very low	38	Very low	124 Å²	124	152.4 Å²	152.4	76%	0.761	78%	0.783	S	S	*	*			cis	-160.5	112	3	33.9	0	0	0	0	108.1
3	N	36.3	Very low	37.9	Very low	161 Å²	161	151.7 Å²	151.7	86%	0.861	79%	0.79	S	S	*	*				39.9	115.2	129.4	-74.3	0.8	0	0	0	121.5
4	L	31.5	Very low	37.5	Very low	162 Å²	162	154.9 Å²	154.9	85%	0.848	80%	0.798	S	S	*	*				-40.4	155.4	124.2	-101.8	80.4	0	0	0	110.2
5	P	41.2	Very low	37.7	Very low	83 Å²	83	155.5 Å²	155.5	54%	0.539	80%	0.801	S	S	.	*			cis	-146.2	-177.7	31.3	27.4	1	0	0	0	113.1
6	Y	41.3	Very low	37.4	Very low	205 Å²	205	158.6 Å²	158.6	80%	0.804	81%	0.807	S	S	*	*				172.8	110.5	90.4	-87.9	-82.7	0	0	0	104.9
7	I	35.5	Very low	37.5	Very low	141 Å²	141	155.6 Å²	155.6	72%	0.723	80%	0.801	S	S	*	*				42.9	119.7	68.9	-61.1	178.4	0	0	0	112.8
8	L	33.8	Very low	37.5	Very low	140 Å²	140	154.7 Å²	154.7	73%	0.733	80%	0.803	S	S	*	*			trans	97.2	67.4	165.3	-66.6	148	0	0	0	119.3
9	I	43.2	Very low	37.9	Very low	173 Å²	173	157.8 Å²	157.8	89%	0.887	81%	0.805	S	S	*	*			trans	-147	69.6	130	-52.6	-178	0	0	0	104.9
10	S	37.1	Very low	38.6	Very low	73 Å²	73	157.4 Å²	157.4	51%	0.51	80%	0.804	S	S	.	*				54.8	104	69	140.4	0	0	0	0	112.4
11	L	35.2	Very low	39.5	Very low	142 Å²	142	155.5 Å²	155.5	74%	0.743	80%	0.795	S	S	*	*			trans	82	119.9	146.4	-72.6	151.3	0	0	0	117.8
12	F	37.5	Very low	41.1	Very low	188 Å²	188	145.7 Å²	145.7	83%	0.825	75%	0.747	S	S	*	*	S	Bend	trans	82.3	82.9	169.6	-61.1	-83.4	0	0	0	117.4
13	V	37.4	Very low	43	Very low	143 Å²	143	143.4 Å²	143.4	87%	0.867	73%	0.733	S	S	*	*				-167.7	82.5	111.8	-177.2	0	0	0	0	107.8
14	H	32.8	Very low	45.3	Very low	196 Å²	196	136 Å²	136	91%	0.907	69%	0.693	S	S	*	*			trans	-119	88.5	173.7	-95.6	-59.7	0	0	0	110.4
15	I	40.1	Very low	47.9	Very low	165 Å²	165	135 Å²	135	85%	0.846	68%	0.684	S	S	*	*			trans	-144.9	104.3	159.5	-55.7	179.4	0	0	0	107.4
16	K	32.7	Very low	50.1	Low	204 Å²	204	132.2 Å²	132.2	89%	0.887	66%	0.664	S	S	*	*			trans	-137.4	139.1	153.1	-83.6	-167.4	178.4	-179.1	0	108
17	P	38.9	Very low	52.3	Low	108 Å²	108	126.6 Å²	126.6	70%	0.701	65%	0.651	S	S	*	*			trans	-80.8	152.2	-153.8	31.6	-31.2	0	0	0	113.1	Y19	P17-Y19 PolarHBondContact O-N 2.95Å
18	V	37.9	Very low	54.8	Low	139 Å²	139	120.6 Å²	120.6	84%	0.842	62%	0.621	S	S	*	*			trans	-48.9	121.5	165.8	174.1	0	0	0	0	109.2	L20	V18-L20 PolarHBondContact O-N 3.3Å; V18-L20 VanDerWaalsContact O-N 3.09Å
19	Y	45.7	Very low	57.2	Low	214 Å²	214	117.2 Å²	117.2	84%	0.839	60%	0.603	S	S	*	*			trans	-66.9	106.3	170	-79.5	-91.7	0	0	0	108.4	P17 L21	P17-Y19 PolarHBondContact O-N 2.95Å; Y19-L21 PolarHBondContact O-N 3.45Å
20	L	51.9	Low	59.1	Low	150 Å²	150	109.1 Å²	109.1	79%	0.785	56%	0.561	S	S	*	*			trans	-59.9	120.1	171.5	-161.8	83.7	0	0	0	108.5	V18 L22	V18-L20 PolarHBondContact O-N 3.3Å; V18-L20 VanDerWaalsContact O-N 3.09Å; L20-L22 PolarHBondContact O-N 3.49Å
21	L	57.5	Low	61.3	Low	118 Å²	118	108.1 Å²	108.1	62%	0.618	55%	0.548	S	S	*	.			trans	-54.9	127.3	169.7	-91.8	148.5	0	0	0	108.8	Y19 T23	Y19-L21 PolarHBondContact O-N 3.45Å; L21-T23 PolarHBondContact O-N 2.68Å; L21-T23 PolarHBondContact O-OG1 3.3Å
22	L	74.4	Confident	63.6	Low	30 Å²	30	102 Å²	102	16%	0.157	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	91.4	-175.6	-168.8	63.4	0	0	0	110	L20 K44 P46 I120 M134 H135	L20-L22 PolarHBondContact O-N 3.49Å; L22-K44 WeakPolarHBondContact CD1-O 3.4Å; L22-P46 HydrophobicContact CD1-CG 4.34Å; L22-P46 HydrophobicContact CD2-CG 4.42Å; L22-I120 HydrophobicContact CD2-CD1 4.2Å; L22-M134 HydrophobicContact CB-CG 4.15Å; L22-M134 HydrophobicContact CD2-CE 3.84Å; L22-M134 HydrophobicContact CD2-CG 3.5Å; L22-M134 HydrophobicContact CD2-SD 4.09Å; L22-M134 HydrophobicContact CG-CG 3.87Å; L22-M134 CarbonylContact O-C 3.5Å; L22-M134 WeakPolarHBondContact O-CA 3.28Å; L22-H135 PolarHBondContact O-N 2.77Å
23	T	80.6	Confident	66	Low	76 Å²	76	96.5 Å²	96.5	47%	0.466	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	130.3	179.8	-55.8	0	0	0	0	111.3	L21 H135 I137	L21-T23 PolarHBondContact O-N 2.68Å; L21-T23 PolarHBondContact O-OG1 3.3Å; T23-H135 CarbonylContact C-O 3.47Å; T23-H135 VanDerWaalsContact CA-O 3.26Å; T23-H135 WeakPolarHBondContact CA-O 3.42Å; T23-I137 HydrophobicContact CG2-CD1 3.89Å; T23-I137 HydrophobicContact CG2-CG1 4.29Å
24	V	84.5	Confident	68.2	Low	5 Å²	5	94.6 Å²	94.6	3%	0.03	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	127.5	176	-172.7	0	0	0	0	109.1	F26 K44 M134 H135 L136 I137	V24-F26 HydrophobicContact CB-CE2 4.33Å; V24-F26 HydrophobicContact CG1-CD2 4.3Å; V24-F26 HydrophobicContact CG1-CE1 3.98Å; V24-F26 HydrophobicContact CG1-CE2 3.54Å; V24-F26 HydrophobicContact CG1-CZ 3.35Å; V24-K44 HydrophobicContact CG1-CG 3.98Å; V24-K44 HydrophobicContact CG2-CB 3.89Å; V24-K44 HydrophobicContact CG2-CG 4.08Å; V24-M134 HydrophobicContact CG2-SD 4.11Å; V24-H135 PolarHBondContact N-O 3.29Å; V24-L136 HydrophobicContact CB-CD2 3.66Å; V24-L136 HydrophobicContact CG1-CD2 4.45Å; V24-L136 HydrophobicContact CG2-CD2 4.06Å; V24-L136 CarbonylContact O-C 3.5Å; V24-L136 WeakPolarHBondContact O-CA 3.15Å; V24-I137 PolarHBondContact O-N 3.46Å
25	Q	87.2	Confident	70.8	Confident	141 Å²	141	92.7 Å²	92.7	66%	0.659	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.1	136.9	177.7	-59.1	-173.2	-35.8	0	0	110.4	I137	Q25-I137 CarbonylContact C-O 3.5Å; Q25-I137 VanDerWaalsContact CA-O 3.26Å; Q25-I137 WeakPolarHBondContact CA-O 3.49Å; Q25-I137 HydrophobicContact CG-CB 4.17Å; Q25-I137 HydrophobicContact CG-CD1 4.33Å
26	F	87.9	Confident	73.1	Confident	25 Å²	25	86.8 Å²	86.8	11%	0.11	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	145.4	171.7	-60.7	-68.5	0	0	0	109.1	V24 I38 G39 L41 I78 L136 I137 I138 T139	V24-F26 HydrophobicContact CB-CE2 4.33Å; V24-F26 HydrophobicContact CG1-CD2 4.3Å; V24-F26 HydrophobicContact CG1-CE1 3.98Å; V24-F26 HydrophobicContact CG1-CE2 3.54Å; V24-F26 HydrophobicContact CG1-CZ 3.35Å; F26-I38 WeakPolarHBondContact CD1-O 3.19Å; F26-I38 HydrophobicContact CD2-CD1 4.19Å; F26-I38 WeakPolarHBondContact CE1-O 3.45Å; F26-I38 HydrophobicContact CG-CD1 4.43Å; F26-G39 VanDerWaalsContact CE1-CA 3.5Å; F26-L41 HydrophobicContact CE2-CD2 4.33Å; F26-L41 HydrophobicContact CZ-CD2 4.3Å; F26-I78 HydrophobicContact CE2-CG2 3.96Å; F26-I78 HydrophobicContact CZ-CG2 3.99Å; F26-L136 HydrophobicContact CE2-CD2 4.32Å; F26-I137 PolarHBondContact N-O 2.8Å; F26-I138 HydrophobicContact CB-CG1 4.34Å; F26-I138 HydrophobicContact CD2-CG1 4.24Å; F26-I138 CarbonylContact O-C 3.53Å; F26-I138 WeakPolarHBondContact O-CA 3.15Å; F26-T139 PolarHBondContact O-N 3.26Å
27	T	86.5	Confident	75.8	Confident	88 Å²	88	81.7 Å²	81.7	54%	0.54	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	125.2	170.7	-57.4	0	0	0	0	107.1	T139 K141	T27-T139 CarbonylContact C-O 3.58Å; T27-T139 WeakPolarHBondContact CA-O 3.41Å; T27-T139 HydrophobicContact CG2-CG2 4.34Å; T27-K141 HydrophobicContact CG2-CD 4.13Å; T27-K141 HydrophobicContact CG2-CG 4.13Å
28	I	88.5	Confident	78.1	Confident	15 Å²	15	77.6 Å²	77.6	8%	0.077	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	151	-175	58.9	-177.8	0	0	0	109.5	L32 I38 F69 L84 I138 T139 I140 K141	I28-L32 HydrophobicContact CB-CD1 3.81Å; I28-L32 HydrophobicContact CG2-CD1 4.27Å; I28-I38 HydrophobicContact CD1-CG2 4.21Å; I28-I38 HydrophobicContact CG2-CB 4.01Å; I28-I38 HydrophobicContact CG2-CG2 3.84Å; I28-F69 HydrophobicContact CD1-CE1 3.86Å; I28-F69 HydrophobicContact CD1-CZ 4.14Å; I28-L84 HydrophobicContact CD1-CD1 3.21Å; I28-L84 HydrophobicContact CG1-CD1 4.19Å; I28-I138 HydrophobicContact CD1-CG2 3.36Å; I28-I138 HydrophobicContact CG1-CG2 3.73Å; I28-T139 PolarHBondContact N-O 3.32Å; I28-I140 HydrophobicContact CG1-CG1 4.48Å; I28-I140 CarbonylContact O-C 3.52Å; I28-I140 WeakPolarHBondContact O-CA 3.41Å; I28-K141 PolarHBondContact O-N 2.95Å
29	L	84.6	Confident	80.4	Confident	68 Å²	68	71.6 Å²	71.6	36%	0.356	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	153.6	166.4	-57.8	176.9	0	0	0	108.2	L32 K141 I143	L29-L32 HydrophobicContact CB-CD2 4.41Å; L29-L32 HydrophobicContact CB-CG 4.28Å; L29-L32 WeakPolarHBondContact O-CD1 3.49Å; L29-L32 WeakPolarHBondContact O-CG 3.22Å; L29-K141 HydrophobicContact CD2-CB 3.92Å; L29-K141 HydrophobicContact CD2-CD 4.37Å; L29-I143 HydrophobicContact CB-CG2 4.19Å; L29-I143 HydrophobicContact CD2-CG2 4.15Å
30	E	83.4	Confident	82.4	Confident	3 Å²	3	63.9 Å²	63.9	1%	0.014	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	174.3	160.4	69.6	179.7	129.8	0	0	111.7	L32 H86 I140 K141 D142 I143	E30-L32 PolarHBondContact O-N 2.86Å; E30-H86 HydrophobicContact CB-CB 4.2Å; E30-H86 VanDerWaalsContact CD-CB 3.43Å; E30-H86 HydrophobicContact CG-CB 4.37Å; E30-H86 WeakPolarHBondContact OE1-CB 3.12Å; E30-H86 WeakPolarHBondContact OE2-CA 3.5Å; E30-H86 WeakPolarHBondContact OE2-CB 3.5Å; E30-H86 PolarHBondContact OE2-N 3.19Å; E30-I140 HydrophobicContact CB-CG2 3.86Å; E30-K141 PolarHBondContact N-O 2.67Å; E30-K141 VanDerWaalsContact N-O 3.09Å; E30-D142 WeakPolarHBondContact OE1-CA 3.47Å; E30-I143 HydrophobicContact CG-CB 4.3Å; E30-I143 HydrophobicContact CG-CD1 3.74Å; E30-I143 HydrophobicContact CG-CG1 3.53Å; E30-I143 HydrophobicContact CG-CG2 4.18Å; E30-I143 PolarHBondContact OE1-N 3.28Å
31	E	81.3	Confident	84.1	Confident	52 Å²	52	56.8 Å²	56.8	24%	0.243	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.8	9.1	176.8	-60.9	-53.9	140.7	0	0	117	R83 L84 I143 D145	E31-R83 IonicContact OE1-CZ 3.56Å; E31-R83 IonicContact OE1-NE 2.74Å; E31-R83 PolarHBondContact OE1-NE 3.37Å; E31-R83 IonicContact OE1-NH2 2.7Å; E31-R83 PolarHBondContact OE1-NH2 2.97Å; E31-R83 WeakPolarHBondContact OE2-CD 3.21Å; E31-R83 WeakPolarHBondContact OE2-CG 3.36Å; E31-R83 IonicContact OE2-CZ 2.69Å; E31-R83 IonicContact OE2-NE 2.88Å; E31-R83 PolarHBondContact OE2-NE 2.89Å; E31-R83 IonicContact OE2-NH1 3.67Å; E31-R83 IonicContact OE2-NH2 3.74Å; E31-R83 PolarHBondContact OE2-NH2 3.5Å; E31-R83 VanDerWaalsContact OE2-NH2 3.16Å; E31-L84 PolarHBondContact N-O 2.8Å; E31-I143 HydrophobicContact CB-CD1 3.76Å; E31-I143 HydrophobicContact CG-CD1 3.87Å; E31-D145 WeakPolarHBondContact CG-OD2 3.19Å
32	L	85.3	Confident	85.4	Confident	14 Å²	14	52.1 Å²	52.1	7%	0.073	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-60.5	139.7	173.8	-69.9	178	0	0	0	111.1	I28 L29 E30 T36 I80 Y267	I28-L32 HydrophobicContact CB-CD1 3.81Å; I28-L32 HydrophobicContact CG2-CD1 4.27Å; L29-L32 HydrophobicContact CB-CD2 4.41Å; L29-L32 HydrophobicContact CB-CG 4.28Å; L29-L32 WeakPolarHBondContact O-CD1 3.49Å; L29-L32 WeakPolarHBondContact O-CG 3.22Å; E30-L32 PolarHBondContact O-N 2.86Å; L32-T36 HydrophobicContact CB-CG2 4.44Å; L32-T36 HydrophobicContact CD1-CG2 4.38Å; L32-I80 HydrophobicContact CB-CD1 3.4Å; L32-I80 HydrophobicContact CD1-CD1 3.99Å; L32-I80 HydrophobicContact CG-CD1 4.34Å; L32-Y267 HydrophobicContact CD2-CE1 3.57Å; L32-Y267 WeakPolarHBondContact CD2-OH 3.49Å
33	P	86.6	Confident	85.8	Confident	72 Å²	72	54.2 Å²	54.2	47%	0.468	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-54	144.8	-177.8	-27.2	33.2	0	0	0	113.8	K35 T36	P33-K35 PolarHBondContact O-N 3.07Å; P33-T36 WeakPolarHBondContact CD-OG1 3.25Å; P33-T36 WeakPolarHBondContact O-CB 3.4Å; P33-T36 PolarHBondContact O-N 3.27Å; P33-T36 PolarHBondContact O-OG1 2.94Å
34	I	85.1	Confident	85.9	Confident	103 Å²	103	56.1 Å²	56.1	53%	0.528	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	140.1	171.1	-55.9	174.7	0	0	0	108.6	T36	I34-T36 VanDerWaalsContact C-N 3.28Å
35	K	86.5	Confident	85.8	Confident	156 Å²	156	56.3 Å²	56.3	68%	0.678	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	4.5	-170.8	-47.5	179.7	-178.6	174.3	0	115.4	P33 I37 I80	P33-K35 PolarHBondContact O-N 3.07Å; K35-I37 PolarHBondContact O-N 2.91Å; K35-I80 WeakPolarHBondContact CA-O 3.08Å; K35-I80 PolarHBondContact N-O 2.52Å
36	T	89.2	Confident	85.4	Confident	42 Å²	42	51.7 Å²	51.7	26%	0.258	28%	0.278	S	S	.	.			trans	-58.8	123.5	168	-62.2	0	0	0	0	109.2	L32 P33 I34 I38 Q79 I80	L32-T36 HydrophobicContact CB-CG2 4.44Å; L32-T36 HydrophobicContact CD1-CG2 4.38Å; P33-T36 WeakPolarHBondContact CD-OG1 3.25Å; P33-T36 WeakPolarHBondContact O-CB 3.4Å; P33-T36 PolarHBondContact O-N 3.27Å; P33-T36 PolarHBondContact O-OG1 2.94Å; I34-T36 VanDerWaalsContact C-N 3.28Å; T36-I38 PolarHBondContact O-N 2.74Å; T36-Q79 CarbonylContact O-C 3.59Å; T36-Q79 WeakPolarHBondContact O-CA 3.3Å; T36-Q79 WeakPolarHBondContact O-CB 3.03Å; T36-I80 PolarHBondContact O-N 2.91Å
37	I	88.5	Confident	85	Confident	96 Å²	96	53.9 Å²	53.9	49%	0.492	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	114.4	178.2	-62.6	170	0	0	0	107.7	K35 L77 I78 Q79	K35-I37 PolarHBondContact O-N 2.91Å; I37-L77 HydrophobicContact CD1-CD1 4.24Å; I37-L77 HydrophobicContact CG2-CD2 4.01Å; I37-I78 CarbonylContact C-O 3.52Å; I37-I78 WeakPolarHBondContact CA-O 3.3Å; I37-Q79 HydrophobicContact CG1-CB 4.49Å
38	I	87.6	Confident	84.4	Confident	22 Å²	22	54.5 Å²	54.5	11%	0.113	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	-16.5	178.3	68.7	169.7	0	0	0	112	F26 I28 T36 F69 I78 I80 I138	F26-I38 WeakPolarHBondContact CD1-O 3.19Å; F26-I38 HydrophobicContact CD2-CD1 4.19Å; F26-I38 WeakPolarHBondContact CE1-O 3.45Å; F26-I38 HydrophobicContact CG-CD1 4.43Å; I28-I38 HydrophobicContact CD1-CG2 4.21Å; I28-I38 HydrophobicContact CG2-CB 4.01Å; I28-I38 HydrophobicContact CG2-CG2 3.84Å; T36-I38 PolarHBondContact O-N 2.74Å; I38-F69 HydrophobicContact CD1-CD1 3.45Å; I38-F69 VanDerWaalsContact CD1-CD1 3.45Å; I38-F69 HydrophobicContact CD1-CE1 3.58Å; I38-F69 HydrophobicContact CD1-CG 4.49Å; I38-I78 HydrophobicContact CD1-CD1 3.85Å; I38-I78 HydrophobicContact CD1-CG1 3.78Å; I38-I78 HydrophobicContact CD1-CG2 4.1Å; I38-I78 HydrophobicContact CG1-CB 4.07Å; I38-I78 HydrophobicContact CG1-CD1 4.34Å; I38-I78 HydrophobicContact CG1-CG1 3.81Å; I38-I78 HydrophobicContact CG1-CG2 3.44Å; I38-I78 VanDerWaalsContact CG1-CG2 3.44Å; I38-I78 PolarHBondContact N-O 3.45Å; I38-I80 HydrophobicContact CG2-CD1 4.03Å; I38-I80 HydrophobicContact CG2-CG1 3.63Å; I38-I138 HydrophobicContact CD1-CD1 3.64Å; I38-I138 HydrophobicContact CD1-CG1 4.31Å
39	G	85.9	Confident	83.9	Confident	13 Å²	13	54.2 Å²	54.2	13%	0.134	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.5	170.6	-179.5	0	0	0	0	0	114.6	F26 I78	F26-G39 VanDerWaalsContact CE1-CA 3.5Å; G39-I78 PolarHBondContact N-O 2.71Å; G39-I78 VanDerWaalsContact O-CG2 3.22Å; G39-I78 WeakPolarHBondContact O-CG2 3.09Å; G39-I78 PolarHBondContact O-N 2.67Å
40	N	88.5	Confident	83.5	Confident	53 Å²	53	55.4 Å²	55.4	28%	0.283	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	113.9	174.7	-173.6	-1.5	0	0	0	109.9	T42 S43 T75 L77	N40-T42 VanDerWaalsContact C-N 3.31Å; N40-T42 PolarHBondContact ND2-OG1 3.19Å; N40-T42 PolarHBondContact O-N 2.81Å; N40-T42 PolarHBondContact OD1-N 2.86Å; N40-T42 PolarHBondContact OD1-OG1 3.09Å; N40-S43 PolarHBondContact O-N 3.5Å; N40-S43 PolarHBondContact O-OG 3.04Å; N40-T75 PolarHBondContact OD1-O 2.91Å; N40-T75 VanDerWaalsContact OD1-O 3.12Å; N40-L77 HydrophobicContact CB-CD2 3.74Å
41	L	86.7	Confident	83.2	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.344	C	S	.	.	S	Bend	trans	-68.8	-29.1	178.2	-59.5	-170.7	0	0	0	112.1	F26 S43 K44 L45 F58 V71 G76 I78 A118 M134 L136	F26-L41 HydrophobicContact CE2-CD2 4.33Å; F26-L41 HydrophobicContact CZ-CD2 4.3Å; L41-S43 VanDerWaalsContact C-N 3.27Å; L41-S43 PolarHBondContact O-N 3.44Å; L41-K44 PolarHBondContact O-N 3.38Å; L41-K44 VanDerWaalsContact O-N 3.09Å; L41-L45 PolarHBondContact O-N 3.06Å; L41-F58 HydrophobicContact CB-CD1 3.96Å; L41-F58 HydrophobicContact CB-CE1 3.84Å; L41-F58 HydrophobicContact CD1-CD1 4.05Å; L41-V71 HydrophobicContact CD1-CG2 3.7Å; L41-V71 HydrophobicContact CG-CG2 4.33Å; L41-G76 VanDerWaalsContact CB-O 3.22Å; L41-G76 WeakPolarHBondContact CB-O 3.02Å; L41-G76 VanDerWaalsContact CG-O 3.24Å; L41-G76 WeakPolarHBondContact CG-O 3.07Å; L41-G76 PolarHBondContact N-O 3.1Å; L41-I78 HydrophobicContact CD2-CG2 4.32Å; L41-A118 HydrophobicContact CD1-CB 3.97Å; L41-M134 HydrophobicContact CB-CE 3.88Å; L41-M134 HydrophobicContact CB-SD 3.84Å; L41-M134 HydrophobicContact CD1-SD 4.14Å; L41-M134 HydrophobicContact CD2-SD 3.91Å; L41-M134 HydrophobicContact CG-SD 4.17Å; L41-M134 WeakPolarHBondContact O-CE 3.12Å; L41-L136 HydrophobicContact CD1-CD1 4.38Å; L41-L136 HydrophobicContact CD2-CD1 4.27Å; L41-L136 HydrophobicContact CD2-CD2 3.69Å
42	T	84.6	Confident	83	Confident	21 Å²	21	62.2 Å²	62.2	13%	0.129	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-65.1	-30.7	177.9	52.9	0	0	0	0	112.8	N40 K44 L45 F58 T75	N40-T42 VanDerWaalsContact C-N 3.31Å; N40-T42 PolarHBondContact ND2-OG1 3.19Å; N40-T42 PolarHBondContact O-N 2.81Å; N40-T42 PolarHBondContact OD1-N 2.86Å; N40-T42 PolarHBondContact OD1-OG1 3.09Å; T42-K44 PolarHBondContact O-N 2.82Å; T42-L45 HydrophobicContact CG2-CD1 4.36Å; T42-L45 PolarHBondContact O-N 2.82Å; T42-F58 HydrophobicContact CG2-CE2 3.44Å; T42-F58 VanDerWaalsContact CG2-CE2 3.44Å; T42-F58 HydrophobicContact CG2-CZ 3.38Å; T42-T75 WeakPolarHBondContact CG2-O 3.36Å; T42-T75 PolarHBondContact OG1-O 2.83Å
43	S	83.9	Confident	82.7	Confident	74 Å²	74	64.6 Å²	64.6	52%	0.517	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-74.9	-10.8	176.9	71.1	0	0	0	0	113.3	N40 L41	N40-S43 PolarHBondContact O-N 3.5Å; N40-S43 PolarHBondContact O-OG 3.04Å; L41-S43 VanDerWaalsContact C-N 3.27Å; L41-S43 PolarHBondContact O-N 3.44Å
44	K	81.8	Confident	82.4	Confident	115 Å²	115	69.4 Å²	69.4	50%	0.5	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-104.9	2.9	177.1	-60.1	-63.1	-174.9	179.4	0	112.9	L22 V24 L41 T42	L22-K44 WeakPolarHBondContact CD1-O 3.4Å; V24-K44 HydrophobicContact CG1-CG 3.98Å; V24-K44 HydrophobicContact CG2-CB 3.89Å; V24-K44 HydrophobicContact CG2-CG 4.08Å; L41-K44 PolarHBondContact O-N 3.38Å; L41-K44 VanDerWaalsContact O-N 3.09Å; T42-K44 PolarHBondContact O-N 2.82Å
45	L	81.9	Confident	82.3	Confident	10 Å²	10	68.5 Å²	68.5	5%	0.052	37%	0.367	C	S	.	.	S	Bend	trans	-70.5	142.3	175.6	-75.2	174	0	0	0	111.7	L41 T42 L49 Q50 I53 L56 F58 I120 M134	L41-L45 PolarHBondContact O-N 3.06Å; T42-L45 HydrophobicContact CG2-CD1 4.36Å; T42-L45 PolarHBondContact O-N 2.82Å; L45-L49 HydrophobicContact CB-CB 4.29Å; L45-L49 HydrophobicContact CD1-CB 4.4Å; L45-L49 HydrophobicContact CD2-CB 4.13Å; L45-L49 HydrophobicContact CD2-CD1 3.92Å; L45-Q50 HydrophobicContact CB-CG 4.33Å; L45-I53 HydrophobicContact CD1-CG1 4.23Å; L45-L56 HydrophobicContact CD1-CD1 3.62Å; L45-F58 HydrophobicContact CD1-CE1 4.39Å; L45-F58 HydrophobicContact CD1-CZ 3.85Å; L45-F58 HydrophobicContact CD2-CE1 4.27Å; L45-F58 HydrophobicContact CG-CE1 4.45Å; L45-F58 HydrophobicContact CG-CZ 4.35Å; L45-I120 HydrophobicContact CD2-CD1 3.53Å; L45-I120 HydrophobicContact CD2-CG1 4.08Å; L45-I120 HydrophobicContact CD2-CG2 4.32Å; L45-M134 HydrophobicContact CD2-CE 3.49Å; L45-M134 VanDerWaalsContact CD2-CE 3.49Å; L45-M134 HydrophobicContact CG-CE 4.04Å
46	P	79.6	Confident	82.3	Confident	43 Å²	43	61 Å²	61	28%	0.279	33%	0.334	S	S	.	.			trans	-57.8	151.6	168.4	-21.2	31.4	0	0	0	111.9	L22 T48 L49 Q50	L22-P46 HydrophobicContact CD1-CG 4.34Å; L22-P46 HydrophobicContact CD2-CG 4.42Å; P46-T48 PolarHBondContact O-N 2.9Å; P46-L49 PolarHBondContact O-N 2.86Å; P46-Q50 PolarHBondContact O-N 3.13Å; P46-Q50 VanDerWaalsContact O-N 3.15Å
47	A	78.7	Confident	82.3	Confident	72 Å²	72	62.7 Å²	62.7	60%	0.595	34%	0.336	S	S	*	.	H	α-helix	trans	-54.5	-28.1	-179	0	0	0	0	0	113.7	L49	A47-L49 VanDerWaalsContact C-N 3.34Å
48	T	74.9	Confident	82.3	Confident	100 Å²	100	58.2 Å²	58.2	61%	0.613	31%	0.313	S	S	*	.	H	α-helix	trans	-67.1	-30.9	176.5	49.2	0	0	0	0	113.5	P46	P46-T48 PolarHBondContact O-N 2.9Å
49	L	77.7	Confident	82.4	Confident	9 Å²	9	65 Å²	65	5%	0.047	34%	0.337	C	S	.	.	H	α-helix	trans	-93.7	-22.4	179.3	-63.6	-171.9	0	0	0	112.5	L45 P46 A47 L51 D52 I53 L56 I120 V131 E132	L45-L49 HydrophobicContact CB-CB 4.29Å; L45-L49 HydrophobicContact CD1-CB 4.4Å; L45-L49 HydrophobicContact CD2-CB 4.13Å; L45-L49 HydrophobicContact CD2-CD1 3.92Å; P46-L49 PolarHBondContact O-N 2.86Å; A47-L49 VanDerWaalsContact C-N 3.34Å; L49-L51 PolarHBondContact O-N 2.9Å; L49-D52 PolarHBondContact O-N 2.79Å; L49-D52 VanDerWaalsContact O-N 3.11Å; L49-I53 PolarHBondContact O-N 3.13Å; L49-L56 HydrophobicContact CB-CD1 3.99Å; L49-L56 WeakPolarHBondContact O-CD1 3.48Å; L49-I120 HydrophobicContact CD1-CD1 4.32Å; L49-V131 HydrophobicContact CD1-CG1 4Å; L49-V131 HydrophobicContact CD2-CB 4.48Å; L49-V131 HydrophobicContact CD2-CG1 3.34Å; L49-V131 HydrophobicContact CG-CG1 4.33Å; L49-E132 HydrophobicContact CD1-CB 4.21Å; L49-E132 VanDerWaalsContact CD1-OE2 3.26Å; L49-E132 WeakPolarHBondContact CD1-OE2 3.25Å
50	Q	76.1	Confident	82.4	Confident	94 Å²	94	65.5 Å²	65.5	44%	0.439	34%	0.336	S	S	.	.	H	α-helix	trans	-59.2	-32.7	173.4	-87.5	177.6	-24.1	0	0	112.8	L45 P46 D52 I53	L45-Q50 HydrophobicContact CB-CG 4.33Å; P46-Q50 PolarHBondContact O-N 3.13Å; P46-Q50 VanDerWaalsContact O-N 3.15Å; Q50-D52 VanDerWaalsContact C-N 3.25Å; Q50-D52 PolarHBondContact O-N 2.71Å; Q50-I53 HydrophobicContact CB-CD1 4.32Å; Q50-I53 HydrophobicContact CG-CD1 4.14Å; Q50-I53 WeakPolarHBondContact O-CD1 3.39Å; Q50-I53 WeakPolarHBondContact O-CG1 3.48Å
51	L	76.2	Confident	82.2	Confident	151 Å²	151	65.7 Å²	65.7	79%	0.791	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-25.6	177.3	-70.8	164.1	0	0	0	113.2	L49	L49-L51 PolarHBondContact O-N 2.9Å
52	D	77	Confident	82	Confident	47 Å²	47	71.8 Å²	71.8	25%	0.251	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	15.4	-174.8	-65.7	-33.7	0	0	0	113.4	L49 Q50 Q54 Q55 L56 R122	L49-D52 PolarHBondContact O-N 2.79Å; L49-D52 VanDerWaalsContact O-N 3.11Å; Q50-D52 VanDerWaalsContact C-N 3.25Å; Q50-D52 PolarHBondContact O-N 2.71Å; D52-Q54 PolarHBondContact O-N 2.78Å; D52-Q55 WeakPolarHBondContact O-CA 3.12Å; D52-Q55 WeakPolarHBondContact O-CB 3.41Å; D52-Q55 PolarHBondContact O-N 2.53Å; D52-L56 WeakPolarHBondContact O-CG 3.48Å; D52-L56 PolarHBondContact O-N 2.87Å; D52-R122 IonicContact OD2-CZ 2.92Å; D52-R122 VanDerWaalsContact OD2-CZ 3.28Å; D52-R122 IonicContact OD2-NE 2.64Å; D52-R122 IonicContact OD2-NH2 3.9Å; D52-R122 PolarHBondContact OD2-NH2 3.45Å
53	I	79.1	Confident	81.7	Confident	63 Å²	63	73 Å²	73	32%	0.323	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-46.5	-38.5	-174.7	-81	168	0	0	0	113	L45 L49 Q50 Q55 L56	L45-I53 HydrophobicContact CD1-CG1 4.23Å; L49-I53 PolarHBondContact O-N 3.13Å; Q50-I53 HydrophobicContact CB-CD1 4.32Å; Q50-I53 HydrophobicContact CG-CD1 4.14Å; Q50-I53 WeakPolarHBondContact O-CD1 3.39Å; Q50-I53 WeakPolarHBondContact O-CG1 3.48Å; I53-Q55 PolarHBondContact O-N 2.77Å; I53-L56 PolarHBondContact O-N 2.73Å
54	Q	81.8	Confident	81.5	Confident	173 Å²	173	76.1 Å²	76.1	81%	0.808	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-59.5	-32.6	178.3	-70.3	-80.3	-24.1	0	0	113.1	D52 R57	D52-Q54 PolarHBondContact O-N 2.78Å; Q54-R57 PolarHBondContact O-NH1 2.66Å
55	Q	82	Confident	81.6	Confident	84 Å²	84	73.7 Å²	73.7	39%	0.393	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-89.6	-9.5	178.5	-58.5	-178.7	6.2	0	0	112.7	D52 I53 R122 V123	D52-Q55 WeakPolarHBondContact O-CA 3.12Å; D52-Q55 WeakPolarHBondContact O-CB 3.41Å; D52-Q55 PolarHBondContact O-N 2.53Å; I53-Q55 PolarHBondContact O-N 2.77Å; Q55-R122 HydrophobicContact CB-CG 3.97Å; Q55-R122 CarbonylContact O-C 3.6Å; Q55-R122 WeakPolarHBondContact O-CA 3.35Å; Q55-V123 PolarHBondContact O-N 3.02Å
56	L	87.3	Confident	81.6	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	146.1	-176.5	-59.6	-177.8	0	0	0	112.5	L45 L49 D52 I53 I120 L121 R122 V131	L45-L56 HydrophobicContact CD1-CD1 3.62Å; L49-L56 HydrophobicContact CB-CD1 3.99Å; L49-L56 WeakPolarHBondContact O-CD1 3.48Å; D52-L56 WeakPolarHBondContact O-CG 3.48Å; D52-L56 PolarHBondContact O-N 2.87Å; I53-L56 PolarHBondContact O-N 2.73Å; L56-I120 HydrophobicContact CB-CG2 4.36Å; L56-I120 HydrophobicContact CD1-CG2 4.05Å; L56-I120 HydrophobicContact CD2-CG2 3.93Å; L56-I120 HydrophobicContact CG-CG2 4.33Å; L56-L121 CarbonylContact C-O 3.52Å; L56-L121 WeakPolarHBondContact CA-O 3.34Å; L56-R122 HydrophobicContact CD2-CB 4.08Å; L56-V131 HydrophobicContact CD2-CG2 3.92Å
57	R	87.9	Confident	82	Confident	76 Å²	76	78.3 Å²	78.3	29%	0.287	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	135.2	173.9	-60.3	-65.6	179.7	-88.3	-0.1	110.1	Q54 V73 L121 V123	Q54-R57 PolarHBondContact O-NH1 2.66Å; R57-V73 CarbonylContact C-O 3.49Å; R57-V73 WeakPolarHBondContact CA-O 3.21Å; R57-V73 HydrophobicContact CB-CG1 3.87Å; R57-V73 HydrophobicContact CG-CG1 4.3Å; R57-L121 HydrophobicContact CB-CB 4.16Å; R57-L121 PolarHBondContact N-O 2.71Å; R57-L121 WeakPolarHBondContact O-CB 3.25Å; R57-L121 PolarHBondContact O-N 3.47Å; R57-V123 HydrophobicContact CB-CG2 4.35Å; R57-V123 HydrophobicContact CG-CG2 3.49Å; R57-V123 VanDerWaalsContact CG-CG2 3.49Å
58	F	89.2	Confident	82.5	Confident	3 Å²	3	75.4 Å²	75.4	1%	0.013	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	138.2	-178.4	-59.5	-93.6	0	0	0	111.3	L41 T42 L45 V71 V73 N119 I120 M134	L41-F58 HydrophobicContact CB-CD1 3.96Å; L41-F58 HydrophobicContact CB-CE1 3.84Å; L41-F58 HydrophobicContact CD1-CD1 4.05Å; T42-F58 HydrophobicContact CG2-CE2 3.44Å; T42-F58 VanDerWaalsContact CG2-CE2 3.44Å; T42-F58 HydrophobicContact CG2-CZ 3.38Å; L45-F58 HydrophobicContact CD1-CE1 4.39Å; L45-F58 HydrophobicContact CD1-CZ 3.85Å; L45-F58 HydrophobicContact CD2-CE1 4.27Å; L45-F58 HydrophobicContact CG-CE1 4.45Å; L45-F58 HydrophobicContact CG-CZ 4.35Å; F58-V71 HydrophobicContact CB-CG1 4.04Å; F58-V71 HydrophobicContact CB-CG2 3.72Å; F58-V71 HydrophobicContact CG-CG2 4.45Å; F58-V73 PolarHBondContact N-O 3.46Å; F58-N119 CarbonylContact C-O 3.58Å; F58-N119 WeakPolarHBondContact CA-O 3.19Å; F58-I120 HydrophobicContact CD1-CG1 4.13Å; F58-I120 HydrophobicContact CE1-CG1 4.01Å; F58-M134 HydrophobicContact CD1-CE 4.34Å; F58-M134 HydrophobicContact CE1-CE 3.73Å
59	R	88.9	Confident	83.2	Confident	164 Å²	164	70.8 Å²	70.8	62%	0.619	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.1	121	177.6	-178.9	178.7	177.4	-179.8	0.4	111.5	A118 N119 L121	R59-A118 CarbonylContact O-C 3.58Å; R59-A118 WeakPolarHBondContact O-CA 3.42Å; R59-N119 PolarHBondContact N-O 3.2Å; R59-N119 PolarHBondContact O-N 2.92Å; R59-L121 HydrophobicContact CB-CD1 4.3Å
60	I	87.2	Confident	83.8	Confident	24 Å²	24	71.6 Å²	71.6	12%	0.123	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	133.8	171.9	-68.1	168.6	0	0	0	109.9	F69 V71 I78 L116 N117 A118	I60-F69 HydrophobicContact CD1-CB 4.02Å; I60-F69 WeakPolarHBondContact CD1-O 3.32Å; I60-V71 HydrophobicContact CD1-CB 4.11Å; I60-V71 HydrophobicContact CD1-CG1 4.25Å; I60-V71 HydrophobicContact CG1-CB 4.09Å; I60-V71 HydrophobicContact CG1-CG1 3.8Å; I60-I78 HydrophobicContact CD1-CD1 4.4Å; I60-L116 HydrophobicContact CD1-CD1 4.3Å; I60-L116 HydrophobicContact CG1-CD1 4.22Å; I60-L116 HydrophobicContact CG2-CD1 3.99Å; I60-N117 CarbonylContact C-O 3.48Å; I60-N117 WeakPolarHBondContact CA-O 3.2Å; I60-A118 HydrophobicContact CG1-CB 4.41Å
61	I	83.3	Confident	84.5	Confident	57 Å²	57	68 Å²	68	29%	0.292	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-76.5	130.5	172.3	-53.5	-174.6	0	0	0	107.9	S63 N117 N119 V133	I61-S63 PolarHBondContact O-N 2.8Å; I61-S63 VanDerWaalsContact O-N 3.17Å; I61-N117 HydrophobicContact CB-CB 4.1Å; I61-N117 HydrophobicContact CD1-CB 3.56Å; I61-N117 HydrophobicContact CG1-CB 3.93Å; I61-N117 PolarHBondContact N-O 3.37Å; I61-N119 WeakPolarHBondContact CD1-OD1 3.43Å; I61-N119 WeakPolarHBondContact CG1-OD1 3.07Å; I61-V133 HydrophobicContact CD1-CG1 4.06Å
62	T	82.3	Confident	85.2	Confident	127 Å²	127	64 Å²	64	78%	0.779	31%	0.309	S	S	*	.	P	Polyproline II helix	trans	-57	119	178.9	46.4	0	0	0	0	111.1
63	S	78.3	Confident	85.7	Confident	46 Å²	46	65.7 Å²	65.7	32%	0.322	32%	0.32	S	S	.	.			trans	-139.7	170.7	174.7	73.6	0	0	0	0	110.2	I61 Y65 S66	I61-S63 PolarHBondContact O-N 2.8Å; I61-S63 VanDerWaalsContact O-N 3.17Å; S63-Y65 PolarHBondContact O-N 2.02Å; S63-Y65 VanDerWaalsContact O-N 3.14Å; S63-Y65 PolarHBondContact OG-N 3.02Å; S63-S66 PolarHBondContact N-OG 2.77Å; S63-S66 WeakPolarHBondContact O-CB 3.29Å; S63-S66 PolarHBondContact O-N 3Å; S63-S66 PolarHBondContact O-OG 3.36Å; S63-S66 PolarHBondContact OG-N 3.07Å
64	E	79.8	Confident	85.9	Confident	140 Å²	140	66.2 Å²	66.2	65%	0.654	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-36.2	175.7	-177.1	172.3	-172	0	0	112.7
65	Y	83.9	Confident	86.2	Confident	64 Å²	64	60.5 Å²	60.5	25%	0.251	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-7.1	-178.7	-53.9	-71	0	0	0	114.8	S63 R67 Y68 I89 I114	S63-Y65 PolarHBondContact O-N 2.02Å; S63-Y65 VanDerWaalsContact O-N 3.14Å; S63-Y65 PolarHBondContact OG-N 3.02Å; Y65-R67 PolarHBondContact O-N 3.02Å; Y65-Y68 HydrophobicContact CD1-CD2 4.38Å; Y65-Y68 HydrophobicContact CD1-CE2 4.22Å; Y65-Y68 WeakPolarHBondContact O-CD2 3.31Å; Y65-Y68 PolarHBondContact O-N 3.08Å; Y65-I89 HydrophobicContact CE1-CG2 4.33Å; Y65-I114 HydrophobicContact CD1-CB 4.41Å; Y65-I114 HydrophobicContact CD1-CD1 3.81Å; Y65-I114 HydrophobicContact CD1-CG1 3.69Å; Y65-I114 HydrophobicContact CD1-CG2 4.13Å; Y65-I114 HydrophobicContact CD2-CG2 3.95Å; Y65-I114 HydrophobicContact CE1-CG1 4.07Å; Y65-I114 HydrophobicContact CG-CB 4.23Å; Y65-I114 HydrophobicContact CG-CD1 4.27Å; Y65-I114 HydrophobicContact CG-CG1 4.01Å; Y65-I114 HydrophobicContact CG-CG2 3.53Å
66	S	82.1	Confident	86.4	Confident	27 Å²	27	56.5 Å²	56.5	19%	0.189	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-60.5	-20.1	-178.1	64.2	0	0	0	0	113.7	S63 Y68	S63-S66 PolarHBondContact N-OG 2.77Å; S63-S66 WeakPolarHBondContact O-CB 3.29Å; S63-S66 PolarHBondContact O-N 3Å; S63-S66 PolarHBondContact O-OG 3.36Å; S63-S66 PolarHBondContact OG-N 3.07Å; S66-Y68 VanDerWaalsContact C-N 3.28Å; S66-Y68 PolarHBondContact O-N 3.21Å
67	R	87.8	Confident	86.6	Confident	124 Å²	124	59 Å²	59	47%	0.468	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-64.9	-27.9	174.2	66.4	-176.9	-179.7	-150	-4.4	114	Y65 N81	Y65-R67 PolarHBondContact O-N 3.02Å; R67-N81 WeakPolarHBondContact O-CB 3.35Å; R67-N81 PolarHBondContact O-ND2 2.84Å
68	Y	89.7	Confident	86.8	Confident	10 Å²	10	55.4 Å²	55.4	4%	0.039	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-82.4	-15	-175.5	-63.8	-78.2	0	0	0	113.6	Y65 S66 I80 N81 Q82 L84 I89 I114	Y65-Y68 HydrophobicContact CD1-CD2 4.38Å; Y65-Y68 HydrophobicContact CD1-CE2 4.22Å; Y65-Y68 WeakPolarHBondContact O-CD2 3.31Å; Y65-Y68 PolarHBondContact O-N 3.08Å; S66-Y68 VanDerWaalsContact C-N 3.28Å; S66-Y68 PolarHBondContact O-N 3.21Å; Y68-I80 CarbonylContact O-C 3.59Å; Y68-I80 WeakPolarHBondContact O-CA 3.27Å; Y68-N81 PolarHBondContact O-N 3.09Å; Y68-Q82 HydrophobicContact CD1-CB 4.05Å; Y68-Q82 HydrophobicContact CD1-CG 4.35Å; Y68-L84 HydrophobicContact CD1-CD2 3.68Å; Y68-L84 HydrophobicContact CE1-CD2 4.47Å; Y68-L84 HydrophobicContact CG-CD2 3.83Å; Y68-I89 HydrophobicContact CD1-CD1 4.39Å; Y68-I89 HydrophobicContact CE1-CD1 3.96Å; Y68-I89 HydrophobicContact CE1-CG1 4.24Å; Y68-I89 HydrophobicContact CE2-CG1 4.48Å; Y68-I114 HydrophobicContact CD2-CD1 4.3Å
69	F	90.6	Very high	86.9	Confident	4 Å²	4	58.2 Å²	58.2	2%	0.018	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	141	-174.8	-55.2	-79.2	0	0	0	110.7	I28 I38 I60 I78 Q79 I80 L84 I114 L116 I138	I28-F69 HydrophobicContact CD1-CE1 3.86Å; I28-F69 HydrophobicContact CD1-CZ 4.14Å; I38-F69 HydrophobicContact CD1-CD1 3.45Å; I38-F69 VanDerWaalsContact CD1-CD1 3.45Å; I38-F69 HydrophobicContact CD1-CE1 3.58Å; I38-F69 HydrophobicContact CD1-CG 4.49Å; I60-F69 HydrophobicContact CD1-CB 4.02Å; I60-F69 WeakPolarHBondContact CD1-O 3.32Å; F69-I78 HydrophobicContact CB-CD1 4.06Å; F69-I78 HydrophobicContact CB-CG1 4.19Å; F69-I78 HydrophobicContact CG-CD1 4.48Å; F69-Q79 CarbonylContact C-O 3.36Å; F69-Q79 WeakPolarHBondContact CA-O 3.1Å; F69-I80 HydrophobicContact CE1-CG1 4.49Å; F69-L84 HydrophobicContact CE1-CD1 4.08Å; F69-L84 HydrophobicContact CE2-CD2 4.36Å; F69-L84 HydrophobicContact CZ-CD1 4.05Å; F69-L84 HydrophobicContact CZ-CD2 3.86Å; F69-I114 HydrophobicContact CE2-CB 4.47Å; F69-I114 HydrophobicContact CE2-CD1 3.85Å; F69-I114 HydrophobicContact CE2-CG2 3.89Å; F69-I114 HydrophobicContact CZ-CD1 4.24Å; F69-L116 HydrophobicContact CB-CD2 4.23Å; F69-L116 HydrophobicContact CD2-CD2 3.22Å; F69-L116 HydrophobicContact CE2-CD2 3.84Å; F69-L116 HydrophobicContact CG-CD2 3.93Å; F69-I138 HydrophobicContact CD1-CD1 3.67Å; F69-I138 HydrophobicContact CD2-CD1 3.75Å; F69-I138 HydrophobicContact CE1-CD1 3.46Å; F69-I138 VanDerWaalsContact CE1-CD1 3.46Å; F69-I138 HydrophobicContact CE1-CG2 4.05Å; F69-I138 HydrophobicContact CE2-CD1 3.54Å; F69-I138 HydrophobicContact CG-CD1 3.8Å; F69-I138 HydrophobicContact CZ-CB 4.19Å; F69-I138 HydrophobicContact CZ-CD1 3.38Å; F69-I138 HydrophobicContact CZ-CG1 4.36Å; F69-I138 HydrophobicContact CZ-CG2 3.73Å
70	S	89.6	Confident	86.9	Confident	26 Å²	26	50.4 Å²	50.4	18%	0.182	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	149.2	169.9	62.1	0	0	0	0	109.1	I78 Q79	S70-I78 CarbonylContact O-C 3.48Å; S70-I78 VanDerWaalsContact O-CA 3.31Å; S70-I78 WeakPolarHBondContact O-CA 3.36Å; S70-Q79 PolarHBondContact N-O 2.75Å; S70-Q79 PolarHBondContact O-N 2.89Å; S70-Q79 WeakPolarHBondContact OG-CG 3.29Å; S70-Q79 PolarHBondContact OG-NE2 2.77Å
71	V	90.3	Very high	87.1	Confident	19 Å²	19	53.2 Å²	53.2	12%	0.115	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	131.9	175.6	68.8	0	0	0	0	109.2	L41 F58 I60 V73 L77	L41-V71 HydrophobicContact CD1-CG2 3.7Å; L41-V71 HydrophobicContact CG-CG2 4.33Å; F58-V71 HydrophobicContact CB-CG1 4.04Å; F58-V71 HydrophobicContact CB-CG2 3.72Å; F58-V71 HydrophobicContact CG-CG2 4.45Å; I60-V71 HydrophobicContact CD1-CB 4.11Å; I60-V71 HydrophobicContact CD1-CG1 4.25Å; I60-V71 HydrophobicContact CG1-CB 4.09Å; I60-V71 HydrophobicContact CG1-CG1 3.8Å; V71-V73 PolarHBondContact O-N 3.31Å; V71-L77 CarbonylContact C-O 3.5Å; V71-L77 WeakPolarHBondContact CA-O 3.26Å
72	N	90.3	Very high	87.3	Confident	66 Å²	66	54.2 Å²	54.2	35%	0.353	29%	0.287	S	S	.	.			trans	-65.8	121.4	172.2	-178.3	-56.3	0	0	0	109	T74 T75 G76 L77	N72-T74 PolarHBondContact O-N 3.19Å; N72-T74 PolarHBondContact OD1-N 3.38Å; N72-T74 PolarHBondContact OD1-OG1 3.06Å; N72-T75 WeakPolarHBondContact CB-OG1 3.3Å; N72-T75 PolarHBondContact O-N 3.3Å; N72-T75 PolarHBondContact OD1-N 3.32Å; N72-T75 PolarHBondContact OD1-OG1 3.27Å; N72-G76 WeakPolarHBondContact O-CA 3.49Å; N72-G76 PolarHBondContact O-N 3.5Å; N72-L77 HydrophobicContact CB-CB 4.2Å; N72-L77 PolarHBondContact N-O 2.73Å
73	V	87.4	Confident	87.5	Confident	82 Å²	82	54.6 Å²	54.6	50%	0.497	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-34.6	-170.9	-169.2	0	0	0	0	111.9	R57 F58 V71	R57-V73 CarbonylContact C-O 3.49Å; R57-V73 WeakPolarHBondContact CA-O 3.21Å; R57-V73 HydrophobicContact CB-CG1 3.87Å; R57-V73 HydrophobicContact CG-CG1 4.3Å; F58-V73 PolarHBondContact N-O 3.46Å; V71-V73 PolarHBondContact O-N 3.31Å
74	T	85.2	Confident	87.9	Confident	75 Å²	75	52.4 Å²	52.4	46%	0.46	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-35.7	-177.7	47.4	0	0	0	0	113.6	N72	N72-T74 PolarHBondContact O-N 3.19Å; N72-T74 PolarHBondContact OD1-N 3.38Å; N72-T74 PolarHBondContact OD1-OG1 3.06Å
75	T	87.8	Confident	88.1	Confident	52 Å²	52	47.4 Å²	47.4	32%	0.319	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-15.5	-173.5	67.8	0	0	0	0	113.6	N40 T42 N72 L77	N40-T75 PolarHBondContact OD1-O 2.91Å; N40-T75 VanDerWaalsContact OD1-O 3.12Å; T42-T75 WeakPolarHBondContact CG2-O 3.36Å; T42-T75 PolarHBondContact OG1-O 2.83Å; N72-T75 WeakPolarHBondContact CB-OG1 3.3Å; N72-T75 PolarHBondContact O-N 3.3Å; N72-T75 PolarHBondContact OD1-N 3.32Å; N72-T75 PolarHBondContact OD1-OG1 3.27Å; T75-L77 PolarHBondContact O-N 3.15Å; T75-L77 WeakPolarHBondContact OG1-CD1 3.32Å; T75-L77 VanDerWaalsContact OG1-CG 3.29Å; T75-L77 WeakPolarHBondContact OG1-CG 3.49Å; T75-L77 PolarHBondContact OG1-N 2.78Å
76	G	86.2	Confident	88.2	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.228	C	C	.	.			trans	69.6	9.1	-174.5	0	0	0	0	0	113.9	L41 N72 I78	L41-G76 VanDerWaalsContact CB-O 3.22Å; L41-G76 WeakPolarHBondContact CB-O 3.02Å; L41-G76 VanDerWaalsContact CG-O 3.24Å; L41-G76 WeakPolarHBondContact CG-O 3.07Å; L41-G76 PolarHBondContact N-O 3.1Å; N72-G76 WeakPolarHBondContact O-CA 3.49Å; N72-G76 PolarHBondContact O-N 3.5Å; G76-I78 PolarHBondContact O-N 2.85Å
77	L	91.3	Very high	88.1	Confident	54 Å²	54	45.2 Å²	45.2	28%	0.283	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	118.5	175.2	-66.6	170.9	0	0	0	109.7	I37 N40 V71 N72 T75	I37-L77 HydrophobicContact CD1-CD1 4.24Å; I37-L77 HydrophobicContact CG2-CD2 4.01Å; N40-L77 HydrophobicContact CB-CD2 3.74Å; V71-L77 CarbonylContact C-O 3.5Å; V71-L77 WeakPolarHBondContact CA-O 3.26Å; N72-L77 HydrophobicContact CB-CB 4.2Å; N72-L77 PolarHBondContact N-O 2.73Å; T75-L77 PolarHBondContact O-N 3.15Å; T75-L77 WeakPolarHBondContact OG1-CD1 3.32Å; T75-L77 VanDerWaalsContact OG1-CG 3.29Å; T75-L77 WeakPolarHBondContact OG1-CG 3.49Å; T75-L77 PolarHBondContact OG1-N 2.78Å
78	I	90.8	Very high	87.8	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	129.4	173.2	-176.4	165.6	0	0	0	108.8	F26 I37 I38 G39 L41 I60 F69 S70 G76 L136 I138	F26-I78 HydrophobicContact CE2-CG2 3.96Å; F26-I78 HydrophobicContact CZ-CG2 3.99Å; I37-I78 CarbonylContact C-O 3.52Å; I37-I78 WeakPolarHBondContact CA-O 3.3Å; I38-I78 HydrophobicContact CD1-CD1 3.85Å; I38-I78 HydrophobicContact CD1-CG1 3.78Å; I38-I78 HydrophobicContact CD1-CG2 4.1Å; I38-I78 HydrophobicContact CG1-CB 4.07Å; I38-I78 HydrophobicContact CG1-CD1 4.34Å; I38-I78 HydrophobicContact CG1-CG1 3.81Å; I38-I78 HydrophobicContact CG1-CG2 3.44Å; I38-I78 VanDerWaalsContact CG1-CG2 3.44Å; I38-I78 PolarHBondContact N-O 3.45Å; G39-I78 PolarHBondContact N-O 2.71Å; G39-I78 VanDerWaalsContact O-CG2 3.22Å; G39-I78 WeakPolarHBondContact O-CG2 3.09Å; G39-I78 PolarHBondContact O-N 2.67Å; L41-I78 HydrophobicContact CD2-CG2 4.32Å; I60-I78 HydrophobicContact CD1-CD1 4.4Å; F69-I78 HydrophobicContact CB-CD1 4.06Å; F69-I78 HydrophobicContact CB-CG1 4.19Å; F69-I78 HydrophobicContact CG-CD1 4.48Å; S70-I78 CarbonylContact O-C 3.48Å; S70-I78 VanDerWaalsContact O-CA 3.31Å; S70-I78 WeakPolarHBondContact O-CA 3.36Å; G76-I78 PolarHBondContact O-N 2.85Å; I78-L136 HydrophobicContact CD1-CD1 3.65Å; I78-I138 HydrophobicContact CD1-CD1 4.49Å
79	Q	92.1	Very high	87.3	Confident	61 Å²	61	46.4 Å²	46.4	29%	0.285	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	153.7	-176.9	67.8	-174.9	-11.5	0	0	110.5	T36 I37 F69 S70 N81	T36-Q79 CarbonylContact O-C 3.59Å; T36-Q79 WeakPolarHBondContact O-CA 3.3Å; T36-Q79 WeakPolarHBondContact O-CB 3.03Å; I37-Q79 HydrophobicContact CG1-CB 4.49Å; F69-Q79 CarbonylContact C-O 3.36Å; F69-Q79 WeakPolarHBondContact CA-O 3.1Å; S70-Q79 PolarHBondContact N-O 2.75Å; S70-Q79 PolarHBondContact O-N 2.89Å; S70-Q79 WeakPolarHBondContact OG-CG 3.29Å; S70-Q79 PolarHBondContact OG-NE2 2.77Å; Q79-N81 PolarHBondContact O-N 2.82Å
80	I	90.1	Very high	86.6	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	126.6	172.9	-64.9	177.3	0	0	0	108.9	L32 K35 T36 I38 Y68 F69 Q82 L84	L32-I80 HydrophobicContact CB-CD1 3.4Å; L32-I80 HydrophobicContact CD1-CD1 3.99Å; L32-I80 HydrophobicContact CG-CD1 4.34Å; K35-I80 WeakPolarHBondContact CA-O 3.08Å; K35-I80 PolarHBondContact N-O 2.52Å; T36-I80 PolarHBondContact O-N 2.91Å; I38-I80 HydrophobicContact CG2-CD1 4.03Å; I38-I80 HydrophobicContact CG2-CG1 3.63Å; Y68-I80 CarbonylContact O-C 3.59Å; Y68-I80 WeakPolarHBondContact O-CA 3.27Å; F69-I80 HydrophobicContact CE1-CG1 4.49Å; I80-Q82 WeakPolarHBondContact CG2-O 3.27Å; I80-L84 HydrophobicContact CD1-CD1 3.76Å; I80-L84 HydrophobicContact CG1-CD1 4.09Å; I80-L84 HydrophobicContact CG2-CG 4.5Å
81	N	89.4	Confident	85.3	Confident	84 Å²	84	51.4 Å²	51.4	45%	0.449	27%	0.268	S	S	.	.			trans	-103.8	-22.6	180	-172.6	63.3	0	0	0	112.4	R67 Y68 Q79	R67-N81 WeakPolarHBondContact O-CB 3.35Å; R67-N81 PolarHBondContact O-ND2 2.84Å; Y68-N81 PolarHBondContact O-N 3.09Å; Q79-N81 PolarHBondContact O-N 2.82Å
82	Q	88.7	Confident	83.8	Confident	78 Å²	78	54.4 Å²	54.4	36%	0.364	28%	0.279	S	S	.	.	S	Bend	trans	-145.6	146.5	177.5	-173.4	172.9	-2.2	0	0	109.2	Y68 I80 L84	Y68-Q82 HydrophobicContact CD1-CB 4.05Å; Y68-Q82 HydrophobicContact CD1-CG 4.35Å; I80-Q82 WeakPolarHBondContact CG2-O 3.27Å; Q82-L84 PolarHBondContact O-N 2.99Å
83	R	86.5	Confident	81.8	Confident	134 Å²	134	57 Å²	57	51%	0.506	30%	0.298	S	S	.	.			trans	-45.8	127.3	175.1	179.3	177.7	161.6	163.3	10.6	110.3	E31	E31-R83 IonicContact OE1-CZ 3.56Å; E31-R83 IonicContact OE1-NE 2.74Å; E31-R83 PolarHBondContact OE1-NE 3.37Å; E31-R83 IonicContact OE1-NH2 2.7Å; E31-R83 PolarHBondContact OE1-NH2 2.97Å; E31-R83 WeakPolarHBondContact OE2-CD 3.21Å; E31-R83 WeakPolarHBondContact OE2-CG 3.36Å; E31-R83 IonicContact OE2-CZ 2.69Å; E31-R83 IonicContact OE2-NE 2.88Å; E31-R83 PolarHBondContact OE2-NE 2.89Å; E31-R83 IonicContact OE2-NH1 3.67Å; E31-R83 IonicContact OE2-NH2 3.74Å; E31-R83 PolarHBondContact OE2-NH2 3.5Å; E31-R83 VanDerWaalsContact OE2-NH2 3.16Å
84	L	86.1	Confident	79.6	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.295	C	S	.	.			trans	-94.8	124	173.2	-66.7	170.3	0	0	0	106.8	I28 E31 Y68 F69 I80 Q82 I89 I114 I140	I28-L84 HydrophobicContact CD1-CD1 3.21Å; I28-L84 HydrophobicContact CG1-CD1 4.19Å; E31-L84 PolarHBondContact N-O 2.8Å; Y68-L84 HydrophobicContact CD1-CD2 3.68Å; Y68-L84 HydrophobicContact CE1-CD2 4.47Å; Y68-L84 HydrophobicContact CG-CD2 3.83Å; F69-L84 HydrophobicContact CE1-CD1 4.08Å; F69-L84 HydrophobicContact CE2-CD2 4.36Å; F69-L84 HydrophobicContact CZ-CD1 4.05Å; F69-L84 HydrophobicContact CZ-CD2 3.86Å; I80-L84 HydrophobicContact CD1-CD1 3.76Å; I80-L84 HydrophobicContact CG1-CD1 4.09Å; I80-L84 HydrophobicContact CG2-CG 4.5Å; Q82-L84 PolarHBondContact O-N 2.99Å; L84-I89 HydrophobicContact CB-CD1 4.27Å; L84-I89 HydrophobicContact CD2-CD1 3.72Å; L84-I114 HydrophobicContact CD2-CD1 4.23Å; L84-I140 HydrophobicContact CD2-CD1 4.12Å
85	D	85.2	Confident	77.1	Confident	36 Å²	36	61.5 Å²	61.5	19%	0.193	31%	0.308	C	S	.	.			trans	-133.6	112.8	-176.1	160.2	-12.8	0	0	0	104.1	E87 K88 I89	D85-E87 PolarHBondContact OD1-N 2.94Å; D85-K88 HydrophobicContact CB-CB 4.04Å; D85-K88 PolarHBondContact O-N 3.1Å; D85-K88 VanDerWaalsContact OD1-CB 3.26Å; D85-K88 WeakPolarHBondContact OD1-CB 3.17Å; D85-K88 PolarHBondContact OD1-N 2.9Å; D85-K88 VanDerWaalsContact OD2-CB 3.25Å; D85-K88 WeakPolarHBondContact OD2-CB 3.3Å; D85-I89 WeakPolarHBondContact O-CB 3.26Å; D85-I89 WeakPolarHBondContact O-CD1 3.4Å; D85-I89 WeakPolarHBondContact O-CG1 3.45Å; D85-I89 PolarHBondContact O-N 3.39Å
86	H	84.5	Confident	74.3	Confident	15 Å²	15	68.1 Å²	68.1	7%	0.069	34%	0.335	C	S	.	.	H	α-helix	trans	-65.3	-42.9	-170.5	174.2	-95.2	0	0	0	110.2	E30 K88 I89 C90 C112 I140 D142	E30-H86 HydrophobicContact CB-CB 4.2Å; E30-H86 VanDerWaalsContact CD-CB 3.43Å; E30-H86 HydrophobicContact CG-CB 4.37Å; E30-H86 WeakPolarHBondContact OE1-CB 3.12Å; E30-H86 WeakPolarHBondContact OE2-CA 3.5Å; E30-H86 WeakPolarHBondContact OE2-CB 3.5Å; E30-H86 PolarHBondContact OE2-N 3.19Å; H86-K88 PolarHBondContact O-N 3.27Å; H86-I89 PolarHBondContact O-N 3.34Å; H86-C90 WeakPolarHBondContact O-CA 3.21Å; H86-C90 WeakPolarHBondContact O-CB 3.37Å; H86-C90 PolarHBondContact O-N 3.21Å; H86-C112 WeakPolarHBondContact CD2-CB 3.44Å; H86-C112 VanDerWaalsContact CD2-SG 3.59Å; H86-C112 WeakPolarHBondContact NE2-CB 3.43Å; H86-I140 HydrophobicContact CB-CG2 4.16Å; H86-D142 IonicContact CE1-OD2 2.63Å; H86-D142 PolarHBondContact CE1-OD2 3.25Å; H86-D142 VanDerWaalsContact CE1-OD2 3.24Å; H86-D142 IonicContact ND1-OD2 3.63Å; H86-D142 PolarHBondContact ND1-OD2 2.89Å
87	E	80.6	Confident	71.5	Confident	29 Å²	29	73.7 Å²	73.7	14%	0.136	37%	0.369	C	S	.	.	H	α-helix	trans	-66.3	-31	-179	-71.6	55	-108.3	0	0	110.6	D85 P91 L181	D85-E87 PolarHBondContact OD1-N 2.94Å; E87-P91 WeakPolarHBondContact O-CA 3.27Å; E87-L181 HydrophobicContact CG-CB 4.06Å
88	K	81.1	Confident	68.5	Low	139 Å²	139	78.5 Å²	78.5	60%	0.604	40%	0.395	S	S	*	.	H	α-helix	trans	-84.5	-35.6	176.6	-174.4	176.1	-174.5	170.8	0	114.1	D85 H86	D85-K88 HydrophobicContact CB-CB 4.04Å; D85-K88 PolarHBondContact O-N 3.1Å; D85-K88 VanDerWaalsContact OD1-CB 3.26Å; D85-K88 WeakPolarHBondContact OD1-CB 3.17Å; D85-K88 PolarHBondContact OD1-N 2.9Å; D85-K88 VanDerWaalsContact OD2-CB 3.25Å; D85-K88 WeakPolarHBondContact OD2-CB 3.3Å; H86-K88 PolarHBondContact O-N 3.27Å
89	I	80.5	Confident	65.6	Low	21 Å²	21	80.4 Å²	80.4	11%	0.108	41%	0.408	C	S	.	.	H	α-helix	trans	-78.8	-34.7	-179.6	-67.8	165	0	0	0	110.2	Y65 Y68 L84 D85 H86 P91 I114 I140	Y65-I89 HydrophobicContact CE1-CG2 4.33Å; Y68-I89 HydrophobicContact CD1-CD1 4.39Å; Y68-I89 HydrophobicContact CE1-CD1 3.96Å; Y68-I89 HydrophobicContact CE1-CG1 4.24Å; Y68-I89 HydrophobicContact CE2-CG1 4.48Å; L84-I89 HydrophobicContact CB-CD1 4.27Å; L84-I89 HydrophobicContact CD2-CD1 3.72Å; D85-I89 WeakPolarHBondContact O-CB 3.26Å; D85-I89 WeakPolarHBondContact O-CD1 3.4Å; D85-I89 WeakPolarHBondContact O-CG1 3.45Å; D85-I89 PolarHBondContact O-N 3.39Å; H86-I89 PolarHBondContact O-N 3.34Å; I89-P91 VanDerWaalsContact C-CD 3.42Å; I89-P91 WeakPolarHBondContact O-CD 3.49Å; I89-I114 HydrophobicContact CD1-CD1 4.28Å; I89-I114 HydrophobicContact CG2-CD1 4.08Å; I89-I114 HydrophobicContact CG2-CG1 4.13Å; I89-I140 HydrophobicContact CB-CD1 4.46Å; I89-I140 HydrophobicContact CD1-CD1 3.61Å; I89-I140 HydrophobicContact CG2-CD1 4.04Å
90	C	76.1	Confident	62.5	Low	39 Å²	39	81.1 Å²	81.1	26%	0.264	41%	0.414	S	S	.	.	S	Bend	trans	-125.3	63.3	-177.2	-67.1	0	0	0	0	110.7	H86 K92 C112	H86-C90 WeakPolarHBondContact O-CA 3.21Å; H86-C90 WeakPolarHBondContact O-CB 3.37Å; H86-C90 PolarHBondContact O-N 3.21Å; C90-K92 PolarHBondContact O-N 3.07Å; C90-C112 HydrophobicContact CB-CB 3.89Å; C90-C112 WeakPolarHBondContact CB-SG 3.3Å; C90-C112 WeakPolarHBondContact SG-CA 3.31Å; C90-C112 WeakPolarHBondContact SG-CB 3.18Å; C90-C112 CovalentContact SG-SG 2.05Å; C90-C112 PolarHBondContact SG-SG 3.42Å
91	P	61.3	Low	59.7	Low	96 Å²	96	87.5 Å²	87.5	62%	0.623	45%	0.447	S	S	*	.			trans	-64.5	129.9	-172.4	26.2	-34.3	0	0	0	112.7	E87 I89	E87-P91 WeakPolarHBondContact O-CA 3.27Å; I89-P91 VanDerWaalsContact C-CD 3.42Å; I89-P91 WeakPolarHBondContact O-CD 3.49Å
92	K	57.9	Low	56.9	Low	82 Å²	82	90.9 Å²	90.9	36%	0.357	46%	0.46	S	S	.	.			trans	-93.8	131.4	178.5	-57	-173.8	-172.9	-141.4	0	110	C90 L94 T183 V221	C90-K92 PolarHBondContact O-N 3.07Å; K92-L94 PolarHBondContact O-N 3.46Å; K92-T183 HydrophobicContact CD-CG2 3.67Å; K92-T183 WeakPolarHBondContact CE-OG1 3.17Å; K92-T183 VanDerWaalsContact NZ-CB 3.28Å; K92-T183 PolarHBondContact NZ-OG1 3.5Å; K92-V221 HydrophobicContact CB-CG1 4.44Å; K92-V221 HydrophobicContact CD-CG1 4.37Å
93	T	48.4	Very low	53.9	Low	121 Å²	121	93.3 Å²	93.3	74%	0.742	48%	0.475	S	S	*	.			trans	-74.5	111.3	179.6	49.1	0	0	0	0	110.7	F95	T93-F95 PolarHBondContact O-N 3.47Å
94	L	41.5	Very low	51	Low	84 Å²	84	91.6 Å²	91.6	44%	0.44	48%	0.482	S	S	.	.	S	Bend	trans	-64.3	-6.3	171.5	-83.5	133	0	0	0	114.4	K92 V179 L181 V221	K92-L94 PolarHBondContact O-N 3.46Å; L94-V179 HydrophobicContact CD2-CG1 4.03Å; L94-L181 HydrophobicContact CD1-CD2 4.32Å; L94-V221 HydrophobicContact CD2-CG2 4.17Å; L94-V221 HydrophobicContact CG-CG2 4.37Å
95	F	33.1	Very low	48.2	Very low	167 Å²	167	97.9 Å²	97.9	73%	0.732	52%	0.52	S	S	*	.			trans	-135.8	111.2	-173.6	-63	-79.3	0	0	0	112.7	T93 T97	T93-F95 PolarHBondContact O-N 3.47Å; F95-T97 PolarHBondContact O-N 2.76Å
96	H	29.2	Very low	45.4	Very low	190 Å²	190	102.2 Å²	102.2	88%	0.88	55%	0.547	S	S	*	.			trans	-82.2	96.5	150.7	-95.2	-68.2	0	0	0	107.8
97	T	27.8	Very low	42.6	Very low	117 Å²	117	109.3 Å²	109.3	72%	0.718	59%	0.586	S	S	*	*			trans	-80.8	117.2	162	50.9	0	0	0	0	108.3	F95 S99	F95-T97 PolarHBondContact O-N 2.76Å; T97-S99 PolarHBondContact O-N 2.79Å; T97-S99 VanDerWaalsContact O-N 3.11Å
98	N	27.3	Very low	40.3	Very low	156 Å²	156	112.6 Å²	112.6	83%	0.834	61%	0.612	S	S	*	*			trans	-48.6	116.2	175.2	-106.5	-14.5	0	0	0	111.2
99	S	29.7	Very low	38.3	Very low	39 Å²	39	113.5 Å²	113.5	27%	0.273	62%	0.624	S	S	.	*			trans	-167	94.6	162.8	112.9	0	0	0	0	106.3	T97 K1052 I1053 I1054	T97-S99 PolarHBondContact O-N 2.79Å; T97-S99 VanDerWaalsContact O-N 3.11Å; S99-K1052 PolarHBondContact OG-O 3.3Å; S99-I1053 WeakPolarHBondContact OG-CA 3.08Å; S99-I1053 PolarHBondContact OG-N 3.28Å; S99-I1054 WeakPolarHBondContact CA-O 3.35Å; S99-I1054 WeakPolarHBondContact CB-O 3.13Å; S99-I1054 WeakPolarHBondContact O-CD1 3.37Å; S99-I1054 PolarHBondContact OG-N 3.29Å
100	N	27.4	Very low	36.9	Very low	76 Å²	76	117 Å²	117	41%	0.406	65%	0.65	S	S	.	*			trans	-60.3	102.3	175.2	31.4	-59.3	0	0	0	127.5	I1054 K1055	N100-I1054 VanDerWaalsContact C-CB 3.43Å; N100-I1054 VanDerWaalsContact CA-CB 3.43Å; N100-I1054 HydrophobicContact CB-CB 3.93Å; N100-I1054 HydrophobicContact CB-CG1 4.28Å; N100-I1054 HydrophobicContact CB-CG2 3.92Å; N100-I1054 VanDerWaalsContact N-CD1 3.3Å; N100-I1054 WeakPolarHBondContact ND2-CG2 3.07Å; N100-I1054 WeakPolarHBondContact O-CB 3.27Å; N100-I1054 WeakPolarHBondContact O-CD1 3.43Å; N100-I1054 WeakPolarHBondContact O-CG1 3.29Å; N100-I1054 WeakPolarHBondContact O-CG2 3.38Å; N100-K1055 PolarHBondContact ND2-O 2.88Å; N100-K1055 PolarHBondContact OD1-O 2.84Å
101	I	31.2	Very low	36.1	Very low	135 Å²	135	119.6 Å²	119.6	69%	0.692	66%	0.661	S	S	*	*			trans	-161.8	82.2	159.8	-65.9	-176.9	0	0	0	99	I1054	I101-I1054 HydrophobicContact CB-CD1 3.62Å; I101-I1054 HydrophobicContact CB-CG1 4.22Å; I101-I1054 HydrophobicContact CD1-CG1 4.45Å; I101-I1054 HydrophobicContact CG1-CD1 3.69Å; I101-I1054 HydrophobicContact CG1-CG1 3.7Å; I101-I1054 HydrophobicContact CG1-CG2 4.47Å
102	H	31	Very low	36.9	Very low	154 Å²	154	115.6 Å²	115.6	71%	0.713	64%	0.635	S	S	*	*				68.6	92.9	103.3	-86.1	-60.6	0	0	0	111.7
103	D	26.1	Very low	38	Very low	129 Å²	129	115.9 Å²	115.9	69%	0.69	64%	0.638	S	S	*	*				61.6	154.2	129.9	-59.5	-41.2	0	0	0	119.9
104	P	25.7	Very low	39.7	Very low	99 Å²	99	110.1 Å²	110.1	64%	0.643	60%	0.602	S	S	*	*			cis	-127.7	155.2	-2.9	29.7	-9.4	0	0	0	114	T106	P104-T106 PolarHBondContact O-N 3.14Å
105	V	26.4	Very low	41.6	Very low	131 Å²	131	109.2 Å²	109.2	79%	0.794	60%	0.6	S	S	*	*			trans	-2.5	110.1	136.2	-178.6	0	0	0	0	114.2
106	T	26.4	Very low	44.1	Very low	127 Å²	127	101.3 Å²	101.3	78%	0.779	57%	0.566	S	S	*	*			trans	-166.3	103.1	135.7	30.9	0	0	0	0	110.7	P104 S108	P104-T106 PolarHBondContact O-N 3.14Å; T106-S108 PolarHBondContact O-N 2.87Å
107	N	26.1	Very low	46.9	Very low	165 Å²	165	94.1 Å²	94.1	88%	0.882	53%	0.534	S	S	*	.			trans	24.1	93.8	143.4	-75.1	-17.2	0	0	0	119
108	S	33.3	Very low	49.6	Very low	98 Å²	98	88.6 Å²	88.6	69%	0.685	50%	0.5	S	S	*	.			trans	-156.9	16.1	136.3	70.9	0	0	0	0	115.5	T106 S110	T106-S108 PolarHBondContact O-N 2.87Å; S108-S110 PolarHBondContact O-N 3.35Å
109	D	38.3	Very low	52.4	Low	158 Å²	158	82.4 Å²	82.4	85%	0.845	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	20.3	174.4	-91.1	1.9	0	0	0	113.8
110	S	50.5	Low	55.1	Low	95 Å²	95	80.6 Å²	80.6	66%	0.664	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110	2.1	-169.4	57.8	0	0	0	0	115.3	S108	S108-S110 PolarHBondContact O-N 3.35Å
111	L	60.5	Low	57.8	Low	93 Å²	93	78.3 Å²	78.3	49%	0.487	44%	0.442	S	S	.	.			trans	-144.8	109.5	175.8	-97.2	105	0	0	0	111.4	Q113 T139	L111-Q113 HydrophobicContact CB-CG 4.04Å; L111-Q113 HydrophobicContact CD2-CG 4.11Å; L111-Q113 PolarHBondContact O-N 3.28Å; L111-T139 HydrophobicContact CD2-CG2 3.43Å; L111-T139 VanDerWaalsContact CD2-CG2 3.43Å; L111-T139 HydrophobicContact CG-CG2 4.11Å
112	C	77	Confident	60.3	Low	11 Å²	11	75 Å²	75	7%	0.074	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	95.6	167.2	-172.8	0	0	0	0	108.7	H86 C90 T139 I140	H86-C112 WeakPolarHBondContact CD2-CB 3.44Å; H86-C112 VanDerWaalsContact CD2-SG 3.59Å; H86-C112 WeakPolarHBondContact NE2-CB 3.43Å; C90-C112 HydrophobicContact CB-CB 3.89Å; C90-C112 WeakPolarHBondContact CB-SG 3.3Å; C90-C112 WeakPolarHBondContact SG-CA 3.31Å; C90-C112 WeakPolarHBondContact SG-CB 3.18Å; C90-C112 CovalentContact SG-SG 2.05Å; C90-C112 PolarHBondContact SG-SG 3.42Å; C112-T139 CarbonylContact O-C 3.47Å; C112-T139 WeakPolarHBondContact O-CA 3.49Å; C112-I140 HydrophobicContact CB-CB 4.28Å; C112-I140 PolarHBondContact O-N 3.11Å
113	Q	81.2	Confident	62.5	Low	89 Å²	89	70.4 Å²	70.4	42%	0.416	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	123	-173.8	-86.9	179.7	-3	0	0	112	L111 I137 I138 T139	L111-Q113 HydrophobicContact CB-CG 4.04Å; L111-Q113 HydrophobicContact CD2-CG 4.11Å; L111-Q113 PolarHBondContact O-N 3.28Å; Q113-I137 HydrophobicContact CG-CG2 4.32Å; Q113-I138 WeakPolarHBondContact CA-O 3.31Å; Q113-T139 HydrophobicContact CG-CG2 4.47Å; Q113-T139 WeakPolarHBondContact CG-OG1 3.45Å; Q113-T139 PolarHBondContact NE2-OG1 3.44Å
114	I	83.7	Confident	64.8	Low	0 Å²	0	67.7 Å²	67.7	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	134.8	168.1	-70.3	-176.8	0	0	0	109.4	Y65 Y68 F69 L84 I89 L116 I137 I138 I140	Y65-I114 HydrophobicContact CD1-CB 4.41Å; Y65-I114 HydrophobicContact CD1-CD1 3.81Å; Y65-I114 HydrophobicContact CD1-CG1 3.69Å; Y65-I114 HydrophobicContact CD1-CG2 4.13Å; Y65-I114 HydrophobicContact CD2-CG2 3.95Å; Y65-I114 HydrophobicContact CE1-CG1 4.07Å; Y65-I114 HydrophobicContact CG-CB 4.23Å; Y65-I114 HydrophobicContact CG-CD1 4.27Å; Y65-I114 HydrophobicContact CG-CG1 4.01Å; Y65-I114 HydrophobicContact CG-CG2 3.53Å; Y68-I114 HydrophobicContact CD2-CD1 4.3Å; F69-I114 HydrophobicContact CE2-CB 4.47Å; F69-I114 HydrophobicContact CE2-CD1 3.85Å; F69-I114 HydrophobicContact CE2-CG2 3.89Å; F69-I114 HydrophobicContact CZ-CD1 4.24Å; L84-I114 HydrophobicContact CD2-CD1 4.23Å; I89-I114 HydrophobicContact CD1-CD1 4.28Å; I89-I114 HydrophobicContact CG2-CD1 4.08Å; I89-I114 HydrophobicContact CG2-CG1 4.13Å; I114-L116 HydrophobicContact CG2-CD2 3.91Å; I114-I137 CarbonylContact O-C 3.53Å; I114-I137 WeakPolarHBondContact O-CA 3.49Å; I114-I138 HydrophobicContact CB-CB 4.29Å; I114-I138 PolarHBondContact N-O 3.49Å; I114-I138 PolarHBondContact O-N 3.37Å; I114-I140 HydrophobicContact CD1-CD1 3.6Å; I114-I140 HydrophobicContact CG1-CD1 3.99Å
115	T	82.4	Confident	66.8	Low	64 Å²	64	71.8 Å²	71.8	39%	0.393	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	132.2	170.6	57.9	0	0	0	0	111.4	L136 I137	T115-L136 WeakPolarHBondContact CA-O 3.44Å; T115-I137 HydrophobicContact CG2-CG1 4.17Å; T115-I137 HydrophobicContact CG2-CG2 4.36Å
116	L	86.1	Confident	68.4	Low	2 Å²	2	70.8 Å²	70.8	1%	0.01	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	161.8	177.9	61.9	100.5	0	0	0	110.9	I60 F69 I114 L136 I138	I60-L116 HydrophobicContact CD1-CD1 4.3Å; I60-L116 HydrophobicContact CG1-CD1 4.22Å; I60-L116 HydrophobicContact CG2-CD1 3.99Å; F69-L116 HydrophobicContact CB-CD2 4.23Å; F69-L116 HydrophobicContact CD2-CD2 3.22Å; F69-L116 HydrophobicContact CE2-CD2 3.84Å; F69-L116 HydrophobicContact CG-CD2 3.93Å; I114-L116 HydrophobicContact CG2-CD2 3.91Å; L116-L136 HydrophobicContact CD1-CB 3.91Å; L116-L136 HydrophobicContact CD1-CD1 3.47Å; L116-L136 VanDerWaalsContact CD1-CD1 3.47Å; L116-L136 HydrophobicContact CD1-CG 4.12Å; L116-L136 HydrophobicContact CG-CB 4.04Å; L116-L136 HydrophobicContact CG-CD1 4.49Å; L116-L136 PolarHBondContact N-O 3.37Å; L116-L136 WeakPolarHBondContact O-CA 3.47Å; L116-L136 VanDerWaalsContact O-CB 3.31Å; L116-L136 WeakPolarHBondContact O-CB 3.31Å; L116-L136 PolarHBondContact O-N 3.15Å; L116-I138 HydrophobicContact CD2-CD1 3.83Å
117	N	86.5	Confident	70.3	Confident	39 Å²	39	66.3 Å²	66.3	21%	0.209	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	150.6	-177.4	-67.3	-63.1	0	0	0	110.7	I60 I61 V133 M134 H135	I60-N117 CarbonylContact C-O 3.48Å; I60-N117 WeakPolarHBondContact CA-O 3.2Å; I61-N117 HydrophobicContact CB-CB 4.1Å; I61-N117 HydrophobicContact CD1-CB 3.56Å; I61-N117 HydrophobicContact CG1-CB 3.93Å; I61-N117 PolarHBondContact N-O 3.37Å; N117-V133 HydrophobicContact CB-CG1 4.15Å; N117-M134 CarbonylContact C-O 3.49Å; N117-M134 VanDerWaalsContact CA-O 3.29Å; N117-M134 WeakPolarHBondContact CA-O 3.45Å; N117-H135 PolarHBondContact OD1-CD2 3.25Å; N117-H135 VanDerWaalsContact OD1-CD2 3.31Å
118	A	86.1	Confident	72.4	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	125.1	174	0	0	0	0	0	111.5	L41 R59 I60 M134 L136	L41-A118 HydrophobicContact CD1-CB 3.97Å; R59-A118 CarbonylContact O-C 3.58Å; R59-A118 WeakPolarHBondContact O-CA 3.42Å; I60-A118 HydrophobicContact CG1-CB 4.41Å; A118-M134 HydrophobicContact CB-CB 4.43Å; A118-M134 PolarHBondContact N-O 2.79Å; A118-M134 PolarHBondContact O-N 2.79Å; A118-L136 HydrophobicContact CB-CD1 3.96Å
119	N	85.7	Confident	74.3	Confident	27 Å²	27	62.3 Å²	62.3	14%	0.144	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	135.7	172.4	-70	-15.2	0	0	0	110.5	F58 R59 I61 L121	F58-N119 CarbonylContact C-O 3.58Å; F58-N119 WeakPolarHBondContact CA-O 3.19Å; R59-N119 PolarHBondContact N-O 3.2Å; R59-N119 PolarHBondContact O-N 2.92Å; I61-N119 WeakPolarHBondContact CD1-OD1 3.43Å; I61-N119 WeakPolarHBondContact CG1-OD1 3.07Å; N119-L121 HydrophobicContact CB-CD2 4.09Å; N119-L121 HydrophobicContact CB-CG 4.39Å
120	I	86.5	Confident	75.9	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	113	163.7	-56.5	151.1	0	0	0	106.6	L22 L45 L49 L56 F58 I130 V131 E132 M134	L22-I120 HydrophobicContact CD2-CD1 4.2Å; L45-I120 HydrophobicContact CD2-CD1 3.53Å; L45-I120 HydrophobicContact CD2-CG1 4.08Å; L45-I120 HydrophobicContact CD2-CG2 4.32Å; L49-I120 HydrophobicContact CD1-CD1 4.32Å; L56-I120 HydrophobicContact CB-CG2 4.36Å; L56-I120 HydrophobicContact CD1-CG2 4.05Å; L56-I120 HydrophobicContact CD2-CG2 3.93Å; L56-I120 HydrophobicContact CG-CG2 4.33Å; F58-I120 HydrophobicContact CD1-CG1 4.13Å; F58-I120 HydrophobicContact CE1-CG1 4.01Å; I120-I130 CarbonylContact O-C 3.56Å; I120-V131 HydrophobicContact CG2-CB 4.31Å; I120-V131 HydrophobicContact CG2-CG2 4.48Å; I120-V131 PolarHBondContact O-N 3.1Å; I120-E132 WeakPolarHBondContact CB-O 3.47Å; I120-E132 HydrophobicContact CD1-CB 3.7Å; I120-E132 HydrophobicContact CD1-CG 4.09Å; I120-E132 PolarHBondContact N-O 2.87Å; I120-E132 PolarHBondContact O-N 3.31Å; I120-M134 HydrophobicContact CD1-CE 3.49Å; I120-M134 VanDerWaalsContact CD1-CE 3.49Å; I120-M134 HydrophobicContact CD1-CG 3.98Å; I120-M134 HydrophobicContact CG1-CE 3.75Å; I120-M134 HydrophobicContact CG1-CG 4.48Å
121	L	83.3	Confident	77.2	Confident	29 Å²	29	57.6 Å²	57.6	15%	0.152	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	135.6	-178.7	-52.8	171.6	0	0	0	108.9	L56 R57 R59 N119 V128 D129 I130	L56-L121 CarbonylContact C-O 3.52Å; L56-L121 WeakPolarHBondContact CA-O 3.34Å; R57-L121 HydrophobicContact CB-CB 4.16Å; R57-L121 PolarHBondContact N-O 2.71Å; R57-L121 WeakPolarHBondContact O-CB 3.25Å; R57-L121 PolarHBondContact O-N 3.47Å; R59-L121 HydrophobicContact CB-CD1 4.3Å; N119-L121 HydrophobicContact CB-CD2 4.09Å; N119-L121 HydrophobicContact CB-CG 4.39Å; L121-V128 HydrophobicContact CB-CG1 3.83Å; L121-V128 HydrophobicContact CD1-CG1 4.26Å; L121-V128 HydrophobicContact CD2-CG1 4.28Å; L121-V128 HydrophobicContact CG-CG1 4.35Å; L121-D129 CarbonylContact C-O 3.51Å; L121-D129 VanDerWaalsContact CA-O 3.24Å; L121-D129 WeakPolarHBondContact CA-O 3.18Å; L121-I130 HydrophobicContact CD2-CB 4.27Å; L121-I130 HydrophobicContact CD2-CG1 3.47Å; L121-I130 VanDerWaalsContact CD2-CG1 3.47Å
122	R	83.8	Confident	78.1	Confident	65 Å²	65	55.1 Å²	55.1	25%	0.245	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	123.4	167.3	-177.9	-176.7	-74.1	162.3	-4.1	108	D52 Q55 L56 M124 V128 D129 V131	D52-R122 IonicContact OD2-CZ 2.92Å; D52-R122 VanDerWaalsContact OD2-CZ 3.28Å; D52-R122 IonicContact OD2-NE 2.64Å; D52-R122 IonicContact OD2-NH2 3.9Å; D52-R122 PolarHBondContact OD2-NH2 3.45Å; Q55-R122 HydrophobicContact CB-CG 3.97Å; Q55-R122 CarbonylContact O-C 3.6Å; Q55-R122 WeakPolarHBondContact O-CA 3.35Å; L56-R122 HydrophobicContact CD2-CB 4.08Å; R122-M124 HydrophobicContact CG-CG 4.13Å; R122-V128 WeakPolarHBondContact O-CA 3.39Å; R122-D129 PolarHBondContact N-O 3.17Å; R122-D129 PolarHBondContact O-N 2.95Å; R122-V131 HydrophobicContact CB-CG2 3.28Å
123	V	78.2	Confident	78.3	Confident	57 Å²	57	56.4 Å²	56.4	35%	0.345	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	110.9	178.3	-177.2	0	0	0	0	108.2	Q55 R57 V128	Q55-V123 PolarHBondContact O-N 3.02Å; R57-V123 HydrophobicContact CB-CG2 4.35Å; R57-V123 HydrophobicContact CG-CG2 3.49Å; R57-V123 VanDerWaalsContact CG-CG2 3.49Å; V123-V128 HydrophobicContact CG1-CG2 4.47Å; V123-V128 HydrophobicContact CG2-CG1 4.41Å; V123-V128 HydrophobicContact CG2-CG2 4.23Å
124	M	72.6	Confident	78.6	Confident	72 Å²	72	52.2 Å²	52.2	36%	0.355	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	161.8	172.6	-61.6	-172.7	-68.9	0	0	109.5	R122 S126 G127 D129	R122-M124 HydrophobicContact CG-CG 4.13Å; M124-S126 PolarHBondContact O-N 2.89Å; M124-G127 PolarHBondContact N-O 2.78Å; M124-G127 PolarHBondContact O-N 3.18Å; M124-G127 VanDerWaalsContact O-N 3.17Å; M124-D129 VanDerWaalsContact CE-OD2 3.29Å; M124-D129 WeakPolarHBondContact CE-OD2 3.31Å
125	N	69.5	Low	78.7	Confident	186 Å²	186	54.8 Å²	54.8	100%	0.995	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-15.3	177.8	-71.7	-11.7	0	0	0	113.8
126	S	59.3	Low	79	Confident	109 Å²	109	51.7 Å²	51.7	76%	0.762	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.4	7.1	-176.9	56.5	0	0	0	0	115	M124	M124-S126 PolarHBondContact O-N 2.89Å
127	G	66.9	Low	79.1	Confident	34 Å²	34	52.9 Å²	52.9	35%	0.351	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	153	176.2	-179.8	0	0	0	0	0	114.3	M124	M124-G127 PolarHBondContact N-O 2.78Å; M124-G127 PolarHBondContact O-N 3.18Å; M124-G127 VanDerWaalsContact O-N 3.17Å
128	V	69.6	Low	79.2	Confident	88 Å²	88	51 Å²	51	53%	0.533	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	117	174.4	-178.4	0	0	0	0	108	L121 R122 V123	L121-V128 HydrophobicContact CB-CG1 3.83Å; L121-V128 HydrophobicContact CD1-CG1 4.26Å; L121-V128 HydrophobicContact CD2-CG1 4.28Å; L121-V128 HydrophobicContact CG-CG1 4.35Å; R122-V128 WeakPolarHBondContact O-CA 3.39Å; V123-V128 HydrophobicContact CG1-CG2 4.47Å; V123-V128 HydrophobicContact CG2-CG1 4.41Å; V123-V128 HydrophobicContact CG2-CG2 4.23Å
129	D	72.3	Confident	79.2	Confident	90 Å²	90	51.9 Å²	51.9	48%	0.481	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	139.1	177.5	-70.3	-27.2	0	0	0	110.1	L121 R122 M124 V131	L121-D129 CarbonylContact C-O 3.51Å; L121-D129 VanDerWaalsContact CA-O 3.24Å; L121-D129 WeakPolarHBondContact CA-O 3.18Å; R122-D129 PolarHBondContact N-O 3.17Å; R122-D129 PolarHBondContact O-N 2.95Å; M124-D129 VanDerWaalsContact CE-OD2 3.29Å; M124-D129 WeakPolarHBondContact CE-OD2 3.31Å; D129-V131 PolarHBondContact O-N 3.01Å
130	I	72.9	Confident	79.2	Confident	105 Å²	105	50.8 Å²	50.8	54%	0.538	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	113.8	167.2	-60.6	163.9	0	0	0	107	I120 L121 V133	I120-I130 CarbonylContact O-C 3.56Å; L121-I130 HydrophobicContact CD2-CB 4.27Å; L121-I130 HydrophobicContact CD2-CG1 3.47Å; L121-I130 VanDerWaalsContact CD2-CG1 3.47Å; I130-V133 HydrophobicContact CG2-CG2 4.25Å
131	V	76.5	Confident	78.9	Confident	49 Å²	49	56.6 Å²	56.6	30%	0.297	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	-45.7	180	-165	0	0	0	0	111.2	L49 L56 I120 R122 D129	L49-V131 HydrophobicContact CD1-CG1 4Å; L49-V131 HydrophobicContact CD2-CB 4.48Å; L49-V131 HydrophobicContact CD2-CG1 3.34Å; L49-V131 HydrophobicContact CG-CG1 4.33Å; L56-V131 HydrophobicContact CD2-CG2 3.92Å; I120-V131 HydrophobicContact CG2-CB 4.31Å; I120-V131 HydrophobicContact CG2-CG2 4.48Å; I120-V131 PolarHBondContact O-N 3.1Å; R122-V131 HydrophobicContact CB-CG2 3.28Å; D129-V131 PolarHBondContact O-N 3.01Å
132	E	79.6	Confident	78.7	Confident	41 Å²	41	56.3 Å²	56.3	19%	0.192	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	159.6	-174	-174.1	159.2	-130.2	0	0	110.2	L49 I120	L49-E132 HydrophobicContact CD1-CB 4.21Å; L49-E132 VanDerWaalsContact CD1-OE2 3.26Å; L49-E132 WeakPolarHBondContact CD1-OE2 3.25Å; I120-E132 WeakPolarHBondContact CB-O 3.47Å; I120-E132 HydrophobicContact CD1-CB 3.7Å; I120-E132 HydrophobicContact CD1-CG 4.09Å; I120-E132 PolarHBondContact N-O 2.87Å; I120-E132 PolarHBondContact O-N 3.31Å
133	V	81.8	Confident	78.4	Confident	39 Å²	39	55.5 Å²	55.5	24%	0.236	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	123.7	176.9	-178.9	0	0	0	0	108.7	I61 N117 I130	I61-V133 HydrophobicContact CD1-CG1 4.06Å; N117-V133 HydrophobicContact CB-CG1 4.15Å; I130-V133 HydrophobicContact CG2-CG2 4.25Å
134	M	86.5	Confident	78.4	Confident	0 Å²	0	55 Å²	55	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	131.9	172.1	-75.6	-172	-146.8	0	0	111.5	L22 V24 L41 L45 F58 N117 A118 I120 L136	L22-M134 HydrophobicContact CB-CG 4.15Å; L22-M134 HydrophobicContact CD2-CE 3.84Å; L22-M134 HydrophobicContact CD2-CG 3.5Å; L22-M134 HydrophobicContact CD2-SD 4.09Å; L22-M134 HydrophobicContact CG-CG 3.87Å; L22-M134 CarbonylContact O-C 3.5Å; L22-M134 WeakPolarHBondContact O-CA 3.28Å; V24-M134 HydrophobicContact CG2-SD 4.11Å; L41-M134 HydrophobicContact CB-CE 3.88Å; L41-M134 HydrophobicContact CB-SD 3.84Å; L41-M134 HydrophobicContact CD1-SD 4.14Å; L41-M134 HydrophobicContact CD2-SD 3.91Å; L41-M134 HydrophobicContact CG-SD 4.17Å; L41-M134 WeakPolarHBondContact O-CE 3.12Å; L45-M134 HydrophobicContact CD2-CE 3.49Å; L45-M134 VanDerWaalsContact CD2-CE 3.49Å; L45-M134 HydrophobicContact CG-CE 4.04Å; F58-M134 HydrophobicContact CD1-CE 4.34Å; F58-M134 HydrophobicContact CE1-CE 3.73Å; N117-M134 CarbonylContact C-O 3.49Å; N117-M134 VanDerWaalsContact CA-O 3.29Å; N117-M134 WeakPolarHBondContact CA-O 3.45Å; A118-M134 HydrophobicContact CB-CB 4.43Å; A118-M134 PolarHBondContact N-O 2.79Å; A118-M134 PolarHBondContact O-N 2.79Å; I120-M134 HydrophobicContact CD1-CE 3.49Å; I120-M134 VanDerWaalsContact CD1-CE 3.49Å; I120-M134 HydrophobicContact CD1-CG 3.98Å; I120-M134 HydrophobicContact CG1-CE 3.75Å; I120-M134 HydrophobicContact CG1-CG 4.48Å; M134-L136 HydrophobicContact CB-CD2 4.16Å
135	H	86.7	Confident	78.6	Confident	54 Å²	54	54.3 Å²	54.3	25%	0.25	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	115	171.1	-169.4	-70.9	0	0	0	110	L22 T23 V24 N117	L22-H135 PolarHBondContact O-N 2.77Å; T23-H135 CarbonylContact C-O 3.47Å; T23-H135 VanDerWaalsContact CA-O 3.26Å; T23-H135 WeakPolarHBondContact CA-O 3.42Å; V24-H135 PolarHBondContact N-O 3.29Å; N117-H135 PolarHBondContact OD1-CD2 3.25Å; N117-H135 VanDerWaalsContact OD1-CD2 3.31Å
136	L	88.1	Confident	79	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	123.9	-175.5	-52.8	-178.6	0	0	0	109.9	V24 F26 L41 I78 T115 L116 A118 M134	V24-L136 HydrophobicContact CB-CD2 3.66Å; V24-L136 HydrophobicContact CG1-CD2 4.45Å; V24-L136 HydrophobicContact CG2-CD2 4.06Å; V24-L136 CarbonylContact O-C 3.5Å; V24-L136 WeakPolarHBondContact O-CA 3.15Å; F26-L136 HydrophobicContact CE2-CD2 4.32Å; L41-L136 HydrophobicContact CD1-CD1 4.38Å; L41-L136 HydrophobicContact CD2-CD1 4.27Å; L41-L136 HydrophobicContact CD2-CD2 3.69Å; I78-L136 HydrophobicContact CD1-CD1 3.65Å; T115-L136 WeakPolarHBondContact CA-O 3.44Å; L116-L136 HydrophobicContact CD1-CB 3.91Å; L116-L136 HydrophobicContact CD1-CD1 3.47Å; L116-L136 VanDerWaalsContact CD1-CD1 3.47Å; L116-L136 HydrophobicContact CD1-CG 4.12Å; L116-L136 HydrophobicContact CG-CB 4.04Å; L116-L136 HydrophobicContact CG-CD1 4.49Å; L116-L136 PolarHBondContact N-O 3.37Å; L116-L136 WeakPolarHBondContact O-CA 3.47Å; L116-L136 VanDerWaalsContact O-CB 3.31Å; L116-L136 WeakPolarHBondContact O-CB 3.31Å; L116-L136 PolarHBondContact O-N 3.15Å; A118-L136 HydrophobicContact CB-CD1 3.96Å; M134-L136 HydrophobicContact CB-CD2 4.16Å
137	I	88.1	Confident	79.9	Confident	27 Å²	27	45.7 Å²	45.7	14%	0.138	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	121.8	174.3	-54	175.4	0	0	0	107.6	T23 V24 Q25 F26 Q113 I114 T115	T23-I137 HydrophobicContact CG2-CD1 3.89Å; T23-I137 HydrophobicContact CG2-CG1 4.29Å; V24-I137 PolarHBondContact O-N 3.46Å; Q25-I137 CarbonylContact C-O 3.5Å; Q25-I137 VanDerWaalsContact CA-O 3.26Å; Q25-I137 WeakPolarHBondContact CA-O 3.49Å; Q25-I137 HydrophobicContact CG-CB 4.17Å; Q25-I137 HydrophobicContact CG-CD1 4.33Å; F26-I137 PolarHBondContact N-O 2.8Å; Q113-I137 HydrophobicContact CG-CG2 4.32Å; I114-I137 CarbonylContact O-C 3.53Å; I114-I137 WeakPolarHBondContact O-CA 3.49Å; T115-I137 HydrophobicContact CG2-CG1 4.17Å; T115-I137 HydrophobicContact CG2-CG2 4.36Å
138	I	88.6	Confident	80.9	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	108.7	-174.4	-55.5	174	0	0	0	107.9	F26 I28 I38 F69 I78 Q113 I114 L116	F26-I138 HydrophobicContact CB-CG1 4.34Å; F26-I138 HydrophobicContact CD2-CG1 4.24Å; F26-I138 CarbonylContact O-C 3.53Å; F26-I138 WeakPolarHBondContact O-CA 3.15Å; I28-I138 HydrophobicContact CD1-CG2 3.36Å; I28-I138 HydrophobicContact CG1-CG2 3.73Å; I38-I138 HydrophobicContact CD1-CD1 3.64Å; I38-I138 HydrophobicContact CD1-CG1 4.31Å; F69-I138 HydrophobicContact CD1-CD1 3.67Å; F69-I138 HydrophobicContact CD2-CD1 3.75Å; F69-I138 HydrophobicContact CE1-CD1 3.46Å; F69-I138 VanDerWaalsContact CE1-CD1 3.46Å; F69-I138 HydrophobicContact CE1-CG2 4.05Å; F69-I138 HydrophobicContact CE2-CD1 3.54Å; F69-I138 HydrophobicContact CG-CD1 3.8Å; F69-I138 HydrophobicContact CZ-CB 4.19Å; F69-I138 HydrophobicContact CZ-CD1 3.38Å; F69-I138 HydrophobicContact CZ-CG1 4.36Å; F69-I138 HydrophobicContact CZ-CG2 3.73Å; I78-I138 HydrophobicContact CD1-CD1 4.49Å; Q113-I138 WeakPolarHBondContact CA-O 3.31Å; I114-I138 HydrophobicContact CB-CB 4.29Å; I114-I138 PolarHBondContact N-O 3.49Å; I114-I138 PolarHBondContact O-N 3.37Å; L116-I138 HydrophobicContact CD2-CD1 3.83Å
139	T	87	Confident	81.7	Confident	18 Å²	18	44.2 Å²	44.2	11%	0.11	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	123.4	174.9	-58.2	0	0	0	0	109.3	F26 T27 I28 L111 C112 Q113	F26-T139 PolarHBondContact O-N 3.26Å; T27-T139 CarbonylContact C-O 3.58Å; T27-T139 WeakPolarHBondContact CA-O 3.41Å; T27-T139 HydrophobicContact CG2-CG2 4.34Å; I28-T139 PolarHBondContact N-O 3.32Å; L111-T139 HydrophobicContact CD2-CG2 3.43Å; L111-T139 VanDerWaalsContact CD2-CG2 3.43Å; L111-T139 HydrophobicContact CG-CG2 4.11Å; C112-T139 CarbonylContact O-C 3.47Å; C112-T139 WeakPolarHBondContact O-CA 3.49Å; Q113-T139 HydrophobicContact CG-CG2 4.47Å; Q113-T139 WeakPolarHBondContact CG-OG1 3.45Å; Q113-T139 PolarHBondContact NE2-OG1 3.44Å
140	I	85.2	Confident	82.4	Confident	4 Å²	4	40.1 Å²	40.1	2%	0.021	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	126.7	174.4	-56.7	169.5	0	0	0	107.7	I28 E30 L84 H86 I89 C112 I114	I28-I140 HydrophobicContact CG1-CG1 4.48Å; I28-I140 CarbonylContact O-C 3.52Å; I28-I140 WeakPolarHBondContact O-CA 3.41Å; E30-I140 HydrophobicContact CB-CG2 3.86Å; L84-I140 HydrophobicContact CD2-CD1 4.12Å; H86-I140 HydrophobicContact CB-CG2 4.16Å; I89-I140 HydrophobicContact CB-CD1 4.46Å; I89-I140 HydrophobicContact CD1-CD1 3.61Å; I89-I140 HydrophobicContact CG2-CD1 4.04Å; C112-I140 HydrophobicContact CB-CB 4.28Å; C112-I140 PolarHBondContact O-N 3.11Å; I114-I140 HydrophobicContact CD1-CD1 3.6Å; I114-I140 HydrophobicContact CG1-CD1 3.99Å
141	K	81.5	Confident	82.8	Confident	122 Å²	122	37.9 Å²	37.9	53%	0.53	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	130.7	171.6	-73.4	-173.8	172.5	-172.2	0	109.7	T27 I28 L29 E30	T27-K141 HydrophobicContact CG2-CD 4.13Å; T27-K141 HydrophobicContact CG2-CG 4.13Å; I28-K141 PolarHBondContact O-N 2.95Å; L29-K141 HydrophobicContact CD2-CB 3.92Å; L29-K141 HydrophobicContact CD2-CD 4.37Å; E30-K141 PolarHBondContact N-O 2.67Å; E30-K141 VanDerWaalsContact N-O 3.09Å
142	D	78.7	Confident	83	Confident	22 Å²	22	41 Å²	41	12%	0.118	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-60	137.7	171.3	-169.7	-50	0	0	0	110.7	E30 H86 T183 N187	E30-D142 WeakPolarHBondContact OE1-CA 3.47Å; H86-D142 IonicContact CE1-OD2 2.63Å; H86-D142 PolarHBondContact CE1-OD2 3.25Å; H86-D142 VanDerWaalsContact CE1-OD2 3.24Å; H86-D142 IonicContact ND1-OD2 3.63Å; H86-D142 PolarHBondContact ND1-OD2 2.89Å; D142-T183 WeakPolarHBondContact CB-O 3.14Å; D142-T183 PolarHBondContact OD1-N 2.79Å; D142-T183 WeakPolarHBondContact OD2-CA 3.14Å; D142-T183 PolarHBondContact OD2-N 3.5Å; D142-T183 PolarHBondContact OD2-OG1 2.84Å; D142-N187 PolarHBondContact O-ND2 2.84Å; D142-N187 PolarHBondContact OD1-ND2 2.96Å
143	I	78	Confident	83.1	Confident	49 Å²	49	41.1 Å²	41.1	25%	0.251	23%	0.226	S	C	.	.			trans	-121.4	153.8	171.8	69.5	-177.1	0	0	0	109.1	L29 E30 E31 D145	L29-I143 HydrophobicContact CB-CG2 4.19Å; L29-I143 HydrophobicContact CD2-CG2 4.15Å; E30-I143 HydrophobicContact CG-CB 4.3Å; E30-I143 HydrophobicContact CG-CD1 3.74Å; E30-I143 HydrophobicContact CG-CG1 3.53Å; E30-I143 HydrophobicContact CG-CG2 4.18Å; E30-I143 PolarHBondContact OE1-N 3.28Å; E31-I143 HydrophobicContact CB-CD1 3.76Å; E31-I143 HydrophobicContact CG-CD1 3.87Å; I143-D145 HydrophobicContact CD1-CB 4.14Å; I143-D145 HydrophobicContact CG1-CB 3.89Å; I143-D145 PolarHBondContact O-N 2.99Å
144	D	77.2	Confident	83.2	Confident	46 Å²	46	43.8 Å²	43.8	25%	0.246	24%	0.238	C	C	.	.	S	Bend	trans	-74.5	67.8	179	-159.4	62.4	0	0	0	110.8	D182 S250 N276	D144-D182 VanDerWaalsContact C-OD2 3.29Å; D144-D182 VanDerWaalsContact CA-OD2 3.23Å; D144-D182 WeakPolarHBondContact CA-OD2 3.44Å; D144-S250 WeakPolarHBondContact OD2-CB 3.23Å; D144-S250 PolarHBondContact OD2-OG 3.35Å; D144-N276 PolarHBondContact OD2-ND2 2.78Å
145	D	77.5	Confident	83.2	Confident	57 Å²	57	48.8 Å²	48.8	31%	0.305	26%	0.262	S	S	.	.			trans	-103.7	-4.9	-179.6	79.1	-27.5	0	0	0	114.8	E31 I143 D182	E31-D145 WeakPolarHBondContact CG-OD2 3.19Å; I143-D145 HydrophobicContact CD1-CB 4.14Å; I143-D145 HydrophobicContact CG1-CB 3.89Å; I143-D145 PolarHBondContact O-N 2.99Å; D145-D182 PolarHBondContact N-OD2 3.47Å; D145-D182 VanDerWaalsContact N-OD2 3.16Å
146	N	77.4	Confident	83.2	Confident	46 Å²	46	47.7 Å²	47.7	25%	0.246	26%	0.257	C	S	.	.	S	Bend	trans	-100.5	137.1	171.5	-62.4	-77.2	0	0	0	111	L181 D182	N146-L181 HydrophobicContact CB-CB 4.19Å; N146-D182 WeakPolarHBondContact CA-OD2 3.48Å; N146-D182 VanDerWaalsContact CB-OD1 3.25Å; N146-D182 WeakPolarHBondContact CB-OD1 3.35Å; N146-D182 PolarHBondContact N-OD1 3.08Å; N146-D182 PolarHBondContact N-OD2 2.86Å; N146-D182 PolarHBondContact ND2-OD1 3.41Å; N146-D182 VanDerWaalsContact O-OD2 3.08Å
147	V	78.5	Confident	83.1	Confident	69 Å²	69	52.4 Å²	52.4	42%	0.418	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-86.7	139	174.8	-172.2	0	0	0	0	108.1	K275	V147-K275 VanDerWaalsContact CG1-O 3.32Å; V147-K275 WeakPolarHBondContact CG1-O 3.31Å; V147-K275 WeakPolarHBondContact CG2-O 3.37Å
148	C	86.4	Confident	82.9	Confident	8 Å²	8	51.5 Å²	51.5	5%	0.054	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-56.6	153.7	171.2	64.3	0	0	0	0	111.7	L178 V179 D180 I189 A248 C278	C148-L178 HydrophobicContact CB-CD1 4.47Å; C148-V179 CarbonylContact C-O 3.55Å; C148-V179 VanDerWaalsContact CA-O 3.23Å; C148-V179 WeakPolarHBondContact CA-O 3.48Å; C148-D180 HydrophobicContact CB-CB 4.27Å; C148-I189 HydrophobicContact CB-CG1 4.01Å; C148-A248 PolarHBondContact SG-O 3.35Å; C148-C278 VanDerWaalsContact C-SG 3.6Å; C148-C278 HydrophobicContact CB-CB 4.07Å; C148-C278 WeakPolarHBondContact CB-SG 3.31Å; C148-C278 WeakPolarHBondContact O-CB 3.47Å; C148-C278 WeakPolarHBondContact SG-CB 3.39Å; C148-C278 CovalentContact SG-SG 2.05Å; C148-C278 PolarHBondContact SG-SG 3.37Å
149	E	87.7	Confident	82.6	Confident	83 Å²	83	54 Å²	54	39%	0.388	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	155.7	-179.8	63.7	178.1	-177.4	0	0	112.2	L151 V179	E149-L151 HydrophobicContact CG-CD2 4.2Å; E149-L151 HydrophobicContact CG-CG 4.31Å; E149-L151 WeakPolarHBondContact OE1-CD2 3.47Å; E149-V179 HydrophobicContact CG-CB 4.24Å; E149-V179 PolarHBondContact N-O 2.8Å; E149-V179 PolarHBondContact O-N 2.93Å
150	F	87.5	Confident	82.1	Confident	3 Å²	3	53.5 Å²	53.5	1%	0.013	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	119.3	168.8	-73	-88	0	0	0	109.6	A153 N154 N176 Q177 L178 L226 I246 C278 L280	F150-A153 CarbonylContact O-C 3.58Å; F150-A153 VanDerWaalsContact O-C 3.31Å; F150-A153 PolarHBondContact O-N 3.12Å; F150-N154 PolarHBondContact N-OD1 3.05Å; F150-N176 HydrophobicContact CB-CB 4.29Å; F150-N176 HydrophobicContact CD1-CB 4.4Å; F150-Q177 CarbonylContact C-O 3.57Å; F150-Q177 WeakPolarHBondContact CA-O 3.22Å; F150-L178 HydrophobicContact CD1-CB 4.41Å; F150-L178 HydrophobicContact CD1-CD1 4.33Å; F150-L178 HydrophobicContact CD2-CD1 4.34Å; F150-L178 HydrophobicContact CE1-CB 4.14Å; F150-L178 HydrophobicContact CE1-CD1 3.95Å; F150-L178 HydrophobicContact CE2-CD1 3.95Å; F150-L178 HydrophobicContact CZ-CD1 3.75Å; F150-L226 HydrophobicContact CE1-CD1 3.92Å; F150-L226 HydrophobicContact CZ-CD1 4.5Å; F150-I246 HydrophobicContact CE1-CG2 4.37Å; F150-I246 HydrophobicContact CZ-CB 4.35Å; F150-I246 HydrophobicContact CZ-CG2 3.88Å; F150-C278 HydrophobicContact CE2-CB 4.47Å; F150-L280 HydrophobicContact CB-CB 4.39Å; F150-L280 HydrophobicContact CB-CD1 4.1Å; F150-L280 HydrophobicContact CD1-CB 3.88Å; F150-L280 HydrophobicContact CD1-CD2 3.91Å; F150-L280 HydrophobicContact CD1-CG 4.34Å; F150-L280 HydrophobicContact CD2-CB 3.65Å; F150-L280 HydrophobicContact CE1-CB 3.96Å; F150-L280 HydrophobicContact CE1-CD2 4.11Å; F150-L280 HydrophobicContact CE2-CB 3.73Å; F150-L280 HydrophobicContact CG-CB 3.71Å; F150-L280 HydrophobicContact CG-CD1 4.28Å; F150-L280 HydrophobicContact CG-CD2 4.41Å; F150-L280 HydrophobicContact CG-CG 4.37Å; F150-L280 HydrophobicContact CZ-CB 3.88Å
151	L	80.3	Confident	81.6	Confident	59 Å²	59	54.7 Å²	54.7	31%	0.309	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	138.6	176	-64.4	-177.3	0	0	0	110.9	E149 N176 Q177 V179	E149-L151 HydrophobicContact CG-CD2 4.2Å; E149-L151 HydrophobicContact CG-CG 4.31Å; E149-L151 WeakPolarHBondContact OE1-CD2 3.47Å; L151-N176 CarbonylContact O-C 3.54Å; L151-N176 WeakPolarHBondContact O-CB 3.47Å; L151-Q177 PolarHBondContact N-O 3.22Å; L151-Q177 PolarHBondContact O-N 3.39Å; L151-V179 HydrophobicContact CD1-CB 4.34Å; L151-V179 HydrophobicContact CD1-CG2 3.76Å; L151-V179 HydrophobicContact CG-CG2 4.13Å
152	P	80.3	Confident	81.4	Confident	115 Å²	115	49.8 Å²	49.8	75%	0.747	27%	0.266	S	S	*	.	S	Bend	cis	-84.9	-11.6	2.5	34.1	-36	0	0	0	114.7
153	A	81.5	Confident	81.1	Confident	43 Å²	43	51.4 Å²	51.4	36%	0.355	29%	0.288	S	S	.	.			trans	-146	157.6	-175.8	0	0	0	0	0	112.5	F150 E155 N176 L280	F150-A153 CarbonylContact O-C 3.58Å; F150-A153 VanDerWaalsContact O-C 3.31Å; F150-A153 PolarHBondContact O-N 3.12Å; A153-E155 PolarHBondContact O-N 2.82Å; A153-N176 PolarHBondContact O-ND2 2.76Å; A153-L280 VanDerWaalsContact O-CD1 3.29Å; A153-L280 WeakPolarHBondContact O-CD1 3.28Å
154	N	83.5	Confident	80.5	Confident	95 Å²	95	51.1 Å²	51.1	51%	0.508	29%	0.286	S	S	.	.	S	Bend	trans	-85.2	14.9	173.7	-63.6	-23.5	0	0	0	113	F150 F279 L280 N281	F150-N154 PolarHBondContact N-OD1 3.05Å; N154-F279 WeakPolarHBondContact CB-O 3.44Å; N154-L280 WeakPolarHBondContact O-CA 3.34Å; N154-N281 PolarHBondContact O-N 3.11Å
155	E	86.6	Confident	79.8	Confident	105 Å²	105	52.1 Å²	52.1	49%	0.491	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	143.4	173	-173.8	164.5	-151.3	0	0	109.8	A153 N176 N281	A153-E155 PolarHBondContact O-N 2.82Å; E155-N176 PolarHBondContact O-ND2 2.82Å; E155-N281 CarbonylContact C-O 3.53Å; E155-N281 VanDerWaalsContact CA-O 3.28Å; E155-N281 WeakPolarHBondContact CA-O 3.38Å; E155-N281 HydrophobicContact CG-CB 4.4Å
156	Q	87.3	Confident	78.9	Confident	31 Å²	31	52.7 Å²	52.7	15%	0.145	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	119.2	178.3	-174.7	176.8	-4.9	0	0	110.4	I158 P174 N176 L280 N281 V282 I283	Q156-I158 HydrophobicContact CG-CG1 4.37Å; Q156-P174 PolarHBondContact NE2-O 2.99Å; Q156-N176 PolarHBondContact OE1-OD1 3.18Å; Q156-L280 HydrophobicContact CB-CD1 4.25Å; Q156-N281 PolarHBondContact N-O 2.74Å; Q156-V282 VanDerWaalsContact O-CA 3.3Å; Q156-V282 WeakPolarHBondContact O-CA 3.34Å; Q156-I283 PolarHBondContact O-N 3.03Å
157	E	87.3	Confident	77.8	Confident	98 Å²	98	60.2 Å²	60.2	46%	0.458	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	138.8	170.4	-66.1	-174.2	-174.5	0	0	110.7	Y159 I283 H285	E157-Y159 HydrophobicContact CB-CE2 3.95Å; E157-Y159 PolarHBondContact OE2-OH 3.42Å; E157-I283 CarbonylContact C-O 3.3Å; E157-I283 WeakPolarHBondContact CA-O 3.49Å; E157-H285 IonicContact OE2-NE2 3.27Å
158	I	83.5	Confident	76.8	Confident	9 Å²	9	61.2 Å²	61.2	5%	0.046	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	129.1	-179.3	-59.8	173.3	0	0	0	107.6	Q156 V160 V173 I175 L228 V282 I283 V284 H285	Q156-I158 HydrophobicContact CG-CG1 4.37Å; I158-V160 HydrophobicContact CG2-CG2 3.95Å; I158-V173 HydrophobicContact CD1-CB 4.37Å; I158-V173 HydrophobicContact CD1-CG1 3.81Å; I158-V173 HydrophobicContact CG1-CG1 4.08Å; I158-V173 HydrophobicContact CG2-CG1 3.96Å; I158-V173 HydrophobicContact CG2-CG2 4.11Å; I158-I175 HydrophobicContact CD1-CD1 4.3Å; I158-L228 HydrophobicContact CD1-CD2 3.78Å; I158-V282 HydrophobicContact CD1-CG1 3.47Å; I158-V282 VanDerWaalsContact CD1-CG1 3.47Å; I158-V282 HydrophobicContact CG1-CG1 4.21Å; I158-I283 PolarHBondContact N-O 2.8Å; I158-V284 HydrophobicContact CB-CG2 4.22Å; I158-V284 HydrophobicContact CD1-CG2 4.41Å; I158-V284 HydrophobicContact CG2-CG1 4.48Å; I158-V284 CarbonylContact O-C 3.56Å; I158-V284 VanDerWaalsContact O-CA 3.27Å; I158-V284 WeakPolarHBondContact O-CA 3.47Å; I158-H285 PolarHBondContact O-N 3.04Å
159	Y	82.1	Confident	75.9	Confident	51 Å²	51	66.2 Å²	66.2	20%	0.2	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	126.6	-179.2	-70.1	-89.6	0	0	0	109.9	E157 H285 I287 R401	E157-Y159 HydrophobicContact CB-CE2 3.95Å; E157-Y159 PolarHBondContact OE2-OH 3.42Å; Y159-H285 HydrophobicContact CD1-CB 3.68Å; Y159-H285 HydrophobicContact CE1-CB 3.77Å; Y159-H285 AromaticContact CE1-CD2 3.67Å; Y159-H285 AromaticContact CE1-CG 3.83Å; Y159-H285 HydrophobicContact CG-CB 4.46Å; Y159-H285 AromaticContact CZ-CD2 3.68Å; Y159-I287 HydrophobicContact CD1-CD1 4.36Å; Y159-R401 HydrophobicContact CE1-CG 4.01Å
160	V	77	Confident	75.2	Confident	9 Å²	9	65.7 Å²	65.7	6%	0.055	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	124.7	-175.1	-173.6	0	0	0	0	109.3	I158 I171 I230 L234 V284 H285 V286 I287	I158-V160 HydrophobicContact CG2-CG2 3.95Å; V160-I171 HydrophobicContact CG1-CD1 3.87Å; V160-I230 HydrophobicContact CG1-CD1 4.27Å; V160-I230 HydrophobicContact CG2-CD1 3.65Å; V160-L234 HydrophobicContact CB-CD1 4.05Å; V160-L234 HydrophobicContact CG1-CD1 3.88Å; V160-V284 HydrophobicContact CB-CG1 4.43Å; V160-V284 HydrophobicContact CG2-CG1 3.76Å; V160-H285 PolarHBondContact N-O 3.21Å; V160-V286 CarbonylContact O-C 3.5Å; V160-V286 WeakPolarHBondContact O-CA 3.35Å; V160-I287 PolarHBondContact O-N 3.13Å
161	M	73.9	Confident	74.7	Confident	29 Å²	29	66.9 Å²	66.9	14%	0.143	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	140	171.5	-73.9	-177.6	-90.5	0	0	110.3	L164 I287 L408	M161-L164 HydrophobicContact CB-CB 4.46Å; M161-L164 WeakPolarHBondContact O-CB 3.15Å; M161-I287 HydrophobicContact CG-CB 4.24Å; M161-I287 HydrophobicContact CG-CD1 4.5Å; M161-I287 HydrophobicContact CG-CG2 4.39Å; M161-L408 HydrophobicContact CE-CB 3.7Å; M161-L408 HydrophobicContact CE-CD1 3.96Å; M161-L408 HydrophobicContact CE-CG 4.26Å
162	E	77.6	Confident	74.6	Confident	18 Å²	18	69.8 Å²	69.8	8%	0.084	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	158.8	170.8	77.3	-175.9	133.5	0	0	111.9	L164 L234 Y236 V286 I287 D288 V289	E162-L164 PolarHBondContact O-N 3.49Å; E162-L234 WeakPolarHBondContact CA-O 3.48Å; E162-L234 WeakPolarHBondContact CB-O 3.49Å; E162-Y236 WeakPolarHBondContact OE2-CB 3.44Å; E162-Y236 PolarHBondContact OE2-N 2.74Å; E162-V286 HydrophobicContact CB-CG1 3.97Å; E162-I287 PolarHBondContact N-O 2.58Å; E162-I287 VanDerWaalsContact N-O 3.08Å; E162-D288 VanDerWaalsContact OE1-CA 3.31Å; E162-D288 WeakPolarHBondContact OE1-CA 3.42Å; E162-V289 HydrophobicContact CG-CB 4.06Å; E162-V289 HydrophobicContact CG-CG2 3.95Å; E162-V289 PolarHBondContact OE1-N 3.3Å
163	G	71.8	Confident	74.7	Confident	56 Å²	56	65.3 Å²	65.3	58%	0.577	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	-6.9	-177.9	0	0	0	0	0	115.5	L165 S233 L234	G163-L165 PolarHBondContact O-N 3.16Å; G163-S233 WeakPolarHBondContact CA-OG 3.36Å; G163-S233 PolarHBondContact N-OG 3.25Å; G163-L234 PolarHBondContact N-O 3.11Å
164	L	66.3	Low	74.6	Confident	43 Å²	43	67.5 Å²	67.5	23%	0.225	36%	0.357	C	S	.	.			trans	-82.7	113.5	-173.9	-161.8	79	0	0	0	111.9	M161 E162 I171 M412	M161-L164 HydrophobicContact CB-CB 4.46Å; M161-L164 WeakPolarHBondContact O-CB 3.15Å; E162-L164 PolarHBondContact O-N 3.49Å; L164-I171 HydrophobicContact CB-CD1 4.23Å; L164-I171 HydrophobicContact CD2-CD1 3.95Å; L164-I171 HydrophobicContact CG-CD1 4.22Å; L164-I171 VanDerWaalsContact O-CD1 3.26Å; L164-I171 WeakPolarHBondContact O-CD1 3.36Å; L164-M412 HydrophobicContact CD1-CE 3.27Å; L164-M412 HydrophobicContact CD1-SD 4.45Å
165	L	61.8	Low	74.8	Confident	67 Å²	67	63.8 Å²	63.8	35%	0.351	34%	0.336	S	S	.	.			trans	-132.8	133.5	163.3	-79.6	167	0	0	0	108.6	G163	G163-L165 PolarHBondContact O-N 3.16Å
166	D	58.4	Low	74.8	Confident	69 Å²	69	60 Å²	60	37%	0.369	32%	0.32	S	S	.	.			trans	-77	177.5	179.9	79.6	-10.4	0	0	0	112.1	T168 N169 M170	D166-T168 VanDerWaalsContact CG-OG1 3.22Å; D166-T168 PolarHBondContact O-N 3.28Å; D166-T168 VanDerWaalsContact OD1-CA 3.27Å; D166-T168 WeakPolarHBondContact OD1-CA 3.47Å; D166-T168 WeakPolarHBondContact OD1-CB 3.37Å; D166-T168 PolarHBondContact OD1-N 3.26Å; D166-T168 PolarHBondContact OD1-OG1 2.89Å; D166-T168 PolarHBondContact OD2-OG1 3.21Å; D166-N169 PolarHBondContact O-N 3.12Å; D166-N169 PolarHBondContact OD1-N 2.74Å; D166-N169 VanDerWaalsContact OD1-N 3.12Å; D166-M170 PolarHBondContact OD1-N 3.36Å; D166-M170 VanDerWaalsContact OD2-O 3.04Å
167	Q	55	Low	74.5	Confident	204 Å²	204	63.6 Å²	63.6	95%	0.953	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-15.5	176.3	-66.6	-177.8	-12.5	0	0	113.9
168	T	57	Low	74.6	Confident	90 Å²	90	59 Å²	59	55%	0.552	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	4.9	178.6	76.4	0	0	0	0	113.1	D166 M170	D166-T168 VanDerWaalsContact CG-OG1 3.22Å; D166-T168 PolarHBondContact O-N 3.28Å; D166-T168 VanDerWaalsContact OD1-CA 3.27Å; D166-T168 WeakPolarHBondContact OD1-CA 3.47Å; D166-T168 WeakPolarHBondContact OD1-CB 3.37Å; D166-T168 PolarHBondContact OD1-N 3.26Å; D166-T168 PolarHBondContact OD1-OG1 2.89Å; D166-T168 PolarHBondContact OD2-OG1 3.21Å; T168-M170 PolarHBondContact O-N 3.14Å; T168-M170 PolarHBondContact OG1-O 2.85Å
169	N	67.1	Low	74.7	Confident	113 Å²	113	58.6 Å²	58.6	60%	0.604	31%	0.313	S	S	*	.	S	Bend	trans	54.8	25.5	-170.7	-73.5	-8.7	0	0	0	113.2	D166	D166-N169 PolarHBondContact O-N 3.12Å; D166-N169 PolarHBondContact OD1-N 2.74Å; D166-N169 VanDerWaalsContact OD1-N 3.12Å
170	M	73.4	Confident	74.8	Confident	72 Å²	72	56.4 Å²	56.4	36%	0.355	31%	0.305	S	S	.	.			trans	-153.2	127.6	-179.6	-66.9	-171.9	-65.9	0	0	112.4	D166 T168 I230 K231	D166-M170 PolarHBondContact OD1-N 3.36Å; D166-M170 VanDerWaalsContact OD2-O 3.04Å; T168-M170 PolarHBondContact O-N 3.14Å; T168-M170 PolarHBondContact OG1-O 2.85Å; M170-I230 CarbonylContact C-O 3.49Å; M170-I230 WeakPolarHBondContact CA-O 3.41Å; M170-K231 HydrophobicContact CG-CG 4.37Å; M170-K231 HydrophobicContact SD-CG 4.22Å
171	I	77	Confident	75.1	Confident	28 Å²	28	58.9 Å²	58.9	14%	0.144	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	125.6	170.8	-58.1	168.6	0	0	0	109.1	V160 L164 V173 L229 I230	V160-I171 HydrophobicContact CG1-CD1 3.87Å; L164-I171 HydrophobicContact CB-CD1 4.23Å; L164-I171 HydrophobicContact CD2-CD1 3.95Å; L164-I171 HydrophobicContact CG-CD1 4.22Å; L164-I171 VanDerWaalsContact O-CD1 3.26Å; L164-I171 WeakPolarHBondContact O-CD1 3.36Å; I171-V173 HydrophobicContact CG2-CG2 3.94Å; I171-L229 CarbonylContact O-C 3.53Å; I171-L229 WeakPolarHBondContact O-CA 3.34Å; I171-I230 HydrophobicContact CB-CB 4.08Å; I171-I230 HydrophobicContact CB-CD1 4.21Å; I171-I230 HydrophobicContact CB-CG1 4.31Å; I171-I230 HydrophobicContact CG2-CD1 4.33Å; I171-I230 PolarHBondContact N-O 3.2Å; I171-I230 PolarHBondContact O-N 3.07Å
172	K	78.7	Confident	75.4	Confident	121 Å²	121	57.6 Å²	57.6	53%	0.526	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	112.4	175.4	-178	-171.6	176.5	-157.2	0	110.7	S227 L229	K172-S227 WeakPolarHBondContact CE-OG 3.49Å; K172-L229 HydrophobicContact CB-CD2 3.98Å; K172-L229 HydrophobicContact CG-CD2 3.82Å
173	V	80.9	Confident	75	Confident	20 Å²	20	57.5 Å²	57.5	12%	0.121	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	123.3	179.1	-171.2	0	0	0	0	110.5	I158 I171 S227 L228 I230	I158-V173 HydrophobicContact CD1-CB 4.37Å; I158-V173 HydrophobicContact CD1-CG1 3.81Å; I158-V173 HydrophobicContact CG1-CG1 4.08Å; I158-V173 HydrophobicContact CG2-CG1 3.96Å; I158-V173 HydrophobicContact CG2-CG2 4.11Å; I171-V173 HydrophobicContact CG2-CG2 3.94Å; V173-S227 CarbonylContact O-C 3.51Å; V173-S227 WeakPolarHBondContact O-CA 3.41Å; V173-S227 WeakPolarHBondContact O-CB 3.35Å; V173-L228 HydrophobicContact CB-CB 4.45Å; V173-L228 PolarHBondContact N-O 2.87Å; V173-L228 PolarHBondContact O-N 2.85Å; V173-I230 HydrophobicContact CG2-CD1 4.39Å
174	P	81.5	Confident	74.7	Confident	90 Å²	90	56.8 Å²	56.8	58%	0.584	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.1	143.3	175.4	27.7	-32.8	0	0	0	111.5	Q156	Q156-P174 PolarHBondContact NE2-O 2.99Å
175	I	86.7	Confident	74.6	Confident	16 Å²	16	61.5 Å²	61.5	8%	0.082	34%	0.338	C	S	.	.			trans	-107.8	149.8	-179.1	-69.7	-61	0	0	0	110.2	I158 L226 L228 I246 L280 V282	I158-I175 HydrophobicContact CD1-CD1 4.3Å; I175-L226 HydrophobicContact CB-CB 3.79Å; I175-L226 HydrophobicContact CG2-CB 3.92Å; I175-L226 HydrophobicContact CG2-CD1 4.22Å; I175-L226 PolarHBondContact N-O 2.69Å; I175-L226 VanDerWaalsContact N-O 3.1Å; I175-L228 HydrophobicContact CD1-CB 3.99Å; I175-L228 HydrophobicContact CG1-CB 4.16Å; I175-I246 HydrophobicContact CB-CD1 4.47Å; I175-I246 HydrophobicContact CD1-CD1 4.08Å; I175-I246 HydrophobicContact CG1-CD1 3.99Å; I175-I246 HydrophobicContact CG2-CD1 3.71Å; I175-L280 HydrophobicContact CG2-CD2 3.32Å; I175-V282 HydrophobicContact CD1-CG2 4.24Å
176	N	85.7	Confident	74.7	Confident	27 Å²	27	61.7 Å²	61.7	14%	0.144	36%	0.355	C	S	.	.			trans	-45.6	146.1	175.3	-75.3	-1.5	0	0	0	112.8	F150 L151 A153 E155 Q156 L178 L280	F150-N176 HydrophobicContact CB-CB 4.29Å; F150-N176 HydrophobicContact CD1-CB 4.4Å; L151-N176 CarbonylContact O-C 3.54Å; L151-N176 WeakPolarHBondContact O-CB 3.47Å; A153-N176 PolarHBondContact O-ND2 2.76Å; E155-N176 PolarHBondContact O-ND2 2.82Å; Q156-N176 PolarHBondContact OE1-OD1 3.18Å; N176-L178 PolarHBondContact O-N 3.39Å; N176-L280 HydrophobicContact CB-CD1 4.07Å; N176-L280 HydrophobicContact CB-CD2 4.04Å
177	Q	82.7	Confident	75.3	Confident	106 Å²	106	60.2 Å²	60.2	50%	0.495	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	126.1	-169.6	-174.9	176.4	5.9	0	0	111.5	F150 L151 V179 S222	F150-Q177 CarbonylContact C-O 3.57Å; F150-Q177 WeakPolarHBondContact CA-O 3.22Å; L151-Q177 PolarHBondContact N-O 3.22Å; L151-Q177 PolarHBondContact O-N 3.39Å; Q177-V179 HydrophobicContact CG-CG2 3.95Å; Q177-S222 WeakPolarHBondContact CG-OG 3.18Å; Q177-S222 PolarHBondContact NE2-OG 3.17Å
178	L	87.9	Confident	76.2	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	122	176.4	-177	66.6	0	0	0	110.6	C148 F150 N176 I189 I194 S222 A248 C278	C148-L178 HydrophobicContact CB-CD1 4.47Å; F150-L178 HydrophobicContact CD1-CB 4.41Å; F150-L178 HydrophobicContact CD1-CD1 4.33Å; F150-L178 HydrophobicContact CD2-CD1 4.34Å; F150-L178 HydrophobicContact CE1-CB 4.14Å; F150-L178 HydrophobicContact CE1-CD1 3.95Å; F150-L178 HydrophobicContact CE2-CD1 3.95Å; F150-L178 HydrophobicContact CZ-CD1 3.75Å; N176-L178 PolarHBondContact O-N 3.39Å; L178-I189 HydrophobicContact CD1-CD1 4.33Å; L178-I189 HydrophobicContact CD2-CD1 3.99Å; L178-I189 HydrophobicContact CD2-CG1 4.24Å; L178-I189 HydrophobicContact CD2-CG2 3.73Å; L178-I189 HydrophobicContact CG-CD1 3.61Å; L178-I189 HydrophobicContact CG-CG1 4.22Å; L178-I194 HydrophobicContact CD2-CD1 3.82Å; L178-I194 HydrophobicContact CD2-CG1 4.08Å; L178-S222 WeakPolarHBondContact O-CB 3.18Å; L178-S222 PolarHBondContact O-OG 2.89Å; L178-A248 HydrophobicContact CD1-CB 3.79Å; L178-A248 HydrophobicContact CD2-CB 3.65Å; L178-A248 HydrophobicContact CG-CB 4.38Å; L178-C278 VanDerWaalsContact CD1-SG 3.51Å
179	V	85.6	Confident	77.5	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.006	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	144.6	-172.9	-179.7	0	0	0	0	110.9	L94 C148 E149 L151 Q177 V221	L94-V179 HydrophobicContact CD2-CG1 4.03Å; C148-V179 CarbonylContact C-O 3.55Å; C148-V179 VanDerWaalsContact CA-O 3.23Å; C148-V179 WeakPolarHBondContact CA-O 3.48Å; E149-V179 HydrophobicContact CG-CB 4.24Å; E149-V179 PolarHBondContact N-O 2.8Å; E149-V179 PolarHBondContact O-N 2.93Å; L151-V179 HydrophobicContact CD1-CB 4.34Å; L151-V179 HydrophobicContact CD1-CG2 3.76Å; L151-V179 HydrophobicContact CG-CG2 4.13Å; Q177-V179 HydrophobicContact CG-CG2 3.95Å; V179-V221 WeakPolarHBondContact CA-O 2.96Å
180	D	85.4	Confident	78.2	Confident	5 Å²	5	46.1 Å²	46.1	3%	0.027	28%	0.276	C	S	.	.			trans	-146.2	127.9	172.9	-168.4	-20.4	0	0	0	108.7	C148 D182 G188 I189 V221	C148-D180 HydrophobicContact CB-CB 4.27Å; D180-D182 PolarHBondContact OD1-N 2.83Å; D180-D182 VanDerWaalsContact OD1-N 3.14Å; D180-G188 VanDerWaalsContact OD2-C 3.3Å; D180-G188 WeakPolarHBondContact OD2-CA 3.21Å; D180-I189 HydrophobicContact CB-CD1 3.54Å; D180-I189 HydrophobicContact CB-CG1 3.69Å; D180-I189 PolarHBondContact OD2-N 2.89Å; D180-V221 PolarHBondContact N-O 2.89Å; D180-V221 CarbonylContact O-C 3.58Å; D180-V221 WeakPolarHBondContact O-CA 3.28Å; D180-V221 VanDerWaalsContact O-CB 3.23Å; D180-V221 WeakPolarHBondContact O-CB 3.47Å; D180-V221 VanDerWaalsContact O-O 3.05Å
181	L	82.4	Confident	78.8	Confident	61 Å²	61	49.3 Å²	49.3	32%	0.319	28%	0.284	S	S	.	.			trans	-82.6	-22.3	-174.1	-63.7	179.4	0	0	0	112.3	E87 L94 N146	E87-L181 HydrophobicContact CG-CB 4.06Å; L94-L181 HydrophobicContact CD1-CD2 4.32Å; N146-L181 HydrophobicContact CB-CB 4.19Å
182	D	80	Confident	79.1	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	30%	0.3	C	S	.	.			trans	-75	144.5	-176.1	-59	-24	0	0	0	110.8	D144 D145 N146 D180 N187	D144-D182 VanDerWaalsContact C-OD2 3.29Å; D144-D182 VanDerWaalsContact CA-OD2 3.23Å; D144-D182 WeakPolarHBondContact CA-OD2 3.44Å; D145-D182 PolarHBondContact N-OD2 3.47Å; D145-D182 VanDerWaalsContact N-OD2 3.16Å; N146-D182 WeakPolarHBondContact CA-OD2 3.48Å; N146-D182 VanDerWaalsContact CB-OD1 3.25Å; N146-D182 WeakPolarHBondContact CB-OD1 3.35Å; N146-D182 PolarHBondContact N-OD1 3.08Å; N146-D182 PolarHBondContact N-OD2 2.86Å; N146-D182 PolarHBondContact ND2-OD1 3.41Å; N146-D182 VanDerWaalsContact O-OD2 3.08Å; D180-D182 PolarHBondContact OD1-N 2.83Å; D180-D182 VanDerWaalsContact OD1-N 3.14Å; D182-N187 HydrophobicContact CB-CB 3.89Å
183	T	69.6	Low	79.4	Confident	16 Å²	16	46.1 Å²	46.1	10%	0.098	28%	0.279	C	S	.	.			trans	-147.7	135.7	-171.9	58	0	0	0	0	114.6	K92 D142 V221	K92-T183 HydrophobicContact CD-CG2 3.67Å; K92-T183 WeakPolarHBondContact CE-OG1 3.17Å; K92-T183 VanDerWaalsContact NZ-CB 3.28Å; K92-T183 PolarHBondContact NZ-OG1 3.5Å; D142-T183 WeakPolarHBondContact CB-O 3.14Å; D142-T183 PolarHBondContact OD1-N 2.79Å; D142-T183 WeakPolarHBondContact OD2-CA 3.14Å; D142-T183 PolarHBondContact OD2-N 3.5Å; D142-T183 PolarHBondContact OD2-OG1 2.84Å; T183-V221 HydrophobicContact CG2-CG1 4.19Å
184	G	65	Low	79.7	Confident	41 Å²	41	45.7 Å²	45.7	42%	0.423	28%	0.277	S	S	.	.	B	Isolated β-bridge	trans	137.2	-177.4	174.3	0	0	0	0	0	111.2	G186 N187	G184-G186 PolarHBondContact O-N 2.93Å; G184-N187 PolarHBondContact O-N 2.96Å
185	P	64.4	Low	80	Confident	143 Å²	143	47.6 Å²	47.6	93%	0.929	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	105.2	178.3	25.6	-30.4	0	0	0	110.5
186	G	65	Low	80	Confident	70 Å²	70	48.8 Å²	48.8	72%	0.722	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	108	-7.2	179	0	0	0	0	0	115.3	G184	G184-G186 PolarHBondContact O-N 2.93Å
187	N	71.5	Confident	79.8	Confident	39 Å²	39	52.4 Å²	52.4	21%	0.209	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-112.5	151.4	-178.2	-55.2	-0.6	0	0	0	109.9	D142 D182 G184	D142-N187 PolarHBondContact O-ND2 2.84Å; D142-N187 PolarHBondContact OD1-ND2 2.96Å; D182-N187 HydrophobicContact CB-CB 3.89Å; G184-N187 PolarHBondContact O-N 2.96Å
188	G	73.7	Confident	79.2	Confident	15 Å²	15	49.3 Å²	49.3	16%	0.155	28%	0.283	C	S	.	.	S	Bend	trans	96.2	168.9	-179.7	0	0	0	0	0	115	D180 H190 S250	D180-G188 VanDerWaalsContact OD2-C 3.3Å; D180-G188 WeakPolarHBondContact OD2-CA 3.21Å; G188-H190 PolarHBondContact O-N 2.94Å; G188-S250 WeakPolarHBondContact O-CA 3.45Å; G188-S250 WeakPolarHBondContact O-CB 3.18Å
189	I	83.3	Confident	78.2	Confident	11 Å²	11	52.3 Å²	52.3	6%	0.056	30%	0.299	C	S	.	.			trans	-61.4	131.5	-177.2	-60.9	138.5	0	0	0	113.2	C148 L178 D180 I194 P223 Y224	C148-I189 HydrophobicContact CB-CG1 4.01Å; L178-I189 HydrophobicContact CD1-CD1 4.33Å; L178-I189 HydrophobicContact CD2-CD1 3.99Å; L178-I189 HydrophobicContact CD2-CG1 4.24Å; L178-I189 HydrophobicContact CD2-CG2 3.73Å; L178-I189 HydrophobicContact CG-CD1 3.61Å; L178-I189 HydrophobicContact CG-CG1 4.22Å; D180-I189 HydrophobicContact CB-CD1 3.54Å; D180-I189 HydrophobicContact CB-CG1 3.69Å; D180-I189 PolarHBondContact OD2-N 2.89Å; I189-I194 HydrophobicContact CG2-CD1 4.23Å; I189-I194 HydrophobicContact CG2-CG1 4.31Å; I189-P223 HydrophobicContact CB-CG 4.39Å; I189-Y224 HydrophobicContact CB-CD2 4.48Å; I189-Y224 HydrophobicContact CB-CE2 4.37Å; I189-Y224 HydrophobicContact CG2-CD2 3.82Å; I189-Y224 HydrophobicContact CG2-CE2 3.85Å
190	H	82.2	Confident	76.8	Confident	85 Å²	85	61.6 Å²	61.6	39%	0.394	34%	0.342	S	S	.	.			trans	-94.7	130.1	172.9	-165.9	-85.3	0	0	0	112.9	G188 S192 S193 S249 T252	G188-H190 PolarHBondContact O-N 2.94Å; H190-S192 PolarHBondContact CE1-OG 2.95Å; H190-S192 PolarHBondContact ND1-N 3.11Å; H190-S192 PolarHBondContact ND1-OG 2.92Å; H190-S192 PolarHBondContact O-N 2.84Å; H190-S193 PolarHBondContact O-N 3.18Å; H190-S193 PolarHBondContact O-OG 3.32Å; H190-S249 PolarHBondContact N-O 3.44Å; H190-T252 HydrophobicContact CB-CG2 4.21Å; H190-T252 WeakPolarHBondContact CE1-CG2 3.42Å; H190-T252 VanDerWaalsContact CG-CG2 3.44Å; H190-T252 WeakPolarHBondContact ND1-CG2 3.36Å
191	R	85.3	Confident	75.4	Confident	138 Å²	138	70.2 Å²	70.2	52%	0.521	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-49.6	-40.4	-178	-163	175.3	175.9	-149	-1.4	115	S193 Y224	R191-S193 VanDerWaalsContact C-N 3.29Å; R191-S193 PolarHBondContact O-N 3.14Å; R191-Y224 HydrophobicContact CB-CE1 3.85Å; R191-Y224 HydrophobicContact CB-CE2 4.22Å; R191-Y224 WeakPolarHBondContact CB-OH 3.11Å; R191-Y224 HydrophobicContact CG-CD1 4.35Å; R191-Y224 HydrophobicContact CG-CE1 3.72Å; R191-Y224 PolarHBondContact N-OH 2.92Å
192	S	83.2	Confident	73.9	Confident	68 Å²	68	69.8 Å²	69.8	48%	0.476	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-79.1	-7.9	-174.7	67.7	0	0	0	0	114.6	H190 T252	H190-S192 PolarHBondContact CE1-OG 2.95Å; H190-S192 PolarHBondContact ND1-N 3.11Å; H190-S192 PolarHBondContact ND1-OG 2.92Å; H190-S192 PolarHBondContact O-N 2.84Å; S192-T252 WeakPolarHBondContact OG-CG2 3.42Å
193	S	85.3	Confident	72.7	Confident	14 Å²	14	78.6 Å²	78.6	10%	0.098	43%	0.429	C	S	.	.	G	3₁₀ helix	trans	-80.6	-21.7	173.8	65.2	0	0	0	0	112.6	H190 R191 K195 S249	H190-S193 PolarHBondContact O-N 3.18Å; H190-S193 PolarHBondContact O-OG 3.32Å; R191-S193 VanDerWaalsContact C-N 3.29Å; R191-S193 PolarHBondContact O-N 3.14Å; S193-K195 PolarHBondContact O-N 2.78Å; S193-S249 WeakPolarHBondContact CB-O 3.05Å; S193-S249 WeakPolarHBondContact CB-OG 3.29Å; S193-S249 PolarHBondContact OG-N 2.94Å; S193-S249 PolarHBondContact OG-O 3.26Å
194	I	88.5	Confident	72.1	Confident	12 Å²	12	80.8 Å²	80.8	6%	0.062	44%	0.442	C	S	.	.			trans	-71.2	112.9	-177.3	-54	175.2	0	0	0	110.4	L178 I189 L212 I214 Y224 L226 V247 A248	L178-I194 HydrophobicContact CD2-CD1 3.82Å; L178-I194 HydrophobicContact CD2-CG1 4.08Å; I189-I194 HydrophobicContact CG2-CD1 4.23Å; I189-I194 HydrophobicContact CG2-CG1 4.31Å; I194-L212 HydrophobicContact CG2-CD2 3.94Å; I194-I214 HydrophobicContact CB-CD1 3.89Å; I194-I214 HydrophobicContact CD1-CG2 4.27Å; I194-I214 HydrophobicContact CG2-CD1 3.82Å; I194-I214 HydrophobicContact CG2-CG1 4.28Å; I194-Y224 HydrophobicContact CD1-CD2 3.49Å; I194-Y224 VanDerWaalsContact CD1-CD2 3.49Å; I194-Y224 HydrophobicContact CD1-CE2 4.19Å; I194-Y224 HydrophobicContact CD1-CG 3.77Å; I194-L226 HydrophobicContact CD1-CD2 4.37Å; I194-L226 HydrophobicContact CG2-CD1 4.21Å; I194-L226 HydrophobicContact CG2-CD2 3.85Å; I194-V247 CarbonylContact C-O 3.5Å; I194-V247 VanDerWaalsContact CA-O 3.22Å; I194-V247 WeakPolarHBondContact CA-O 3.44Å; I194-A248 HydrophobicContact CG1-CB 4.02Å
195	K	86.8	Confident	72	Confident	129 Å²	129	81.7 Å²	81.7	56%	0.561	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.3	142.3	-177.3	-64.2	178.6	-174.4	172.5	0	112.1	S193 I246 V247	S193-K195 PolarHBondContact O-N 2.78Å; K195-I246 WeakPolarHBondContact O-CA 3.23Å; K195-V247 PolarHBondContact N-O 3.06Å; K195-V247 PolarHBondContact O-N 2.88Å
196	L	86.9	Confident	72.1	Confident	42 Å²	42	75.3 Å²	75.3	22%	0.22	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	121.1	166.6	-174.8	66.5	0	0	0	109.1	L198 F210 L212 L228 M244 I246	L196-L198 HydrophobicContact CD2-CD2 4.47Å; L196-F210 HydrophobicContact CD2-CB 4.4Å; L196-L212 HydrophobicContact CB-CB 4.26Å; L196-L212 HydrophobicContact CB-CD2 4.38Å; L196-L228 HydrophobicContact CD2-CD1 4.21Å; L196-M244 HydrophobicContact CD1-CB 4.15Å; L196-M244 HydrophobicContact CD1-CG 4.01Å; L196-M244 HydrophobicContact CD1-SD 3.94Å; L196-I246 HydrophobicContact CD1-CD1 4.42Å; L196-I246 HydrophobicContact CD1-CG1 3.64Å
197	K	81.7	Confident	72.1	Confident	103 Å²	103	77.7 Å²	77.7	45%	0.448	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	131.1	170.1	-67.7	-175.8	-175.9	169.1	0	108.3	T245 V247	K197-T245 WeakPolarHBondContact CA-O 3.35Å; K197-T245 WeakPolarHBondContact CB-O 3.36Å; K197-T245 PolarHBondContact N-O 3.47Å; K197-T245 PolarHBondContact O-N 3.37Å; K197-T245 VanDerWaalsContact O-O 3.13Å; K197-V247 HydrophobicContact CD-CG2 3.64Å; K197-V247 HydrophobicContact CG-CG2 4.05Å
198	L	70.2	Confident	72.3	Confident	41 Å²	41	81.5 Å²	81.5	22%	0.215	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	139.2	179.7	-67.3	156	0	0	0	109.4	L196 Q200 L206 N207 M244	L196-L198 HydrophobicContact CD2-CD2 4.47Å; L198-Q200 PolarHBondContact O-N 2.78Å; L198-L206 HydrophobicContact CB-CB 4.4Å; L198-L206 HydrophobicContact CB-CD1 3.95Å; L198-L206 HydrophobicContact CD1-CB 3.59Å; L198-L206 HydrophobicContact CD2-CB 3.7Å; L198-L206 HydrophobicContact CD2-CD1 4.05Å; L198-L206 HydrophobicContact CD2-CG 4.36Å; L198-L206 HydrophobicContact CG-CB 4.07Å; L198-L206 HydrophobicContact CG-CD1 4.42Å; L198-N207 WeakPolarHBondContact CD1-OD1 3.3Å; L198-M244 HydrophobicContact CD2-CB 3.96Å
199	D	65.4	Low	72.5	Confident	64 Å²	64	81.5 Å²	81.5	34%	0.342	41%	0.409	S	S	.	.			trans	-69	126	178.2	-169.6	4.5	0	0	0	109.9	K201 R243	D199-K201 PolarHBondContact O-N 3.03Å; D199-R243 HydrophobicContact CB-CB 4.11Å; D199-R243 WeakPolarHBondContact CB-O 3.2Å; D199-R243 PolarHBondContact N-O 2.96Å
200	Q	56.3	Low	72.7	Confident	195 Å²	195	81.2 Å²	81.2	91%	0.911	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	16.3	-172.4	-68.1	-171.7	-25	0	0	113.8	L198	L198-Q200 PolarHBondContact O-N 2.78Å
201	K	56.2	Low	72.9	Confident	186 Å²	186	80.4 Å²	80.4	81%	0.809	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-10.3	-174.6	-82.9	-178.4	175.8	176	0	115.3	D199	D199-K201 PolarHBondContact O-N 3.03Å
202	S	52.2	Low	73.1	Confident	53 Å²	53	75 Å²	75	37%	0.371	39%	0.387	S	S	.	.	S	Bend	trans	-120.6	133.5	179.9	46.5	0	0	0	0	111.9	V204	S202-V204 PolarHBondContact O-N 3.4Å
203	N	53.4	Low	73.3	Confident	185 Å²	185	76.4 Å²	76.4	99%	0.989	39%	0.385	S	S	*	.			trans	-73	21.9	-172.8	-114.4	1.1	0	0	0	114.4
204	V	58.5	Low	73.5	Confident	63 Å²	63	77.9 Å²	77.9	38%	0.382	39%	0.391	S	S	.	.	S	Bend	trans	-109.5	140.4	-172.7	-177.6	0	0	0	0	110.1	S202 L206 I209 I239	S202-V204 PolarHBondContact O-N 3.4Å; V204-L206 PolarHBondContact O-N 3.32Å; V204-I209 HydrophobicContact CG1-CD1 3.85Å; V204-I239 HydrophobicContact CG2-CD1 3.69Å
205	S	62.1	Low	73.2	Confident	59 Å²	59	80 Å²	80	41%	0.413	41%	0.405	S	S	.	.			trans	-65.9	74.1	172.2	-178.7	0	0	0	0	110.3	N207 E208	S205-N207 PolarHBondContact O-N 3.26Å; S205-N207 VanDerWaalsContact O-N 3.07Å; S205-E208 PolarHBondContact O-N 3.1Å; S205-E208 VanDerWaalsContact OG-CD 3.29Å; S205-E208 WeakPolarHBondContact OG-CG 3.22Å; S205-E208 PolarHBondContact OG-OE1 3.21Å
206	L	66.2	Low	72.9	Confident	10 Å²	10	79.6 Å²	79.6	5%	0.052	41%	0.409	C	S	.	.	H	α-helix	trans	-59.4	-21.9	-177.1	-72.5	162.9	0	0	0	113	L198 V204 E208 I209 F210 F242	L198-L206 HydrophobicContact CB-CB 4.4Å; L198-L206 HydrophobicContact CB-CD1 3.95Å; L198-L206 HydrophobicContact CD1-CB 3.59Å; L198-L206 HydrophobicContact CD2-CB 3.7Å; L198-L206 HydrophobicContact CD2-CD1 4.05Å; L198-L206 HydrophobicContact CD2-CG 4.36Å; L198-L206 HydrophobicContact CG-CB 4.07Å; L198-L206 HydrophobicContact CG-CD1 4.42Å; V204-L206 PolarHBondContact O-N 3.32Å; L206-E208 PolarHBondContact O-N 3.44Å; L206-I209 PolarHBondContact O-N 3.38Å; L206-F210 HydrophobicContact CD2-CD2 4.12Å; L206-F210 HydrophobicContact CD2-CE2 3.94Å; L206-F210 PolarHBondContact O-N 3.06Å; L206-F242 HydrophobicContact CD2-CD1 3.51Å; L206-F242 HydrophobicContact CD2-CE1 4.04Å
207	N	65.7	Low	71.9	Confident	119 Å²	119	80.4 Å²	80.4	64%	0.636	42%	0.415	S	S	*	.	H	α-helix	trans	-66.3	-19.3	175	-68.9	-24.8	0	0	0	113.7	L198 S205	L198-N207 WeakPolarHBondContact CD1-OD1 3.3Å; S205-N207 PolarHBondContact O-N 3.26Å; S205-N207 VanDerWaalsContact O-N 3.07Å
208	E	74.4	Confident	71	Confident	119 Å²	119	81.4 Å²	81.4	56%	0.556	44%	0.435	S	S	*	.	H	α-helix	trans	-87.4	-20.4	175.3	-70	172	-146.2	0	0	112.4	S205 L206 Q232	S205-E208 PolarHBondContact O-N 3.1Å; S205-E208 VanDerWaalsContact OG-CD 3.29Å; S205-E208 WeakPolarHBondContact OG-CG 3.22Å; S205-E208 PolarHBondContact OG-OE1 3.21Å; L206-E208 PolarHBondContact O-N 3.44Å; E208-Q232 PolarHBondContact O-NE2 2.9Å; E208-Q232 VanDerWaalsContact O-NE2 3.09Å
209	I	79.7	Confident	70.8	Confident	16 Å²	16	81.4 Å²	81.4	8%	0.082	44%	0.439	C	S	.	.	H	α-helix	trans	-94.2	-43.3	-179.2	-55.5	175.1	0	0	0	110.6	V204 L206 I230 K231 L234 F242	V204-I209 HydrophobicContact CG1-CD1 3.85Å; L206-I209 PolarHBondContact O-N 3.38Å; I209-I230 HydrophobicContact CG2-CG2 4.46Å; I209-I230 CarbonylContact O-C 3.58Å; I209-I230 WeakPolarHBondContact O-CA 3.29Å; I209-K231 PolarHBondContact O-N 2.73Å; I209-L234 HydrophobicContact CG2-CD2 3.91Å; I209-F242 HydrophobicContact CD1-CE1 4.14Å
210	F	87.1	Confident	70.9	Confident	5 Å²	5	85.8 Å²	85.8	2%	0.022	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	147.8	-171.9	-59.6	-73.5	0	0	0	114	L196 L206 L228 L229 I230 F242 M244 V284	L196-F210 HydrophobicContact CD2-CB 4.4Å; L206-F210 HydrophobicContact CD2-CD2 4.12Å; L206-F210 HydrophobicContact CD2-CE2 3.94Å; L206-F210 PolarHBondContact O-N 3.06Å; F210-L228 HydrophobicContact CB-CD1 4.23Å; F210-L228 HydrophobicContact CD1-CD1 4.28Å; F210-L228 HydrophobicContact CD1-CD2 4.08Å; F210-L228 HydrophobicContact CD1-CG 4.25Å; F210-L228 HydrophobicContact CE1-CD2 4.41Å; F210-L229 CarbonylContact C-O 3.54Å; F210-L229 VanDerWaalsContact CA-O 3.28Å; F210-L229 WeakPolarHBondContact CA-O 3.44Å; F210-I230 HydrophobicContact CD1-CG1 4.17Å; F210-I230 HydrophobicContact CE1-CD1 4.41Å; F210-I230 HydrophobicContact CE1-CG1 4Å; F210-I230 HydrophobicContact CE1-CG2 4.38Å; F210-F242 HydrophobicContact CE2-CB 3.87Å; F210-F242 AromaticContact CE2-CD1 3.79Å; F210-F242 HydrophobicContact CE2-CD1 3.79Å; F210-F242 HydrophobicContact CE2-CD2 4.28Å; F210-F242 HydrophobicContact CE2-CE1 4.37Å; F210-F242 AromaticContact CE2-CG 3.72Å; F210-F242 HydrophobicContact CE2-CG 3.72Å; F210-F242 HydrophobicContact CZ-CB 3.9Å; F210-F242 HydrophobicContact CZ-CD1 4.23Å; F210-F242 AromaticContact CZ-CD2 3.89Å; F210-F242 HydrophobicContact CZ-CD2 3.89Å; F210-F242 HydrophobicContact CZ-CE2 4.48Å; F210-F242 AromaticContact CZ-CG 3.74Å; F210-F242 HydrophobicContact CZ-CG 3.74Å; F210-M244 HydrophobicContact CD1-CE 3.93Å; F210-M244 HydrophobicContact CD2-CE 3.78Å; F210-M244 HydrophobicContact CE1-CE 3.96Å; F210-M244 HydrophobicContact CE2-CE 3.81Å; F210-M244 HydrophobicContact CG-CE 3.85Å; F210-M244 HydrophobicContact CZ-CE 3.9Å; F210-V284 HydrophobicContact CE1-CG2 4.07Å; F210-V284 HydrophobicContact CZ-CB 4.48Å; F210-V284 HydrophobicContact CZ-CG2 4.28Å
211	D	86.5	Confident	71.8	Confident	68 Å²	68	76.9 Å²	76.9	36%	0.364	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	160.8	173.6	-165.8	3.1	0	0	0	111.8	L228 L229 K231	D211-L228 CarbonylContact O-C 3.59Å; D211-L228 WeakPolarHBondContact O-CA 3.15Å; D211-L229 HydrophobicContact CB-CB 4.15Å; D211-L229 HydrophobicContact CB-CD1 4.32Å; D211-L229 PolarHBondContact N-O 2.79Å; D211-L229 PolarHBondContact O-N 3.38Å; D211-K231 HydrophobicContact CB-CD 4.4Å; D211-K231 VanDerWaalsContact CB-NZ 3.29Å; D211-K231 VanDerWaalsContact CG-NZ 3.33Å; D211-K231 WeakPolarHBondContact OD2-CE 3.18Å; D211-K231 IonicContact OD2-NZ 3.28Å; D211-K231 PolarHBondContact OD2-NZ 3.4Å
212	L	88.7	Confident	73	Confident	24 Å²	24	68.1 Å²	68.1	13%	0.126	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	116.3	-176	-173.7	69.9	0	0	0	111.9	I194 L196 L226 I246	I194-L212 HydrophobicContact CG2-CD2 3.94Å; L196-L212 HydrophobicContact CB-CB 4.26Å; L196-L212 HydrophobicContact CB-CD2 4.38Å; L212-L226 HydrophobicContact CD1-CB 4.37Å; L212-I246 HydrophobicContact CD1-CD1 3.76Å; L212-I246 HydrophobicContact CD1-CG1 4.48Å; L212-I246 HydrophobicContact CD2-CG2 4.2Å
213	K	87.7	Confident	74.3	Confident	97 Å²	97	67 Å²	67	42%	0.422	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	124.4	176.5	-174.1	170	-179.1	167.9	0	111.3	T215 L226 S227 L229	K213-T215 HydrophobicContact CG-CG2 4.44Å; K213-L226 CarbonylContact O-C 3.59Å; K213-L226 WeakPolarHBondContact O-CA 3.35Å; K213-S227 PolarHBondContact N-O 2.89Å; K213-S227 PolarHBondContact O-N 3.4Å; K213-L229 HydrophobicContact CB-CD1 4.2Å; K213-L229 HydrophobicContact CB-CD2 4.46Å; K213-L229 HydrophobicContact CB-CG 4.32Å
214	I	89.6	Confident	75.9	Confident	45 Å²	45	59.8 Å²	59.8	23%	0.231	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	127.9	179.3	-51.3	172.7	0	0	0	110.1	I194 Y224 L226	I194-I214 HydrophobicContact CB-CD1 3.89Å; I194-I214 HydrophobicContact CD1-CG2 4.27Å; I194-I214 HydrophobicContact CG2-CD1 3.82Å; I194-I214 HydrophobicContact CG2-CG1 4.28Å; I214-Y224 HydrophobicContact CG2-CD1 3.92Å; I214-Y224 HydrophobicContact CG2-CG 4.14Å; I214-L226 HydrophobicContact CB-CD2 4.25Å; I214-L226 HydrophobicContact CG1-CD2 3.83Å; I214-L226 HydrophobicContact CG2-CD2 4.07Å
215	T	82.4	Confident	77.1	Confident	57 Å²	57	58.8 Å²	58.8	35%	0.35	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	140.9	-178.7	52.1	0	0	0	0	111.8	K213 Y224 A225	K213-T215 HydrophobicContact CG-CG2 4.44Å; T215-Y224 CarbonylContact O-C 3.51Å; T215-Y224 VanDerWaalsContact O-CA 3.24Å; T215-Y224 WeakPolarHBondContact O-CA 3.37Å; T215-A225 PolarHBondContact N-O 2.79Å; T215-A225 PolarHBondContact O-N 2.96Å; T215-A225 WeakPolarHBondContact OG1-CB 3.37Å; T215-A225 PolarHBondContact OG1-O 2.78Å
216	N	79.3	Confident	78.4	Confident	120 Å²	120	56.3 Å²	56.3	64%	0.642	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	151.1	-177.6	-66	-15.5	0	0	0	112.4	P223 Y224	N216-P223 CarbonylContact C-O 3.51Å; N216-P223 WeakPolarHBondContact CA-O 3.16Å; N216-Y224 WeakPolarHBondContact OD1-CE1 3.36Å
217	T	67.1	Low	79.4	Confident	59 Å²	59	56.3 Å²	56.3	36%	0.362	31%	0.308	S	S	.	.			trans	-123.3	171	174.9	88.8	0	0	0	0	112.3	S219 S222 P223 A225	T217-S219 PolarHBondContact OG1-N 3.47Å; T217-S219 VanDerWaalsContact OG1-N 3.14Å; T217-S222 WeakPolarHBondContact CG2-O 3.35Å; T217-S222 PolarHBondContact OG1-O 3.43Å; T217-P223 PolarHBondContact N-O 3.11Å; T217-A225 HydrophobicContact CG2-CB 4.27Å
218	S	63.3	Low	80.5	Confident	124 Å²	124	50.7 Å²	50.7	87%	0.867	28%	0.278	S	S	*	.	S	Bend	trans	-85.6	-4.5	173.6	57.1	0	0	0	0	114
219	S	64.4	Low	81.1	Confident	41 Å²	41	46 Å²	46	29%	0.287	26%	0.257	S	S	.	.			trans	-79.9	130.5	-178.2	-178.8	0	0	0	0	110.7	T217 V221 S222	T217-S219 PolarHBondContact OG1-N 3.47Å; T217-S219 VanDerWaalsContact OG1-N 3.14Å; S219-V221 VanDerWaalsContact C-N 3.29Å; S219-V221 VanDerWaalsContact OG-CG2 3.32Å; S219-V221 WeakPolarHBondContact OG-CG2 3.16Å; S219-V221 PolarHBondContact OG-N 2.82Å; S219-S222 PolarHBondContact OG-N 3.05Å
220	K	68.4	Low	81.4	Confident	157 Å²	157	45.3 Å²	45.3	68%	0.683	25%	0.253	S	S	*	.	S	Bend	trans	-71	-23.8	172.5	-70.7	-173.2	178.9	177.1	0	113.2
221	V	75.2	Confident	81.1	Confident	8 Å²	8	48.7 Å²	48.7	5%	0.048	27%	0.268	C	S	.	.	S	Bend	trans	-101.5	-5.5	-177.3	-64	0	0	0	0	113.6	K92 L94 V179 D180 T183 S219	K92-V221 HydrophobicContact CB-CG1 4.44Å; K92-V221 HydrophobicContact CD-CG1 4.37Å; L94-V221 HydrophobicContact CD2-CG2 4.17Å; L94-V221 HydrophobicContact CG-CG2 4.37Å; V179-V221 WeakPolarHBondContact CA-O 2.96Å; D180-V221 PolarHBondContact N-O 2.89Å; D180-V221 CarbonylContact O-C 3.58Å; D180-V221 WeakPolarHBondContact O-CA 3.28Å; D180-V221 VanDerWaalsContact O-CB 3.23Å; D180-V221 WeakPolarHBondContact O-CB 3.47Å; D180-V221 VanDerWaalsContact O-O 3.05Å; T183-V221 HydrophobicContact CG2-CG1 4.19Å; S219-V221 VanDerWaalsContact C-N 3.29Å; S219-V221 VanDerWaalsContact OG-CG2 3.32Å; S219-V221 WeakPolarHBondContact OG-CG2 3.16Å; S219-V221 PolarHBondContact OG-N 2.82Å
222	S	81.1	Confident	80.8	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.014	27%	0.27	C	S	.	.			trans	-149.1	68	176.6	-175.8	0	0	0	0	110	Q177 L178 T217 S219 Y224	Q177-S222 WeakPolarHBondContact CG-OG 3.18Å; Q177-S222 PolarHBondContact NE2-OG 3.17Å; L178-S222 WeakPolarHBondContact O-CB 3.18Å; L178-S222 PolarHBondContact O-OG 2.89Å; T217-S222 WeakPolarHBondContact CG2-O 3.35Å; T217-S222 PolarHBondContact OG1-O 3.43Å; S219-S222 PolarHBondContact OG-N 3.05Å; S222-Y224 PolarHBondContact O-N 2.9Å
223	P	79.3	Confident	80.4	Confident	28 Å²	28	51.2 Å²	51.2	18%	0.182	28%	0.283	C	S	.	.			trans	-70.2	-13.2	-168	26.3	-34.1	0	0	0	114.6	I189 N216 T217	I189-P223 HydrophobicContact CB-CG 4.39Å; N216-P223 CarbonylContact C-O 3.51Å; N216-P223 WeakPolarHBondContact CA-O 3.16Å; T217-P223 PolarHBondContact N-O 3.11Å
224	Y	87.9	Confident	80.2	Confident	34 Å²	34	47.1 Å²	47.1	13%	0.133	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	137.4	-175.8	-51.3	-66.8	0	0	0	113.2	I189 R191 I194 I214 T215 N216 S222	I189-Y224 HydrophobicContact CB-CD2 4.48Å; I189-Y224 HydrophobicContact CB-CE2 4.37Å; I189-Y224 HydrophobicContact CG2-CD2 3.82Å; I189-Y224 HydrophobicContact CG2-CE2 3.85Å; R191-Y224 HydrophobicContact CB-CE1 3.85Å; R191-Y224 HydrophobicContact CB-CE2 4.22Å; R191-Y224 WeakPolarHBondContact CB-OH 3.11Å; R191-Y224 HydrophobicContact CG-CD1 4.35Å; R191-Y224 HydrophobicContact CG-CE1 3.72Å; R191-Y224 PolarHBondContact N-OH 2.92Å; I194-Y224 HydrophobicContact CD1-CD2 3.49Å; I194-Y224 VanDerWaalsContact CD1-CD2 3.49Å; I194-Y224 HydrophobicContact CD1-CE2 4.19Å; I194-Y224 HydrophobicContact CD1-CG 3.77Å; I214-Y224 HydrophobicContact CG2-CD1 3.92Å; I214-Y224 HydrophobicContact CG2-CG 4.14Å; T215-Y224 CarbonylContact O-C 3.51Å; T215-Y224 VanDerWaalsContact O-CA 3.24Å; T215-Y224 WeakPolarHBondContact O-CA 3.37Å; N216-Y224 WeakPolarHBondContact OD1-CE1 3.36Å; S222-Y224 PolarHBondContact O-N 2.9Å
225	A	83.4	Confident	79.9	Confident	42 Å²	42	48.4 Å²	48.4	35%	0.347	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	137.7	166.8	0	0	0	0	0	110.6	T215 T217	T215-A225 PolarHBondContact N-O 2.79Å; T215-A225 PolarHBondContact O-N 2.96Å; T215-A225 WeakPolarHBondContact OG1-CB 3.37Å; T215-A225 PolarHBondContact OG1-O 2.78Å; T217-A225 HydrophobicContact CG2-CB 4.27Å
226	L	89.5	Confident	80	Confident	8 Å²	8	47.9 Å²	47.9	4%	0.042	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	147.5	-170.1	-56.6	-176.8	0	0	0	112.1	F150 I175 I194 L212 K213 I214 I246	F150-L226 HydrophobicContact CE1-CD1 3.92Å; F150-L226 HydrophobicContact CZ-CD1 4.5Å; I175-L226 HydrophobicContact CB-CB 3.79Å; I175-L226 HydrophobicContact CG2-CB 3.92Å; I175-L226 HydrophobicContact CG2-CD1 4.22Å; I175-L226 PolarHBondContact N-O 2.69Å; I175-L226 VanDerWaalsContact N-O 3.1Å; I194-L226 HydrophobicContact CD1-CD2 4.37Å; I194-L226 HydrophobicContact CG2-CD1 4.21Å; I194-L226 HydrophobicContact CG2-CD2 3.85Å; L212-L226 HydrophobicContact CD1-CB 4.37Å; K213-L226 CarbonylContact O-C 3.59Å; K213-L226 WeakPolarHBondContact O-CA 3.35Å; I214-L226 HydrophobicContact CB-CD2 4.25Å; I214-L226 HydrophobicContact CG1-CD2 3.83Å; I214-L226 HydrophobicContact CG2-CD2 4.07Å; L226-I246 HydrophobicContact CD1-CG2 4.07Å
227	S	87.2	Confident	80.2	Confident	10 Å²	10	45.7 Å²	45.7	7%	0.07	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	133.2	170.2	-50.2	0	0	0	0	111.4	K172 V173 K213	K172-S227 WeakPolarHBondContact CE-OG 3.49Å; V173-S227 CarbonylContact O-C 3.51Å; V173-S227 WeakPolarHBondContact O-CA 3.41Å; V173-S227 WeakPolarHBondContact O-CB 3.35Å; K213-S227 PolarHBondContact N-O 2.89Å; K213-S227 PolarHBondContact O-N 3.4Å
228	L	88.2	Confident	80.9	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	135	170.6	-173	71.7	0	0	0	109.4	I158 V173 I175 L196 F210 D211 M244 V282 V284	I158-L228 HydrophobicContact CD1-CD2 3.78Å; V173-L228 HydrophobicContact CB-CB 4.45Å; V173-L228 PolarHBondContact N-O 2.87Å; V173-L228 PolarHBondContact O-N 2.85Å; I175-L228 HydrophobicContact CD1-CB 3.99Å; I175-L228 HydrophobicContact CG1-CB 4.16Å; L196-L228 HydrophobicContact CD2-CD1 4.21Å; F210-L228 HydrophobicContact CB-CD1 4.23Å; F210-L228 HydrophobicContact CD1-CD1 4.28Å; F210-L228 HydrophobicContact CD1-CD2 4.08Å; F210-L228 HydrophobicContact CD1-CG 4.25Å; F210-L228 HydrophobicContact CE1-CD2 4.41Å; D211-L228 CarbonylContact O-C 3.59Å; D211-L228 WeakPolarHBondContact O-CA 3.15Å; L228-M244 HydrophobicContact CD1-SD 3.67Å; L228-M244 HydrophobicContact CD2-CE 4.4Å; L228-M244 HydrophobicContact CD2-SD 3.91Å; L228-M244 HydrophobicContact CG-SD 4.47Å; L228-V282 HydrophobicContact CD2-CG1 4.4Å; L228-V284 HydrophobicContact CD2-CG2 4.14Å
229	L	86.2	Confident	81.6	Confident	22 Å²	22	43.5 Å²	43.5	12%	0.115	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	126.7	176.9	-54.7	176.7	0	0	0	109	I171 K172 F210 D211 K213	I171-L229 CarbonylContact O-C 3.53Å; I171-L229 WeakPolarHBondContact O-CA 3.34Å; K172-L229 HydrophobicContact CB-CD2 3.98Å; K172-L229 HydrophobicContact CG-CD2 3.82Å; F210-L229 CarbonylContact C-O 3.54Å; F210-L229 VanDerWaalsContact CA-O 3.28Å; F210-L229 WeakPolarHBondContact CA-O 3.44Å; D211-L229 HydrophobicContact CB-CB 4.15Å; D211-L229 HydrophobicContact CB-CD1 4.32Å; D211-L229 PolarHBondContact N-O 2.79Å; D211-L229 PolarHBondContact O-N 3.38Å; K213-L229 HydrophobicContact CB-CD1 4.2Å; K213-L229 HydrophobicContact CB-CD2 4.46Å; K213-L229 HydrophobicContact CB-CG 4.32Å
230	I	86.5	Confident	82.4	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	117.2	173.6	-47.3	179.1	0	0	0	107.4	V160 M170 I171 V173 I209 F210 L234	V160-I230 HydrophobicContact CG1-CD1 4.27Å; V160-I230 HydrophobicContact CG2-CD1 3.65Å; M170-I230 CarbonylContact C-O 3.49Å; M170-I230 WeakPolarHBondContact CA-O 3.41Å; I171-I230 HydrophobicContact CB-CB 4.08Å; I171-I230 HydrophobicContact CB-CD1 4.21Å; I171-I230 HydrophobicContact CB-CG1 4.31Å; I171-I230 HydrophobicContact CG2-CD1 4.33Å; I171-I230 PolarHBondContact N-O 3.2Å; I171-I230 PolarHBondContact O-N 3.07Å; V173-I230 HydrophobicContact CG2-CD1 4.39Å; I209-I230 HydrophobicContact CG2-CG2 4.46Å; I209-I230 CarbonylContact O-C 3.58Å; I209-I230 WeakPolarHBondContact O-CA 3.29Å; F210-I230 HydrophobicContact CD1-CG1 4.17Å; F210-I230 HydrophobicContact CE1-CD1 4.41Å; F210-I230 HydrophobicContact CE1-CG1 4Å; F210-I230 HydrophobicContact CE1-CG2 4.38Å; I230-L234 HydrophobicContact CG2-CD2 4.38Å; I230-L234 HydrophobicContact CG2-CG 4.47Å
231	K	80.9	Confident	83.1	Confident	77 Å²	77	42.8 Å²	42.8	34%	0.335	23%	0.228	S	C	.	.			trans	-100.9	-9	-168.3	-66.6	177.3	175.2	170.6	0	114.6	M170 I209 D211	M170-K231 HydrophobicContact CG-CG 4.37Å; M170-K231 HydrophobicContact SD-CG 4.22Å; I209-K231 PolarHBondContact O-N 2.73Å; D211-K231 HydrophobicContact CB-CD 4.4Å; D211-K231 VanDerWaalsContact CB-NZ 3.29Å; D211-K231 VanDerWaalsContact CG-NZ 3.33Å; D211-K231 WeakPolarHBondContact OD2-CE 3.18Å; D211-K231 IonicContact OD2-NZ 3.28Å; D211-K231 PolarHBondContact OD2-NZ 3.4Å
232	Q	81	Confident	83.6	Confident	87 Å²	87	42.9 Å²	42.9	41%	0.407	23%	0.227	S	C	.	.	S	Bend	trans	-137	153.9	-176.2	-61.4	-172.8	23.8	0	0	109.9	E208	E208-Q232 PolarHBondContact O-NE2 2.9Å; E208-Q232 VanDerWaalsContact O-NE2 3.09Å
233	S	79.8	Confident	83.8	Confident	58 Å²	58	48.3 Å²	48.3	41%	0.406	25%	0.248	S	C	.	.			trans	-65.2	138.7	172.1	-170	0	0	0	0	109.4	G163	G163-S233 WeakPolarHBondContact CA-OG 3.36Å; G163-S233 PolarHBondContact N-OG 3.25Å
234	L	84	Confident	84.2	Confident	11 Å²	11	47.2 Å²	47.2	6%	0.058	24%	0.24	C	C	.	.			trans	-92.7	157.5	173.1	-51.9	-179.1	0	0	0	109.1	V160 E162 G163 I209 I230 F242 V284 V286	V160-L234 HydrophobicContact CB-CD1 4.05Å; V160-L234 HydrophobicContact CG1-CD1 3.88Å; E162-L234 WeakPolarHBondContact CA-O 3.48Å; E162-L234 WeakPolarHBondContact CB-O 3.49Å; G163-L234 PolarHBondContact N-O 3.11Å; I209-L234 HydrophobicContact CG2-CD2 3.91Å; I230-L234 HydrophobicContact CG2-CD2 4.38Å; I230-L234 HydrophobicContact CG2-CG 4.47Å; L234-F242 HydrophobicContact CD1-CE2 4.18Å; L234-F242 HydrophobicContact CD2-CE2 3.87Å; L234-F242 HydrophobicContact CD2-CZ 4.08Å; L234-V284 HydrophobicContact CD1-CG1 4.45Å; L234-V286 HydrophobicContact CB-CG1 4.16Å; L234-V286 HydrophobicContact CB-CG2 4.13Å; L234-V286 HydrophobicContact CD1-CG2 3.98Å
235	D	82.6	Confident	84.2	Confident	72 Å²	72	47.2 Å²	47.2	39%	0.385	24%	0.244	S	C	.	.			trans	-140.9	119.4	-175.3	162.8	-1.5	0	0	0	106.9	E237 S238 I239	D235-E237 PolarHBondContact OD1-N 3.22Å; D235-E237 VanDerWaalsContact OD1-N 3.09Å; D235-S238 VanDerWaalsContact CG-OG 3.31Å; D235-S238 PolarHBondContact O-N 2.77Å; D235-S238 PolarHBondContact OD1-N 3.09Å; D235-S238 VanDerWaalsContact OD1-N 3.13Å; D235-S238 WeakPolarHBondContact OD2-CB 3.28Å; D235-S238 PolarHBondContact OD2-OG 3.08Å; D235-I239 PolarHBondContact O-N 3.31Å; D235-I239 VanDerWaalsContact O-N 3.1Å
236	Y	85.5	Confident	84.5	Confident	46 Å²	46	45.2 Å²	45.2	18%	0.18	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-42.1	-173	-178.2	-88	0	0	0	111.9	E162 S238 I239 Q240 V286 D288 A325	E162-Y236 WeakPolarHBondContact OE2-CB 3.44Å; E162-Y236 PolarHBondContact OE2-N 2.74Å; Y236-S238 PolarHBondContact O-N 2.89Å; Y236-I239 PolarHBondContact O-N 2.8Å; Y236-Q240 HydrophobicContact CD2-CG 4.29Å; Y236-Q240 HydrophobicContact CE1-CG 4.16Å; Y236-Q240 HydrophobicContact CE2-CB 4.3Å; Y236-Q240 HydrophobicContact CE2-CG 3.91Å; Y236-Q240 PolarHBondContact OH-NE2 2.75Å; Y236-V286 HydrophobicContact CD2-CB 4.28Å; Y236-V286 HydrophobicContact CD2-CG1 4.26Å; Y236-V286 WeakPolarHBondContact CD2-O 3.16Å; Y236-D288 HydrophobicContact CD1-CB 3.72Å; Y236-D288 VanDerWaalsContact CD1-OD1 3.27Å; Y236-D288 WeakPolarHBondContact CD1-OD1 3.38Å; Y236-D288 HydrophobicContact CD2-CB 3.8Å; Y236-D288 HydrophobicContact CE1-CB 3.99Å; Y236-D288 HydrophobicContact CE2-CB 4.01Å; Y236-D288 HydrophobicContact CG-CB 3.63Å; Y236-A325 HydrophobicContact CD1-CB 4.13Å; Y236-A325 HydrophobicContact CE1-CB 3.32Å
237	E	82.6	Confident	84.5	Confident	74 Å²	74	45.2 Å²	45.2	35%	0.346	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-27.4	178.1	-73.7	55.3	-114.8	0	0	111.1	D235	D235-E237 PolarHBondContact OD1-N 3.22Å; D235-E237 VanDerWaalsContact OD1-N 3.09Å
238	S	81	Confident	84.5	Confident	83 Å²	83	44.7 Å²	44.7	58%	0.58	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-61	174.5	-74.8	0	0	0	0	113.9	D235 Y236	D235-S238 VanDerWaalsContact CG-OG 3.31Å; D235-S238 PolarHBondContact O-N 2.77Å; D235-S238 PolarHBondContact OD1-N 3.09Å; D235-S238 VanDerWaalsContact OD1-N 3.13Å; D235-S238 WeakPolarHBondContact OD2-CB 3.28Å; D235-S238 PolarHBondContact OD2-OG 3.08Å; Y236-S238 PolarHBondContact O-N 2.89Å
239	I	79.2	Confident	84.3	Confident	54 Å²	54	45.4 Å²	45.4	28%	0.277	23%	0.229	S	C	.	.			trans	-145.8	120.8	-175.1	-59.7	178.9	0	0	0	111.2	V204 D235 Y236 F242 V286	V204-I239 HydrophobicContact CG2-CD1 3.69Å; D235-I239 PolarHBondContact O-N 3.31Å; D235-I239 VanDerWaalsContact O-N 3.1Å; Y236-I239 PolarHBondContact O-N 2.8Å; I239-F242 HydrophobicContact CB-CE1 4.42Å; I239-F242 HydrophobicContact CB-CZ 4.05Å; I239-F242 HydrophobicContact CD1-CE1 4.21Å; I239-F242 HydrophobicContact CD1-CZ 4.48Å; I239-F242 HydrophobicContact CG2-CD1 4.35Å; I239-F242 HydrophobicContact CG2-CE1 3.88Å; I239-F242 HydrophobicContact CG2-CE2 4.23Å; I239-F242 HydrophobicContact CG2-CZ 3.81Å; I239-V286 VanDerWaalsContact O-CG2 3.28Å; I239-V286 WeakPolarHBondContact O-CG2 3.31Å
240	Q	81.9	Confident	83.5	Confident	116 Å²	116	44.9 Å²	44.9	54%	0.542	23%	0.227	S	C	.	.	S	Bend	trans	-84.4	-22.4	-174.5	-60.6	174.8	-17.1	0	0	114.6	Y236 V286	Y236-Q240 HydrophobicContact CD2-CG 4.29Å; Y236-Q240 HydrophobicContact CE1-CG 4.16Å; Y236-Q240 HydrophobicContact CE2-CB 4.3Å; Y236-Q240 HydrophobicContact CE2-CG 3.91Å; Y236-Q240 PolarHBondContact OH-NE2 2.75Å; Q240-V286 PolarHBondContact O-N 3.1Å
241	E	83	Confident	82.4	Confident	67 Å²	67	47.9 Å²	47.9	31%	0.313	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	140.7	-172.2	-162	-163.4	94.6	0	0	113.6	R243 I283 V284 H285	E241-R243 VanDerWaalsContact CD-NH2 3.27Å; E241-R243 WeakPolarHBondContact OE1-CG 3.12Å; E241-R243 IonicContact OE1-CZ 3.23Å; E241-R243 IonicContact OE1-NE 2.71Å; E241-R243 PolarHBondContact OE1-NE 3.37Å; E241-R243 IonicContact OE1-NH2 3.64Å; E241-R243 PolarHBondContact OE1-NH2 3.37Å; E241-R243 IonicContact OE2-CZ 3.24Å; E241-R243 IonicContact OE2-NH2 3.42Å; E241-R243 PolarHBondContact OE2-NH2 2.95Å; E241-R243 VanDerWaalsContact OE2-NH2 3.08Å; E241-I283 HydrophobicContact CG-CG2 3.64Å; E241-V284 CarbonylContact C-O 3.52Å; E241-V284 WeakPolarHBondContact CA-O 3.38Å; E241-H285 IonicContact OE2-CE1 3.46Å; E241-H285 IonicContact OE2-ND1 2.96Å
242	F	84.7	Confident	81	Confident	10 Å²	10	48.2 Å²	48.2	4%	0.044	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	131	173	-55.5	-87.9	0	0	0	111.8	L206 I209 F210 L234 I239 M244 I283 V284 V286	L206-F242 HydrophobicContact CD2-CD1 3.51Å; L206-F242 HydrophobicContact CD2-CE1 4.04Å; I209-F242 HydrophobicContact CD1-CE1 4.14Å; F210-F242 HydrophobicContact CE2-CB 3.87Å; F210-F242 AromaticContact CE2-CD1 3.79Å; F210-F242 HydrophobicContact CE2-CD1 3.79Å; F210-F242 HydrophobicContact CE2-CD2 4.28Å; F210-F242 HydrophobicContact CE2-CE1 4.37Å; F210-F242 AromaticContact CE2-CG 3.72Å; F210-F242 HydrophobicContact CE2-CG 3.72Å; F210-F242 HydrophobicContact CZ-CB 3.9Å; F210-F242 HydrophobicContact CZ-CD1 4.23Å; F210-F242 AromaticContact CZ-CD2 3.89Å; F210-F242 HydrophobicContact CZ-CD2 3.89Å; F210-F242 HydrophobicContact CZ-CE2 4.48Å; F210-F242 AromaticContact CZ-CG 3.74Å; F210-F242 HydrophobicContact CZ-CG 3.74Å; L234-F242 HydrophobicContact CD1-CE2 4.18Å; L234-F242 HydrophobicContact CD2-CE2 3.87Å; L234-F242 HydrophobicContact CD2-CZ 4.08Å; I239-F242 HydrophobicContact CB-CE1 4.42Å; I239-F242 HydrophobicContact CB-CZ 4.05Å; I239-F242 HydrophobicContact CD1-CE1 4.21Å; I239-F242 HydrophobicContact CD1-CZ 4.48Å; I239-F242 HydrophobicContact CG2-CD1 4.35Å; I239-F242 HydrophobicContact CG2-CE1 3.88Å; I239-F242 HydrophobicContact CG2-CE2 4.23Å; I239-F242 HydrophobicContact CG2-CZ 3.81Å; F242-M244 HydrophobicContact CB-CE 4.35Å; F242-I283 CarbonylContact O-C 3.6Å; F242-I283 WeakPolarHBondContact O-CA 3.03Å; F242-V284 HydrophobicContact CB-CB 4.19Å; F242-V284 HydrophobicContact CD2-CB 4.42Å; F242-V284 PolarHBondContact N-O 2.88Å; F242-V284 PolarHBondContact O-N 3.33Å; F242-V286 HydrophobicContact CD2-CG2 4.24Å; F242-V286 HydrophobicContact CE2-CG2 3.75Å
243	R	85.1	Confident	79.3	Confident	116 Å²	116	51.6 Å²	51.6	44%	0.438	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	133.8	177.9	-63.9	-174.3	-176	-94.7	-12.5	112.3	D199 E241	D199-R243 HydrophobicContact CB-CB 4.11Å; D199-R243 WeakPolarHBondContact CB-O 3.2Å; D199-R243 PolarHBondContact N-O 2.96Å; E241-R243 VanDerWaalsContact CD-NH2 3.27Å; E241-R243 WeakPolarHBondContact OE1-CG 3.12Å; E241-R243 IonicContact OE1-CZ 3.23Å; E241-R243 IonicContact OE1-NE 2.71Å; E241-R243 PolarHBondContact OE1-NE 3.37Å; E241-R243 IonicContact OE1-NH2 3.64Å; E241-R243 PolarHBondContact OE1-NH2 3.37Å; E241-R243 IonicContact OE2-CZ 3.24Å; E241-R243 IonicContact OE2-NH2 3.42Å; E241-R243 PolarHBondContact OE2-NH2 2.95Å; E241-R243 VanDerWaalsContact OE2-NH2 3.08Å
244	M	87.2	Confident	77.3	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.02	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	165.8	179.3	66.6	-165.1	73.9	0	0	112.1	L196 L198 F210 L228 F242 V282 V284	L196-M244 HydrophobicContact CD1-CB 4.15Å; L196-M244 HydrophobicContact CD1-CG 4.01Å; L196-M244 HydrophobicContact CD1-SD 3.94Å; L198-M244 HydrophobicContact CD2-CB 3.96Å; F210-M244 HydrophobicContact CD1-CE 3.93Å; F210-M244 HydrophobicContact CD2-CE 3.78Å; F210-M244 HydrophobicContact CE1-CE 3.96Å; F210-M244 HydrophobicContact CE2-CE 3.81Å; F210-M244 HydrophobicContact CG-CE 3.85Å; F210-M244 HydrophobicContact CZ-CE 3.9Å; L228-M244 HydrophobicContact CD1-SD 3.67Å; L228-M244 HydrophobicContact CD2-CE 4.4Å; L228-M244 HydrophobicContact CD2-SD 3.91Å; L228-M244 HydrophobicContact CG-SD 4.47Å; F242-M244 HydrophobicContact CB-CE 4.35Å; M244-V282 HydrophobicContact CG-CB 3.63Å; M244-V282 HydrophobicContact CG-CG1 4.06Å; M244-V282 PolarHBondContact N-O 3.47Å; M244-V282 PolarHBondContact O-N 2.57Å; M244-V282 HydrophobicContact SD-CB 4.39Å; M244-V282 HydrophobicContact SD-CG1 4.23Å; M244-V284 HydrophobicContact CE-CG2 3.83Å
245	T	88	Confident	75	Confident	35 Å²	35	64 Å²	64	22%	0.215	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	127.2	-178.8	-53	0	0	0	0	110.4	K197 V247 F279 L280 N281	K197-T245 WeakPolarHBondContact CA-O 3.35Å; K197-T245 WeakPolarHBondContact CB-O 3.36Å; K197-T245 PolarHBondContact N-O 3.47Å; K197-T245 PolarHBondContact O-N 3.37Å; K197-T245 VanDerWaalsContact O-O 3.13Å; T245-V247 HydrophobicContact CG2-CG2 4.21Å; T245-F279 HydrophobicContact CG2-CB 4.16Å; T245-F279 HydrophobicContact CG2-CD1 4.14Å; T245-L280 CarbonylContact C-O 3.51Å; T245-L280 VanDerWaalsContact CA-O 3.27Å; T245-L280 WeakPolarHBondContact CA-O 3.41Å; T245-N281 PolarHBondContact OG1-OD1 3.33Å
246	I	89.9	Confident	72.5	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	134.9	170.9	-59.9	172.7	0	0	0	108.5	F150 I175 K195 L196 L212 L226 F279 L280 V282	F150-I246 HydrophobicContact CE1-CG2 4.37Å; F150-I246 HydrophobicContact CZ-CB 4.35Å; F150-I246 HydrophobicContact CZ-CG2 3.88Å; I175-I246 HydrophobicContact CB-CD1 4.47Å; I175-I246 HydrophobicContact CD1-CD1 4.08Å; I175-I246 HydrophobicContact CG1-CD1 3.99Å; I175-I246 HydrophobicContact CG2-CD1 3.71Å; K195-I246 WeakPolarHBondContact O-CA 3.23Å; L196-I246 HydrophobicContact CD1-CD1 4.42Å; L196-I246 HydrophobicContact CD1-CG1 3.64Å; L212-I246 HydrophobicContact CD1-CD1 3.76Å; L212-I246 HydrophobicContact CD1-CG1 4.48Å; L212-I246 HydrophobicContact CD2-CG2 4.2Å; L226-I246 HydrophobicContact CD1-CG2 4.07Å; I246-F279 CarbonylContact O-C 3.36Å; I246-F279 VanDerWaalsContact O-CA 3.31Å; I246-F279 WeakPolarHBondContact O-CA 3.46Å; I246-L280 HydrophobicContact CB-CB 4.27Å; I246-L280 HydrophobicContact CD1-CD2 4.29Å; I246-L280 PolarHBondContact N-O 3.32Å; I246-L280 PolarHBondContact O-N 2.86Å; I246-V282 HydrophobicContact CD1-CG2 4.23Å
247	V	89.2	Confident	69.9	Low	7 Å²	7	73.5 Å²	73.5	4%	0.042	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	140.2	-178.4	-173.5	0	0	0	0	110	I194 K195 K197 T245 E277 C278 F279	I194-V247 CarbonylContact C-O 3.5Å; I194-V247 VanDerWaalsContact CA-O 3.22Å; I194-V247 WeakPolarHBondContact CA-O 3.44Å; K195-V247 PolarHBondContact N-O 3.06Å; K195-V247 PolarHBondContact O-N 2.88Å; K197-V247 HydrophobicContact CD-CG2 3.64Å; K197-V247 HydrophobicContact CG-CG2 4.05Å; T245-V247 HydrophobicContact CG2-CG2 4.21Å; V247-E277 HydrophobicContact CG1-CB 4.44Å; V247-E277 HydrophobicContact CG1-CG 4.49Å; V247-C278 WeakPolarHBondContact CA-O 3.44Å; V247-F279 HydrophobicContact CB-CD1 4.42Å; V247-F279 HydrophobicContact CG1-CD1 4.17Å; V247-F279 HydrophobicContact CG1-CE1 3.88Å; V247-F279 HydrophobicContact CG2-CD1 3.67Å; V247-F279 HydrophobicContact CG2-CE1 3.9Å
248	A	88.2	Confident	67.4	Low	0 Å²	0	76.8 Å²	76.8	0%	0	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	158.7	172.5	0	0	0	0	0	111.7	C148 L178 I194 E277 C278	C148-A248 PolarHBondContact SG-O 3.35Å; L178-A248 HydrophobicContact CD1-CB 3.79Å; L178-A248 HydrophobicContact CD2-CB 3.65Å; L178-A248 HydrophobicContact CG-CB 4.38Å; I194-A248 HydrophobicContact CG1-CB 4.02Å; A248-E277 CarbonylContact O-C 3.41Å; A248-E277 VanDerWaalsContact O-CA 3.32Å; A248-E277 WeakPolarHBondContact O-CA 3.21Å; A248-C278 PolarHBondContact N-O 3.01Å; A248-C278 PolarHBondContact O-N 2.9Å
249	S	83	Confident	65.1	Low	14 Å²	14	80.7 Å²	80.7	10%	0.098	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	161.7	178.9	70	0	0	0	0	114	H190 S193 S251 N276	H190-S249 PolarHBondContact N-O 3.44Å; S193-S249 WeakPolarHBondContact CB-O 3.05Å; S193-S249 WeakPolarHBondContact CB-OG 3.29Å; S193-S249 PolarHBondContact OG-N 2.94Å; S193-S249 PolarHBondContact OG-O 3.26Å; S249-S251 PolarHBondContact OG-O 3.03Å; S249-N276 WeakPolarHBondContact CA-O 3.49Å; S249-N276 WeakPolarHBondContact CB-O 3.39Å
250	S	70.1	Confident	63	Low	12 Å²	12	83.3 Å²	83.3	8%	0.084	45%	0.445	C	S	.	.	S	Bend	trans	-77.3	-29.2	176.7	62.6	0	0	0	0	114.1	D144 G188 N276	D144-S250 WeakPolarHBondContact OD2-CB 3.23Å; D144-S250 PolarHBondContact OD2-OG 3.35Å; G188-S250 WeakPolarHBondContact O-CA 3.45Å; G188-S250 WeakPolarHBondContact O-CB 3.18Å; S250-N276 PolarHBondContact OG-ND2 2.82Å
251	S	63.4	Low	60.5	Low	63 Å²	63	84.4 Å²	84.4	44%	0.441	46%	0.46	S	S	.	.			trans	-116.7	150	-178.2	68.6	0	0	0	0	113.9	S249	S249-S251 PolarHBondContact OG-O 3.03Å
252	T	50.9	Low	57.9	Low	83 Å²	83	84.1 Å²	84.1	51%	0.509	48%	0.476	S	S	.	.	S	Bend	trans	-86	-16.3	-179	51.7	0	0	0	0	114.4	H190 S192	H190-T252 HydrophobicContact CB-CG2 4.21Å; H190-T252 WeakPolarHBondContact CE1-CG2 3.42Å; H190-T252 VanDerWaalsContact CG-CG2 3.44Å; H190-T252 WeakPolarHBondContact ND1-CG2 3.36Å; S192-T252 WeakPolarHBondContact OG-CG2 3.42Å
253	E	46.8	Very low	55.2	Low	159 Å²	159	91.3 Å²	91.3	74%	0.743	51%	0.514	S	S	*	.	S	Bend	trans	-153.2	138.8	-168.7	-67.1	-172.5	153.7	0	0	114
254	K	37.7	Very low	52.8	Low	202 Å²	202	95.6 Å²	95.6	88%	0.878	54%	0.537	S	S	*	.			trans	-59.4	123.5	169.6	-73.8	-178.5	174	-175.5	0	110.5	K256	K254-K256 PolarHBondContact O-N 3.1Å
255	P	34.8	Very low	50.2	Low	126 Å²	126	102.1 Å²	102.1	82%	0.818	57%	0.57	S	S	*	*			trans	-72.3	115.2	179.3	-7.2	21.4	0	0	0	110.9
256	K	29.2	Very low	47.3	Very low	205 Å²	205	105.8 Å²	105.8	89%	0.891	60%	0.597	S	S	*	*			trans	-81.8	120.5	166.3	-75.1	178.4	177.5	174.3	0	109.1	K254	K254-K256 PolarHBondContact O-N 3.1Å
257	S	32	Very low	44.7	Very low	113 Å²	113	112.3 Å²	112.3	79%	0.79	62%	0.623	S	S	*	*			trans	-70.8	124.4	-177.3	56.8	0	0	0	0	113.6
258	T	30.6	Very low	42.1	Very low	143 Å²	143	117.3 Å²	117.3	88%	0.877	66%	0.656	S	S	*	*			trans	-148	109.8	151.2	13.9	0	0	0	0	108.8
259	I	32.8	Very low	39.5	Very low	166 Å²	166	126.3 Å²	126.3	85%	0.851	70%	0.698	S	S	*	*			trans	-98	137.6	177.7	-65	170.1	0	0	0	108.9
260	S	34.8	Very low	37.1	Very low	108 Å²	108	132.7 Å²	132.7	76%	0.755	73%	0.731	S	S	*	*			trans	-137	102.6	154.9	53.6	0	0	0	0	111
261	T	29	Very low	35.5	Very low	139 Å²	139	140.6 Å²	140.6	85%	0.853	77%	0.771	S	S	*	*			trans	43	119.5	143.2	59.8	0	0	0	0	121.8
262	G	28.5	Very low	33.9	Very low	62 Å²	62	143.6 Å²	143.6	64%	0.639	78%	0.782	S	S	*	*			trans	164.7	86.4	155.2	0	0	0	0	0	113.7
263	D	27.4	Very low	33.1	Very low	161 Å²	161	144.6 Å²	144.6	86%	0.861	80%	0.799	S	S	*	*			trans	49.9	69.6	158.6	-60.7	-17.8	0	0	0	119.5
264	F	34.1	Very low	32.8	Very low	206 Å²	206	145.7 Å²	145.7	90%	0.904	80%	0.804	S	S	*	*			trans	-141.5	140.7	160.4	-84.4	-83.1	0	0	0	112.3	S266	F264-S266 PolarHBondContact O-N 3.42Å
265	I	34	Very low	33.5	Very low	141 Å²	141	143.3 Å²	143.3	72%	0.723	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-51.1	124.8	-177.9	-64.3	162.1	0	0	0	110	Y267	I265-Y267 WeakPolarHBondContact O-CD2 3.3Å; I265-Y267 PolarHBondContact O-N 3.49Å
266	S	27.6	Very low	34.8	Very low	112 Å²	112	139.9 Å²	139.9	78%	0.783	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-65	118.1	176.7	54	0	0	0	0	110.9	F264	F264-S266 PolarHBondContact O-N 3.42Å
267	Y	35.2	Very low	37.1	Very low	136 Å²	136	134.8 Å²	134.8	53%	0.533	75%	0.748	S	S	.	*	P	Polyproline II helix	trans	-82.6	150.1	166.5	-65.2	-84.1	0	0	0	109.7	L32 I265 E269	L32-Y267 HydrophobicContact CD2-CE1 3.57Å; L32-Y267 WeakPolarHBondContact CD2-OH 3.49Å; I265-Y267 WeakPolarHBondContact O-CD2 3.3Å; I265-Y267 PolarHBondContact O-N 3.49Å; Y267-E269 PolarHBondContact O-N 3.36Å
268	P	34.7	Very low	39.7	Very low	113 Å²	113	129.7 Å²	129.7	73%	0.734	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-60	121.6	174.7	-13.8	27.4	0	0	0	109.6	D270	P268-D270 VanDerWaalsContact C-N 3.33Å; P268-D270 PolarHBondContact O-N 2.84Å
269	E	32	Very low	42.5	Very low	189 Å²	189	127.2 Å²	127.2	88%	0.883	69%	0.689	S	S	*	*	S	Bend	trans	-59.5	96.7	159.4	-70.3	176.3	160.2	0	0	107	Y267	Y267-E269 PolarHBondContact O-N 3.36Å
270	D	32.4	Very low	45.3	Very low	148 Å²	148	119.3 Å²	119.3	79%	0.791	65%	0.649	S	S	*	*			trans	179.1	69.2	163.6	-89.2	-26.5	0	0	0	110.6	P268	P268-D270 VanDerWaalsContact C-N 3.33Å; P268-D270 PolarHBondContact O-N 2.84Å
271	L	36.9	Very low	47.9	Very low	178 Å²	178	117.8 Å²	117.8	93%	0.932	63%	0.632	S	S	*	*	S	Bend	trans	-146.3	98.6	156.4	-96.5	160.5	0	0	0	107.6	A273	L271-A273 PolarHBondContact O-N 2.87Å
272	N	31.5	Very low	50.8	Low	126 Å²	126	111.2 Å²	111.2	67%	0.674	59%	0.592	S	S	*	*			trans	-52	123.8	-169.4	-73.7	-33.7	0	0	0	114.3	E274	N272-E274 PolarHBondContact O-N 2.82Å
273	A	33.5	Very low	53.6	Low	104 Å²	104	108.8 Å²	108.8	86%	0.86	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	30.2	173.6	0	0	0	0	0	115.2	L271	L271-A273 PolarHBondContact O-N 2.87Å
274	E	40.7	Very low	56.4	Low	181 Å²	181	101.1 Å²	101.1	85%	0.846	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.1	7.2	178.8	-76.1	-170.6	156.3	0	0	113.5	N272	N272-E274 PolarHBondContact O-N 2.82Å
275	K	51.4	Low	58.8	Low	152 Å²	152	92.4 Å²	92.4	66%	0.661	49%	0.485	S	S	*	.			trans	-119.9	17	-161.2	-91.4	-170.8	175.9	-173.3	0	118.5	V147	V147-K275 VanDerWaalsContact CG1-O 3.32Å; V147-K275 WeakPolarHBondContact CG1-O 3.31Å; V147-K275 WeakPolarHBondContact CG2-O 3.37Å
276	N	62.7	Low	61.1	Low	55 Å²	55	86 Å²	86	29%	0.294	45%	0.453	S	S	.	.			trans	-108.3	20.1	-179.5	-62.7	19.5	0	0	0	113.6	D144 S249 S250	D144-N276 PolarHBondContact OD2-ND2 2.78Å; S249-N276 WeakPolarHBondContact CA-O 3.49Å; S249-N276 WeakPolarHBondContact CB-O 3.39Å; S250-N276 PolarHBondContact OG-ND2 2.82Å
277	E	78.1	Confident	63.6	Low	97 Å²	97	82.7 Å²	82.7	45%	0.453	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	136.8	170.6	-69	-170.7	176.8	0	0	110.7	V247 A248 F279	V247-E277 HydrophobicContact CG1-CB 4.44Å; V247-E277 HydrophobicContact CG1-CG 4.49Å; A248-E277 CarbonylContact O-C 3.41Å; A248-E277 VanDerWaalsContact O-CA 3.32Å; A248-E277 WeakPolarHBondContact O-CA 3.21Å; E277-F279 HydrophobicContact CB-CE2 3.92Å; E277-F279 HydrophobicContact CB-CZ 3.7Å; E277-F279 VanDerWaalsContact OE2-CZ 3.31Å; E277-F279 WeakPolarHBondContact OE2-CZ 3.45Å
278	C	86.9	Confident	65.6	Low	7 Å²	7	77 Å²	77	5%	0.047	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	146.5	170.7	57.3	0	0	0	0	111.3	C148 F150 L178 V247 A248	C148-C278 VanDerWaalsContact C-SG 3.6Å; C148-C278 HydrophobicContact CB-CB 4.07Å; C148-C278 WeakPolarHBondContact CB-SG 3.31Å; C148-C278 WeakPolarHBondContact O-CB 3.47Å; C148-C278 WeakPolarHBondContact SG-CB 3.39Å; C148-C278 CovalentContact SG-SG 2.05Å; C148-C278 PolarHBondContact SG-SG 3.37Å; F150-C278 HydrophobicContact CE2-CB 4.47Å; L178-C278 VanDerWaalsContact CD1-SG 3.51Å; V247-C278 WeakPolarHBondContact CA-O 3.44Å; A248-C278 PolarHBondContact N-O 3.01Å; A248-C278 PolarHBondContact O-N 2.9Å
279	F	89.4	Confident	67.5	Low	91 Å²	91	74.2 Å²	74.2	40%	0.399	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	140.3	-169.6	-53.3	-91.4	0	0	0	110.5	N154 T245 I246 V247 E277	N154-F279 WeakPolarHBondContact CB-O 3.44Å; T245-F279 HydrophobicContact CG2-CB 4.16Å; T245-F279 HydrophobicContact CG2-CD1 4.14Å; I246-F279 CarbonylContact O-C 3.36Å; I246-F279 VanDerWaalsContact O-CA 3.31Å; I246-F279 WeakPolarHBondContact O-CA 3.46Å; V247-F279 HydrophobicContact CB-CD1 4.42Å; V247-F279 HydrophobicContact CG1-CD1 4.17Å; V247-F279 HydrophobicContact CG1-CE1 3.88Å; V247-F279 HydrophobicContact CG2-CD1 3.67Å; V247-F279 HydrophobicContact CG2-CE1 3.9Å; E277-F279 HydrophobicContact CB-CE2 3.92Å; E277-F279 HydrophobicContact CB-CZ 3.7Å; E277-F279 VanDerWaalsContact OE2-CZ 3.31Å; E277-F279 WeakPolarHBondContact OE2-CZ 3.45Å
280	L	90.9	Very high	69.6	Low	0 Å²	0	67.5 Å²	67.5	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	115.4	167.4	178.4	71.3	0	0	0	109.1	F150 A153 N154 Q156 I175 N176 T245 I246 V282	F150-L280 HydrophobicContact CB-CB 4.39Å; F150-L280 HydrophobicContact CB-CD1 4.1Å; F150-L280 HydrophobicContact CD1-CB 3.88Å; F150-L280 HydrophobicContact CD1-CD2 3.91Å; F150-L280 HydrophobicContact CD1-CG 4.34Å; F150-L280 HydrophobicContact CD2-CB 3.65Å; F150-L280 HydrophobicContact CE1-CB 3.96Å; F150-L280 HydrophobicContact CE1-CD2 4.11Å; F150-L280 HydrophobicContact CE2-CB 3.73Å; F150-L280 HydrophobicContact CG-CB 3.71Å; F150-L280 HydrophobicContact CG-CD1 4.28Å; F150-L280 HydrophobicContact CG-CD2 4.41Å; F150-L280 HydrophobicContact CG-CG 4.37Å; F150-L280 HydrophobicContact CZ-CB 3.88Å; A153-L280 VanDerWaalsContact O-CD1 3.29Å; A153-L280 WeakPolarHBondContact O-CD1 3.28Å; N154-L280 WeakPolarHBondContact O-CA 3.34Å; Q156-L280 HydrophobicContact CB-CD1 4.25Å; I175-L280 HydrophobicContact CG2-CD2 3.32Å; N176-L280 HydrophobicContact CB-CD1 4.07Å; N176-L280 HydrophobicContact CB-CD2 4.04Å; T245-L280 CarbonylContact C-O 3.51Å; T245-L280 VanDerWaalsContact CA-O 3.27Å; T245-L280 WeakPolarHBondContact CA-O 3.41Å; I246-L280 HydrophobicContact CB-CB 4.27Å; I246-L280 HydrophobicContact CD1-CD2 4.29Å; I246-L280 PolarHBondContact N-O 3.32Å; I246-L280 PolarHBondContact O-N 2.86Å; L280-V282 HydrophobicContact CD2-CG2 3.95Å; L280-V282 HydrophobicContact CG-CG2 3.95Å
281	N	90.2	Very high	71.6	Confident	76 Å²	76	64.9 Å²	64.9	41%	0.406	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	131	170.5	-68.3	-29.5	0	0	0	109.5	N154 E155 Q156 T245	N154-N281 PolarHBondContact O-N 3.11Å; E155-N281 CarbonylContact C-O 3.53Å; E155-N281 VanDerWaalsContact CA-O 3.28Å; E155-N281 WeakPolarHBondContact CA-O 3.38Å; E155-N281 HydrophobicContact CG-CB 4.4Å; Q156-N281 PolarHBondContact N-O 2.74Å; T245-N281 PolarHBondContact OG1-OD1 3.33Å
282	V	88.4	Confident	73.6	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.006	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	125.9	179.9	-179.8	0	0	0	0	108.7	Q156 I158 I175 L228 M244 I246 L280	Q156-V282 VanDerWaalsContact O-CA 3.3Å; Q156-V282 WeakPolarHBondContact O-CA 3.34Å; I158-V282 HydrophobicContact CD1-CG1 3.47Å; I158-V282 VanDerWaalsContact CD1-CG1 3.47Å; I158-V282 HydrophobicContact CG1-CG1 4.21Å; I175-V282 HydrophobicContact CD1-CG2 4.24Å; L228-V282 HydrophobicContact CD2-CG1 4.4Å; M244-V282 HydrophobicContact CG-CB 3.63Å; M244-V282 HydrophobicContact CG-CG1 4.06Å; M244-V282 PolarHBondContact N-O 3.47Å; M244-V282 PolarHBondContact O-N 2.57Å; M244-V282 HydrophobicContact SD-CB 4.39Å; M244-V282 HydrophobicContact SD-CG1 4.23Å; I246-V282 HydrophobicContact CD1-CG2 4.23Å; L280-V282 HydrophobicContact CD2-CG2 3.95Å; L280-V282 HydrophobicContact CG-CG2 3.95Å
283	I	88.5	Confident	76	Confident	11 Å²	11	56 Å²	56	6%	0.056	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	124.3	177.2	-53.2	173.1	0	0	0	108	Q156 E157 I158 E241 F242 H285	Q156-I283 PolarHBondContact O-N 3.03Å; E157-I283 CarbonylContact C-O 3.3Å; E157-I283 WeakPolarHBondContact CA-O 3.49Å; I158-I283 PolarHBondContact N-O 2.8Å; E241-I283 HydrophobicContact CG-CG2 3.64Å; F242-I283 CarbonylContact O-C 3.6Å; F242-I283 WeakPolarHBondContact O-CA 3.03Å; I283-H285 WeakPolarHBondContact CG2-NE2 3.2Å
284	V	85.7	Confident	78.6	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	115	175.1	-174.7	0	0	0	0	108.8	I158 V160 F210 L228 L234 E241 F242 M244	I158-V284 HydrophobicContact CB-CG2 4.22Å; I158-V284 HydrophobicContact CD1-CG2 4.41Å; I158-V284 HydrophobicContact CG2-CG1 4.48Å; I158-V284 CarbonylContact O-C 3.56Å; I158-V284 VanDerWaalsContact O-CA 3.27Å; I158-V284 WeakPolarHBondContact O-CA 3.47Å; V160-V284 HydrophobicContact CB-CG1 4.43Å; V160-V284 HydrophobicContact CG2-CG1 3.76Å; F210-V284 HydrophobicContact CE1-CG2 4.07Å; F210-V284 HydrophobicContact CZ-CB 4.48Å; F210-V284 HydrophobicContact CZ-CG2 4.28Å; L228-V284 HydrophobicContact CD2-CG2 4.14Å; L234-V284 HydrophobicContact CD1-CG1 4.45Å; E241-V284 CarbonylContact C-O 3.52Å; E241-V284 WeakPolarHBondContact CA-O 3.38Å; F242-V284 HydrophobicContact CB-CB 4.19Å; F242-V284 HydrophobicContact CD2-CB 4.42Å; F242-V284 PolarHBondContact N-O 2.88Å; F242-V284 PolarHBondContact O-N 3.33Å; M244-V284 HydrophobicContact CE-CG2 3.83Å
285	H	84.8	Confident	80.9	Confident	22 Å²	22	45.5 Å²	45.5	10%	0.102	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	126.4	175.6	-63.9	-73.8	0	0	0	110.4	E157 I158 Y159 V160 E241 I283	E157-H285 IonicContact OE2-NE2 3.27Å; I158-H285 PolarHBondContact O-N 3.04Å; Y159-H285 HydrophobicContact CD1-CB 3.68Å; Y159-H285 HydrophobicContact CE1-CB 3.77Å; Y159-H285 AromaticContact CE1-CD2 3.67Å; Y159-H285 AromaticContact CE1-CG 3.83Å; Y159-H285 HydrophobicContact CG-CB 4.46Å; Y159-H285 AromaticContact CZ-CD2 3.68Å; V160-H285 PolarHBondContact N-O 3.21Å; E241-H285 IonicContact OE2-CE1 3.46Å; E241-H285 IonicContact OE2-ND1 2.96Å; I283-H285 WeakPolarHBondContact CG2-NE2 3.2Å
286	V	82	Confident	82.8	Confident	8 Å²	8	38.8 Å²	38.8	5%	0.048	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	133	172.3	-171.5	0	0	0	0	108.9	V160 E162 L234 Y236 I239 Q240 F242	V160-V286 CarbonylContact O-C 3.5Å; V160-V286 WeakPolarHBondContact O-CA 3.35Å; E162-V286 HydrophobicContact CB-CG1 3.97Å; L234-V286 HydrophobicContact CB-CG1 4.16Å; L234-V286 HydrophobicContact CB-CG2 4.13Å; L234-V286 HydrophobicContact CD1-CG2 3.98Å; Y236-V286 HydrophobicContact CD2-CB 4.28Å; Y236-V286 HydrophobicContact CD2-CG1 4.26Å; Y236-V286 WeakPolarHBondContact CD2-O 3.16Å; I239-V286 VanDerWaalsContact O-CG2 3.28Å; I239-V286 WeakPolarHBondContact O-CG2 3.31Å; Q240-V286 PolarHBondContact O-N 3.1Å; F242-V286 HydrophobicContact CD2-CG2 4.24Å; F242-V286 HydrophobicContact CE2-CG2 3.75Å
287	I	79.4	Confident	84	Confident	42 Å²	42	41.1 Å²	41.1	22%	0.215	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	121.2	177.7	-60.4	171	0	0	0	108.7	Y159 V160 M161 E162	Y159-I287 HydrophobicContact CD1-CD1 4.36Å; V160-I287 PolarHBondContact O-N 3.13Å; M161-I287 HydrophobicContact CG-CB 4.24Å; M161-I287 HydrophobicContact CG-CD1 4.5Å; M161-I287 HydrophobicContact CG-CG2 4.39Å; E162-I287 PolarHBondContact N-O 2.58Å; E162-I287 VanDerWaalsContact N-O 3.08Å
288	D	77.2	Confident	84.4	Confident	15 Å²	15	42.2 Å²	42.2	8%	0.08	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-60	140.2	173.3	179.9	104.5	0	0	0	112.6	E162 Y236 A325 H329	E162-D288 VanDerWaalsContact OE1-CA 3.31Å; E162-D288 WeakPolarHBondContact OE1-CA 3.42Å; Y236-D288 HydrophobicContact CD1-CB 3.72Å; Y236-D288 VanDerWaalsContact CD1-OD1 3.27Å; Y236-D288 WeakPolarHBondContact CD1-OD1 3.38Å; Y236-D288 HydrophobicContact CD2-CB 3.8Å; Y236-D288 HydrophobicContact CE1-CB 3.99Å; Y236-D288 HydrophobicContact CE2-CB 4.01Å; Y236-D288 HydrophobicContact CG-CB 3.63Å; D288-A325 WeakPolarHBondContact OD1-CB 3.36Å; D288-A325 PolarHBondContact OD1-N 2.79Å; D288-H329 IonicContact OD2-CE1 2.75Å; D288-H329 IonicContact OD2-CG 2.58Å; D288-H329 IonicContact OD2-ND1 3.77Å; D288-H329 PolarHBondContact OD2-ND1 3.06Å
289	V	75.3	Confident	84.5	Confident	55 Å²	55	48 Å²	48	33%	0.333	25%	0.247	S	C	.	.			trans	-127.8	142.3	177.3	176.9	0	0	0	0	108.2	E162 D291	E162-V289 HydrophobicContact CG-CB 4.06Å; E162-V289 HydrophobicContact CG-CG2 3.95Å; E162-V289 PolarHBondContact OE1-N 3.3Å; V289-D291 VanDerWaalsContact C-N 3.33Å; V289-D291 PolarHBondContact O-N 3.12Å
290	N	75.2	Confident	84.6	Confident	48 Å²	48	48.5 Å²	48.5	26%	0.257	25%	0.253	S	S	.	.			trans	-71.9	77.4	-176.4	-169.9	103.7	0	0	0	112.9	D324 H329	N290-D324 VanDerWaalsContact CA-OD2 3.25Å; N290-D324 WeakPolarHBondContact CA-OD2 3.37Å; N290-D324 VanDerWaalsContact CG-OD2 3.29Å; N290-D324 PolarHBondContact OD1-OD2 3.16Å; N290-H329 HydrophobicContact CB-CB 4.28Å; N290-H329 WeakPolarHBondContact OD1-CB 3.33Å
291	D	75.1	Confident	84.7	Confident	94 Å²	94	49.6 Å²	49.6	50%	0.503	26%	0.26	S	S	.	.			trans	-106.6	-1	-177.5	78.5	-15.4	0	0	0	114.7	V289 D324	V289-D291 VanDerWaalsContact C-N 3.33Å; V289-D291 PolarHBondContact O-N 3.12Å; D291-D324 PolarHBondContact N-OD2 3.28Å
292	H	79	Confident	84.8	Confident	65 Å²	65	54 Å²	54	30%	0.301	27%	0.272	S	S	.	.	S	Bend	trans	-111.2	151.8	170	-60.9	79.7	0	0	0	113.8	L323 D324 L421	H292-L323 HydrophobicContact CB-CB 4.01Å; H292-D324 WeakPolarHBondContact CB-OD1 3.29Å; H292-D324 IonicContact CG-OD1 3.68Å; H292-D324 PolarHBondContact N-OD1 2.9Å; H292-D324 PolarHBondContact N-OD2 2.83Å; H292-D324 IonicContact ND1-OD1 3.25Å; H292-D324 PolarHBondContact ND1-OD1 3.36Å; H292-D324 VanDerWaalsContact ND1-OD1 3.09Å; H292-D324 VanDerWaalsContact O-OD2 3.11Å; H292-L421 WeakPolarHBondContact O-CD1 3.45Å
293	S	81.5	Confident	85	Confident	52 Å²	52	57 Å²	57	36%	0.364	29%	0.288	S	S	.	.			trans	-107	144.9	-174.6	-49.9	0	0	0	0	114.7	T295 L421	S293-T295 PolarHBondContact O-OG1 2.79Å; S293-L421 WeakPolarHBondContact OG-CB 3.25Å; S293-L421 WeakPolarHBondContact OG-CD1 3.36Å; S293-L421 VanDerWaalsContact OG-CD2 3.31Å; S293-L421 WeakPolarHBondContact OG-CD2 3.37Å; S293-L421 WeakPolarHBondContact OG-CG 3.39Å
294	P	88.6	Confident	85.1	Confident	2 Å²	2	60.6 Å²	60.6	1%	0.013	31%	0.314	C	S	.	.			trans	-60.1	138	168	-23.7	31.8	0	0	0	112.7	R321 D322 L332 V377 N379 D423	P294-R321 CarbonylContact C-O 3.5Å; P294-R321 WeakPolarHBondContact CA-O 3.21Å; P294-D322 WeakPolarHBondContact CD-OD2 3.39Å; P294-D322 WeakPolarHBondContact CG-OD2 3.29Å; P294-L332 HydrophobicContact CB-CD2 3.86Å; P294-L332 HydrophobicContact CG-CD2 4.24Å; P294-V377 HydrophobicContact CB-CG1 4.07Å; P294-V377 HydrophobicContact CB-CG2 4.29Å; P294-N379 WeakPolarHBondContact CD-OD1 3.3Å; P294-N379 WeakPolarHBondContact CG-OD1 3.08Å; P294-D423 WeakPolarHBondContact O-CB 3.49Å
295	T	87.8	Confident	85.4	Confident	63 Å²	63	61.7 Å²	61.7	39%	0.387	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	131.6	-178.1	-53.3	0	0	0	0	113.4	S293 A320 R321	S293-T295 PolarHBondContact O-OG1 2.79Å; T295-A320 CarbonylContact O-C 3.6Å; T295-A320 WeakPolarHBondContact O-CA 3.45Å; T295-A320 WeakPolarHBondContact O-CB 3.49Å; T295-R321 PolarHBondContact N-O 3.5Å; T295-R321 PolarHBondContact O-N 3.07Å
296	F	92.3	Very high	85.6	Confident	10 Å²	10	64.7 Å²	64.7	4%	0.044	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	148.1	174.6	-79.2	-70.6	0	0	0	113.3	P318 E319 A320 F334 I375 V377 D423 M425	F296-P318 HydrophobicContact CD1-CB 4.36Å; F296-P318 HydrophobicContact CE1-CB 3.93Å; F296-P318 HydrophobicContact CE1-CG 4.32Å; F296-E319 WeakPolarHBondContact CA-O 3.44Å; F296-A320 HydrophobicContact CD1-CB 4.08Å; F296-A320 HydrophobicContact CE1-CB 4.48Å; F296-F334 AromaticContact CE1-CD1 3.94Å; F296-F334 HydrophobicContact CE1-CD1 3.94Å; F296-F334 AromaticContact CE1-CE1 3.7Å; F296-F334 HydrophobicContact CE1-CE1 3.7Å; F296-F334 HydrophobicContact CZ-CD1 4.19Å; F296-F334 HydrophobicContact CZ-CE1 4.34Å; F296-I375 HydrophobicContact CZ-CG2 4.12Å; F296-V377 HydrophobicContact CD1-CG1 4.42Å; F296-V377 HydrophobicContact CD2-CB 4.49Å; F296-V377 HydrophobicContact CD2-CG1 3.69Å; F296-V377 HydrophobicContact CE1-CB 4.14Å; F296-V377 HydrophobicContact CE1-CG1 4.2Å; F296-V377 HydrophobicContact CE2-CB 3.8Å; F296-V377 HydrophobicContact CE2-CG1 3.44Å; F296-V377 VanDerWaalsContact CE2-CG1 3.44Å; F296-V377 HydrophobicContact CG-CG1 4.18Å; F296-V377 HydrophobicContact CZ-CB 3.58Å; F296-V377 HydrophobicContact CZ-CG1 3.7Å; F296-D423 HydrophobicContact CD2-CB 3.99Å; F296-D423 WeakPolarHBondContact CE2-O 3.3Å; F296-D423 PolarHBondContact N-OD2 2.8Å; F296-M425 HydrophobicContact CD1-SD 4.12Å; F296-M425 HydrophobicContact CD2-CB 4.39Å; F296-M425 HydrophobicContact CE1-CG 4.41Å; F296-M425 HydrophobicContact CE1-SD 4.05Å; F296-M425 HydrophobicContact CE2-CG 4.38Å; F296-M425 HydrophobicContact CZ-CG 4.3Å; F296-M425 HydrophobicContact CZ-SD 4.5Å
297	L	88.4	Confident	86	Confident	105 Å²	105	64.9 Å²	64.9	55%	0.55	34%	0.336	S	S	.	.	S	Bend	trans	-83.2	-25.1	176.4	-61.9	-177.3	0	0	0	114.3	E319	L297-E319 HydrophobicContact CB-CB 4.4Å; L297-E319 HydrophobicContact CD1-CB 3.8Å; L297-E319 WeakPolarHBondContact CD1-OE2 3.46Å; L297-E319 HydrophobicContact CG-CB 4.23Å; L297-E319 PolarHBondContact N-O 3.47Å
298	Q	86.8	Confident	86.4	Confident	120 Å²	120	67.6 Å²	67.6	56%	0.561	35%	0.351	S	S	*	.			trans	-136.2	144.4	178.5	-67.1	-175.7	-4.2	0	0	111.5	M425	Q298-M425 WeakPolarHBondContact O-CE 3.48Å
299	K	88	Confident	87.1	Confident	129 Å²	129	67.6 Å²	67.6	56%	0.561	35%	0.352	S	S	*	.			trans	-104.9	-27.6	-175.1	-65	-162.1	173.1	-161	0	116.7	M425 E426	K299-M425 WeakPolarHBondContact O-CA 3.43Å; K299-M425 WeakPolarHBondContact O-CB 3.36Å; K299-E426 PolarHBondContact O-N 3.15Å
300	N	92.1	Very high	87.8	Confident	100 Å²	100	72.7 Å²	72.7	54%	0.535	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	139.5	-173.7	-63.1	-33.7	0	0	0	114.4	E426	N300-E426 CarbonylContact C-O 3.09Å; N300-E426 VanDerWaalsContact CA-O 3.32Å; N300-E426 WeakPolarHBondContact CA-O 3.46Å
301	V	92.1	Very high	88.4	Confident	23 Å²	23	73.8 Å²	73.8	14%	0.139	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	150	-176.3	-175.7	0	0	0	0	114.3	Y316 M425 E426 L427 F428	V301-Y316 HydrophobicContact CG1-CD2 4.17Å; V301-Y316 HydrophobicContact CG1-CE2 3.89Å; V301-Y316 HydrophobicContact CG2-CE1 4.21Å; V301-Y316 HydrophobicContact CG2-CE2 4.1Å; V301-Y316 WeakPolarHBondContact CG2-OH 3.32Å; V301-M425 HydrophobicContact CG2-CE 4.1Å; V301-E426 PolarHBondContact N-O 3.34Å; V301-L427 HydrophobicContact CB-CD1 3.61Å; V301-L427 HydrophobicContact CG1-CD1 3.53Å; V301-L427 CarbonylContact O-C 3.54Å; V301-L427 WeakPolarHBondContact O-CA 3.13Å; V301-F428 WeakPolarHBondContact O-CD2 3.36Å; V301-F428 PolarHBondContact O-N 2.94Å
302	Y	92.2	Very high	89.1	Confident	169 Å²	169	74.3 Å²	74.3	66%	0.663	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.9	139.2	-175.2	-60.6	-97.6	0	0	0	115.4	F428	Y302-F428 CarbonylContact C-O 3.4Å; Y302-F428 WeakPolarHBondContact CA-O 3.48Å; Y302-F428 HydrophobicContact CD1-CB 3.57Å; Y302-F428 AromaticContact CD1-CD2 3.79Å; Y302-F428 HydrophobicContact CD1-CD2 3.79Å; Y302-F428 AromaticContact CD1-CG 3.83Å; Y302-F428 HydrophobicContact CD1-CG 3.83Å; Y302-F428 HydrophobicContact CE1-CB 4Å; Y302-F428 HydrophobicContact CE1-CD1 4.41Å; Y302-F428 AromaticContact CE1-CD2 3.49Å; Y302-F428 HydrophobicContact CE1-CD2 3.49Å; Y302-F428 VanDerWaalsContact CE1-CD2 3.49Å; Y302-F428 HydrophobicContact CE1-CE2 4.09Å; Y302-F428 AromaticContact CE1-CG 3.71Å; Y302-F428 HydrophobicContact CE1-CG 3.71Å; Y302-F428 HydrophobicContact CE2-CD2 4.36Å; Y302-F428 HydrophobicContact CG-CB 4.29Å; Y302-F428 HydrophobicContact CG-CD2 4.32Å; Y302-F428 AromaticContact CZ-CD2 3.8Å
303	L	92.7	Very high	89.7	Confident	65 Å²	65	77 Å²	77	34%	0.34	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	175.3	-172.7	-58.2	175.5	0	0	0	116.3	I315 L427 F428 I429 Q430	L303-I315 HydrophobicContact CD1-CG2 3.74Å; L303-L427 HydrophobicContact CD1-CD1 3.83Å; L303-L427 HydrophobicContact CD1-CD2 4.45Å; L303-L427 HydrophobicContact CG-CD1 4.15Å; L303-F428 PolarHBondContact N-O 2.92Å; L303-I429 HydrophobicContact CB-CG1 4.37Å; L303-I429 WeakPolarHBondContact O-CA 3.36Å; L303-Q430 PolarHBondContact O-N 2.75Å
304	S	91	Very high	90.3	Very high	86 Å²	86	79.1 Å²	79.1	60%	0.601	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.6	146	175.2	-54.4	0	0	0	0	114.4
305	I	91.6	Very high	90.5	Very high	22 Å²	22	80.4 Å²	80.4	11%	0.113	41%	0.407	C	S	.	.			trans	-147.7	147.5	-168.1	-55.7	-178.5	0	0	0	112.8	T309 I315 L363 I429 Q430 V431	I305-T309 HydrophobicContact CG2-CG2 3.97Å; I305-T309 WeakPolarHBondContact CG2-OG1 3.19Å; I305-I315 HydrophobicContact CD1-CD1 3.83Å; I305-L363 HydrophobicContact CB-CD1 4.37Å; I305-L363 HydrophobicContact CG2-CD1 4.02Å; I305-I429 HydrophobicContact CB-CG2 4.37Å; I305-I429 HydrophobicContact CD1-CD1 4.37Å; I305-I429 HydrophobicContact CD1-CG2 3.75Å; I305-I429 HydrophobicContact CG1-CG2 3.81Å; I305-Q430 PolarHBondContact N-O 3.4Å; I305-V431 WeakPolarHBondContact O-CA 3.4Å
306	L	90	Very high	90.8	Very high	85 Å²	85	79.5 Å²	79.5	45%	0.445	40%	0.397	S	S	.	.			trans	-81.2	148.9	173	-68.8	165.6	0	0	0	111.9	N308 T309 I432	L306-N308 VanDerWaalsContact C-N 3.26Å; L306-N308 WeakPolarHBondContact CB-OD1 3.18Å; L306-N308 PolarHBondContact O-N 2.91Å; L306-T309 PolarHBondContact N-OG1 2.7Å; L306-T309 WeakPolarHBondContact O-CB 3.44Å; L306-T309 PolarHBondContact O-N 3.18Å; L306-T309 VanDerWaalsContact O-N 3.12Å; L306-T309 PolarHBondContact O-OG1 3.38Å; L306-I432 HydrophobicContact CD2-CB 3.99Å; L306-I432 HydrophobicContact CD2-CD1 3.98Å; L306-I432 HydrophobicContact CD2-CG2 4.01Å
307	E	90.3	Very high	90.9	Very high	13 Å²	13	82 Å²	82	6%	0.061	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-34.6	-179.1	77.4	-179.9	150.4	0	0	113.3	T309 L363 Y365 V431 I432 D433 V434	E307-T309 VanDerWaalsContact C-N 3.28Å; E307-T309 PolarHBondContact O-N 3.36Å; E307-L363 CarbonylContact C-O 3.32Å; E307-L363 PolarHBondContact O-N 3.13Å; E307-L363 VanDerWaalsContact O-N 3.16Å; E307-Y365 WeakPolarHBondContact OE2-CB 3.48Å; E307-Y365 PolarHBondContact OE2-N 3.16Å; E307-V431 HydrophobicContact CB-CG1 3.92Å; E307-I432 WeakPolarHBondContact CB-O 3.46Å; E307-I432 WeakPolarHBondContact CG-O 2.91Å; E307-I432 PolarHBondContact N-O 2.85Å; E307-D433 WeakPolarHBondContact OE1-CA 3.16Å; E307-V434 HydrophobicContact CG-CG2 4.29Å; E307-V434 WeakPolarHBondContact OE1-CB 3.06Å; E307-V434 PolarHBondContact OE1-N 3.25Å
308	N	88.2	Confident	91.1	Very high	98 Å²	98	77.3 Å²	77.3	52%	0.524	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	19.6	178.5	68.8	-7.5	0	0	0	114.6	L306 E310	L306-N308 VanDerWaalsContact C-N 3.26Å; L306-N308 WeakPolarHBondContact CB-OD1 3.18Å; L306-N308 PolarHBondContact O-N 2.91Å; N308-E310 PolarHBondContact O-N 2.91Å
309	T	90.9	Very high	91.3	Very high	16 Å²	16	78.1 Å²	78.1	10%	0.098	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-64.2	131.9	177.9	-62.3	0	0	0	0	111.4	I305 L306 E307 K313 L359	I305-T309 HydrophobicContact CG2-CG2 3.97Å; I305-T309 WeakPolarHBondContact CG2-OG1 3.19Å; L306-T309 PolarHBondContact N-OG1 2.7Å; L306-T309 WeakPolarHBondContact O-CB 3.44Å; L306-T309 PolarHBondContact O-N 3.18Å; L306-T309 VanDerWaalsContact O-N 3.12Å; L306-T309 PolarHBondContact O-OG1 3.38Å; E307-T309 VanDerWaalsContact C-N 3.28Å; E307-T309 PolarHBondContact O-N 3.36Å; T309-K313 HydrophobicContact CG2-CD 3.71Å; T309-L359 HydrophobicContact CG2-CD2 4.05Å
310	E	89.8	Confident	91.4	Very high	162 Å²	162	73.1 Å²	73.1	76%	0.757	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-59.6	142.7	-178.6	-63.5	179.6	-179	0	0	113.6	N308	N308-E310 PolarHBondContact O-N 2.91Å
311	T	89	Confident	91.3	Very high	70 Å²	70	76.5 Å²	76.5	43%	0.429	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	154	174.2	56.3	0	0	0	0	112.3	K313 T362	T311-K313 VanDerWaalsContact C-N 3.3Å; T311-K313 PolarHBondContact O-N 3.18Å; T311-T362 HydrophobicContact CG2-CG2 4.32Å
312	N	89.2	Confident	91.1	Very high	105 Å²	105	76.9 Å²	76.9	56%	0.561	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	12.8	-176.9	-57.6	-38.8	0	0	0	116.1	L359	N312-L359 WeakPolarHBondContact CA-O 3.49Å; N312-L359 PolarHBondContact N-O 3.19Å
313	K	91.3	Very high	90.8	Very high	123 Å²	123	74.8 Å²	74.8	54%	0.535	38%	0.382	S	S	.	.			trans	-71.6	132.8	172.5	-168.3	170.2	-178.7	176.3	0	111	T309 T311 F358 L359	T309-K313 HydrophobicContact CG2-CD 3.71Å; T311-K313 VanDerWaalsContact C-N 3.3Å; T311-K313 PolarHBondContact O-N 3.18Å; K313-F358 WeakPolarHBondContact O-CA 3.42Å; K313-L359 PolarHBondContact O-N 3.44Å
314	L	93.3	Very high	90.2	Very high	96 Å²	96	71.9 Å²	71.9	50%	0.503	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	131.2	173.4	176.8	67.9	0	0	0	110.4	F358	L314-F358 HydrophobicContact CB-CD1 4.15Å; L314-F358 HydrophobicContact CB-CE1 3.9Å; L314-F358 HydrophobicContact CD1-CD1 4.27Å; L314-F358 HydrophobicContact CD1-CE1 3.83Å; L314-F358 HydrophobicContact CD1-CE2 4.29Å; L314-F358 HydrophobicContact CD1-CZ 3.84Å; L314-F358 HydrophobicContact CG-CE1 4.46Å
315	I	94	Very high	89.5	Confident	28 Å²	28	69.1 Å²	69.1	14%	0.144	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	-49.5	-178.3	-54.4	-57.8	0	0	0	111.9	L303 I305 F348 L357 L359 L427 I429	L303-I315 HydrophobicContact CD1-CG2 3.74Å; I305-I315 HydrophobicContact CD1-CD1 3.83Å; I315-F348 HydrophobicContact CG1-CD1 4.45Å; I315-F348 HydrophobicContact CG1-CE1 4.17Å; I315-L357 HydrophobicContact CB-CD2 4.34Å; I315-L357 HydrophobicContact CG2-CD2 4.26Å; I315-L357 PolarHBondContact N-O 3.24Å; I315-L359 HydrophobicContact CD1-CB 4.33Å; I315-L359 HydrophobicContact CG1-CB 4.45Å; I315-L427 HydrophobicContact CG2-CD2 4.44Å; I315-I429 HydrophobicContact CG2-CD1 4.31Å
316	Y	94.1	Very high	88.3	Confident	45 Å²	45	70 Å²	70	18%	0.176	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	163.1	-175.7	-173.4	-110.1	0	0	0	113.5	V301 P318 L357 M425	V301-Y316 HydrophobicContact CG1-CD2 4.17Å; V301-Y316 HydrophobicContact CG1-CE2 3.89Å; V301-Y316 HydrophobicContact CG2-CE1 4.21Å; V301-Y316 HydrophobicContact CG2-CE2 4.1Å; V301-Y316 WeakPolarHBondContact CG2-OH 3.32Å; Y316-P318 HydrophobicContact CE1-CB 4.29Å; Y316-L357 PolarHBondContact N-O 3.44Å; Y316-L357 PolarHBondContact O-N 2.97Å; Y316-M425 HydrophobicContact CE1-CE 3.97Å; Y316-M425 HydrophobicContact CE1-SD 4.42Å
317	T	94.1	Very high	87.1	Confident	62 Å²	62	71.2 Å²	71.2	38%	0.38	38%	0.376	S	S	.	.			trans	-145.2	123.7	175.3	-60.2	0	0	0	0	111.6	S356	T317-S356 PolarHBondContact OG1-OG 2.93Å
318	P	92.6	Very high	85.9	Confident	7 Å²	7	73.3 Å²	73.3	5%	0.045	39%	0.387	C	S	.	.			trans	-95.9	169.3	-176.9	39	-36.4	0	0	0	114.8	F296 Y316 F334 G355 M425	F296-P318 HydrophobicContact CD1-CB 4.36Å; F296-P318 HydrophobicContact CE1-CB 3.93Å; F296-P318 HydrophobicContact CE1-CG 4.32Å; Y316-P318 HydrophobicContact CE1-CB 4.29Å; P318-F334 HydrophobicContact CG-CD1 3.96Å; P318-F334 HydrophobicContact CG-CE1 4.03Å; P318-G355 VanDerWaalsContact CD-C 3.41Å; P318-G355 WeakPolarHBondContact CD-O 3.22Å; P318-M425 HydrophobicContact CB-SD 3.57Å; P318-M425 VanDerWaalsContact CB-SD 3.57Å
319	E	90.6	Very high	85	Confident	136 Å²	136	70.6 Å²	70.6	64%	0.636	37%	0.371	S	S	*	.			trans	-133.6	137	-178.7	-62.6	-179.4	175.2	0	0	113.1	F296 L297	F296-E319 WeakPolarHBondContact CA-O 3.44Å; L297-E319 HydrophobicContact CB-CB 4.4Å; L297-E319 HydrophobicContact CD1-CB 3.8Å; L297-E319 WeakPolarHBondContact CD1-OE2 3.46Å; L297-E319 HydrophobicContact CG-CB 4.23Å; L297-E319 PolarHBondContact N-O 3.47Å
320	A	91	Very high	84.2	Confident	24 Å²	24	72.7 Å²	72.7	20%	0.198	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	166.6	-177.2	0	0	0	0	0	115.1	T295 F296 L332 F334 V377	T295-A320 CarbonylContact O-C 3.6Å; T295-A320 WeakPolarHBondContact O-CA 3.45Å; T295-A320 WeakPolarHBondContact O-CB 3.49Å; F296-A320 HydrophobicContact CD1-CB 4.08Å; F296-A320 HydrophobicContact CE1-CB 4.48Å; A320-L332 HydrophobicContact CB-CD1 4.27Å; A320-L332 WeakPolarHBondContact O-CD1 3.22Å; A320-F334 HydrophobicContact CB-CE1 4.14Å; A320-F334 HydrophobicContact CB-CZ 4.21Å; A320-V377 HydrophobicContact CB-CB 4.47Å; A320-V377 HydrophobicContact CB-CG1 4.13Å; A320-V377 HydrophobicContact CB-CG2 4.06Å
321	R	89.3	Confident	83.8	Confident	171 Å²	171	69.4 Å²	69.4	65%	0.645	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.3	156.3	-179.7	68.6	178.9	-177.3	176.5	2.3	115.3	P294 T295	P294-R321 CarbonylContact C-O 3.5Å; P294-R321 WeakPolarHBondContact CA-O 3.21Å; T295-R321 PolarHBondContact N-O 3.5Å; T295-R321 PolarHBondContact O-N 3.07Å
322	D	87.7	Confident	83.8	Confident	31 Å²	31	68.1 Å²	68.1	17%	0.166	36%	0.362	C	S	.	.			trans	-140.1	153.3	173.9	-151.8	-39.8	0	0	0	111.9	P294 D324 L332 N379	P294-D322 WeakPolarHBondContact CD-OD2 3.39Å; P294-D322 WeakPolarHBondContact CG-OD2 3.29Å; D322-D324 PolarHBondContact OD1-N 2.99Å; D322-L332 HydrophobicContact CB-CD2 4.16Å; D322-N379 PolarHBondContact OD2-ND2 3.47Å
323	L	85.3	Confident	83.7	Confident	125 Å²	125	64.3 Å²	64.3	65%	0.654	34%	0.341	S	S	*	.			trans	-105.8	-19.6	-176.8	-68	179.8	0	0	0	115.1	H292	H292-L323 HydrophobicContact CB-CB 4.01Å
324	D	82	Confident	83.8	Confident	5 Å²	5	59 Å²	59	3%	0.027	32%	0.318	C	S	.	.			trans	-66.2	156.9	-179.3	-61.8	-23.6	0	0	0	112.1	N290 D291 H292 D322 H329 S330	N290-D324 VanDerWaalsContact CA-OD2 3.25Å; N290-D324 WeakPolarHBondContact CA-OD2 3.37Å; N290-D324 VanDerWaalsContact CG-OD2 3.29Å; N290-D324 PolarHBondContact OD1-OD2 3.16Å; D291-D324 PolarHBondContact N-OD2 3.28Å; H292-D324 WeakPolarHBondContact CB-OD1 3.29Å; H292-D324 IonicContact CG-OD1 3.68Å; H292-D324 PolarHBondContact N-OD1 2.9Å; H292-D324 PolarHBondContact N-OD2 2.83Å; H292-D324 IonicContact ND1-OD1 3.25Å; H292-D324 PolarHBondContact ND1-OD1 3.36Å; H292-D324 VanDerWaalsContact ND1-OD1 3.09Å; H292-D324 VanDerWaalsContact O-OD2 3.11Å; D322-D324 PolarHBondContact OD1-N 2.99Å; D324-H329 HydrophobicContact CB-CB 3.56Å; D324-S330 WeakPolarHBondContact O-CB 3.25Å
325	A	74.3	Confident	83.8	Confident	27 Å²	27	56.8 Å²	56.8	22%	0.223	31%	0.305	C	S	.	.			trans	-101.6	162.6	-176.3	0	0	0	0	0	115	Y236 D288	Y236-A325 HydrophobicContact CD1-CB 4.13Å; Y236-A325 HydrophobicContact CE1-CB 3.32Å; D288-A325 WeakPolarHBondContact OD1-CB 3.36Å; D288-A325 PolarHBondContact OD1-N 2.79Å
326	G	67	Low	83.7	Confident	40 Å²	40	57.1 Å²	57.1	41%	0.412	31%	0.307	S	S	.	.	H	α-helix	trans	90	170.3	174.8	0	0	0	0	0	114.4	I328 S330	G326-I328 PolarHBondContact O-N 2.77Å; G326-S330 WeakPolarHBondContact O-CB 3.1Å; G326-S330 PolarHBondContact O-N 2.89Å; G326-S330 PolarHBondContact O-OG 3Å
327	P	65	Low	83.5	Confident	112 Å²	112	55.2 Å²	55.2	73%	0.727	30%	0.3	S	S	*	.	H	α-helix	trans	-70.3	-15.1	-168.8	27.8	-34.7	0	0	0	114.1	Q331	P327-Q331 PolarHBondContact O-OE1 3.18Å
328	I	65.5	Low	83.1	Confident	57 Å²	57	61 Å²	61	29%	0.292	32%	0.32	S	S	.	.	H	α-helix	trans	-105	-56.4	-175.3	-64	158.6	0	0	0	109.9	G326 S330 Q331 P380 I385	G326-I328 PolarHBondContact O-N 2.77Å; I328-S330 VanDerWaalsContact C-N 3.34Å; I328-S330 PolarHBondContact O-N 3.14Å; I328-Q331 PolarHBondContact O-N 3.18Å; I328-P380 WeakPolarHBondContact O-CD 3.22Å; I328-I385 HydrophobicContact CD1-CD1 3.99Å; I328-I385 HydrophobicContact CD1-CG1 4.37Å; I328-I385 HydrophobicContact CD1-CG2 3.92Å; I328-I385 HydrophobicContact CG1-CD1 4.23Å; I328-I385 HydrophobicContact CG1-CG1 4.3Å; I328-I385 HydrophobicContact CG1-CG2 4.38Å; I328-I385 HydrophobicContact CG2-CD1 3.55Å; I328-I385 HydrophobicContact CG2-CG1 4.06Å
329	H	69.3	Low	82.8	Confident	41 Å²	41	67.6 Å²	67.6	19%	0.19	34%	0.344	C	S	.	.	H	α-helix	trans	-69	-31.3	-174.3	-50.5	158	0	0	0	112.2	D288 N290 D324 Q331 N379	D288-H329 IonicContact OD2-CE1 2.75Å; D288-H329 IonicContact OD2-CG 2.58Å; D288-H329 IonicContact OD2-ND1 3.77Å; D288-H329 PolarHBondContact OD2-ND1 3.06Å; N290-H329 HydrophobicContact CB-CB 4.28Å; N290-H329 WeakPolarHBondContact OD1-CB 3.33Å; D324-H329 HydrophobicContact CB-CB 3.56Å; H329-Q331 VanDerWaalsContact C-N 3.33Å; H329-Q331 PolarHBondContact O-N 2.73Å; H329-N379 PolarHBondContact O-ND2 3.24Å
330	S	74.9	Confident	82.8	Confident	60 Å²	60	61.9 Å²	61.9	42%	0.42	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	3.4	178.1	94.1	0	0	0	0	115.1	D324 G326 I328	D324-S330 WeakPolarHBondContact O-CB 3.25Å; G326-S330 WeakPolarHBondContact O-CB 3.1Å; G326-S330 PolarHBondContact O-N 2.89Å; G326-S330 PolarHBondContact O-OG 3Å; I328-S330 VanDerWaalsContact C-N 3.34Å; I328-S330 PolarHBondContact O-N 3.14Å
331	Q	80.7	Confident	82.7	Confident	93 Å²	93	63 Å²	63	44%	0.435	32%	0.324	S	S	.	.			trans	-89.6	130.9	-171.8	-178.1	178.8	-5.6	0	0	112	P327 I328 H329 P380	P327-Q331 PolarHBondContact O-OE1 3.18Å; I328-Q331 PolarHBondContact O-N 3.18Å; H329-Q331 VanDerWaalsContact C-N 3.33Å; H329-Q331 PolarHBondContact O-N 2.73Å; Q331-P380 HydrophobicContact CB-CG 3.68Å; Q331-P380 HydrophobicContact CG-CG 3.87Å; Q331-P380 WeakPolarHBondContact O-CD 3.39Å
332	L	87.8	Confident	82.7	Confident	43 Å²	43	60.2 Å²	60.2	23%	0.225	33%	0.328	C	S	.	.			trans	-99.8	129.8	178.1	-59.3	176.4	0	0	0	111.7	P294 A320 D322 F334 V377	P294-L332 HydrophobicContact CB-CD2 3.86Å; P294-L332 HydrophobicContact CG-CD2 4.24Å; A320-L332 HydrophobicContact CB-CD1 4.27Å; A320-L332 WeakPolarHBondContact O-CD1 3.22Å; D322-L332 HydrophobicContact CB-CD2 4.16Å; L332-F334 HydrophobicContact CB-CE2 4.42Å; L332-V377 HydrophobicContact CB-CG2 4.24Å; L332-V377 HydrophobicContact CD2-CG2 4.12Å
333	I	88.8	Confident	82.8	Confident	24 Å²	24	59.5 Å²	59.5	12%	0.123	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	122.5	174	-60.1	-179.1	0	0	0	109.7	P352 V377 R378 P380	I333-P352 HydrophobicContact CG2-CB 4.4Å; I333-V377 WeakPolarHBondContact O-CA 3.38Å; I333-R378 HydrophobicContact CB-CG 4.33Å; I333-R378 PolarHBondContact N-O 3.05Å; I333-R378 PolarHBondContact O-N 2.81Å; I333-R378 VanDerWaalsContact O-N 3.09Å; I333-P380 HydrophobicContact CD1-CB 4.02Å; I333-P380 HydrophobicContact CD1-CG 4.08Å
334	F	93.2	Very high	83.1	Confident	13 Å²	13	53.7 Å²	53.7	6%	0.057	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	137.1	176.6	-60.8	-89.3	0	0	0	111.6	F296 P318 A320 L332 I350 P352 T376 V377	F296-F334 AromaticContact CE1-CD1 3.94Å; F296-F334 HydrophobicContact CE1-CD1 3.94Å; F296-F334 AromaticContact CE1-CE1 3.7Å; F296-F334 HydrophobicContact CE1-CE1 3.7Å; F296-F334 HydrophobicContact CZ-CD1 4.19Å; F296-F334 HydrophobicContact CZ-CE1 4.34Å; P318-F334 HydrophobicContact CG-CD1 3.96Å; P318-F334 HydrophobicContact CG-CE1 4.03Å; A320-F334 HydrophobicContact CB-CE1 4.14Å; A320-F334 HydrophobicContact CB-CZ 4.21Å; L332-F334 HydrophobicContact CB-CE2 4.42Å; F334-I350 HydrophobicContact CB-CD1 4.25Å; F334-P352 PolarHBondContact N-O 2.92Å; F334-P352 WeakPolarHBondContact O-CA 2.93Å; F334-T376 WeakPolarHBondContact CA-O 3.21Å; F334-V377 HydrophobicContact CD1-CB 4.22Å; F334-V377 HydrophobicContact CD1-CG2 4.18Å; F334-V377 HydrophobicContact CE1-CB 4.27Å; F334-V377 HydrophobicContact CE1-CG2 4.01Å; F334-V377 HydrophobicContact CZ-CG2 4.36Å
335	E	92.3	Very high	83.5	Confident	48 Å²	48	56.4 Å²	56.4	22%	0.224	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	153.8	179.4	60.3	-176.5	-152.1	0	0	112.5	S337 I375 T376 R378	E335-S337 PolarHBondContact O-N 3.43Å; E335-I375 WeakPolarHBondContact O-CA 3.31Å; E335-T376 PolarHBondContact N-O 2.92Å; E335-T376 PolarHBondContact O-N 3Å; E335-R378 IonicContact OE1-NE 3.24Å; E335-R378 IonicContact OE2-CZ 3.59Å; E335-R378 IonicContact OE2-NE 2.82Å; E335-R378 PolarHBondContact OE2-NE 2.63Å; E335-R378 IonicContact OE2-NH2 3.05Å
336	L	92.6	Very high	84.3	Confident	36 Å²	36	57.1 Å²	57.1	19%	0.188	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	127.4	165.2	-74.9	175.2	0	0	0	107.6	F338 I350 L357 I373	L336-F338 PolarHBondContact O-N 2.83Å; L336-I350 HydrophobicContact CG-CB 4.26Å; L336-I350 HydrophobicContact CG-CG2 3.99Å; L336-L357 HydrophobicContact CD2-CD1 3.87Å; L336-I373 HydrophobicContact CD2-CG2 3.84Å
337	S	89.5	Confident	85.5	Confident	4 Å²	4	55.9 Å²	55.9	3%	0.028	30%	0.299	C	S	.	.			trans	-58.8	138.4	179.8	-170.8	0	0	0	0	110.8	E335 R339 N340 L374 T376	E335-S337 PolarHBondContact O-N 3.43Å; S337-R339 PolarHBondContact O-N 2.75Å; S337-R339 PolarHBondContact OG-N 2.72Å; S337-N340 PolarHBondContact N-ND2 2.79Å; S337-N340 WeakPolarHBondContact O-CB 3.43Å; S337-N340 PolarHBondContact O-N 2.87Å; S337-N340 PolarHBondContact O-ND2 2.78Å; S337-N340 VanDerWaalsContact O-ND2 3.09Å; S337-L374 PolarHBondContact N-O 2.71Å; S337-T376 WeakPolarHBondContact CA-OG1 3.18Å
338	F	85.9	Confident	86.9	Confident	183 Å²	183	50.7 Å²	50.7	80%	0.803	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-15	171.9	71	-90.6	0	0	0	113.1	L336 N340	L336-F338 PolarHBondContact O-N 2.83Å; F338-N340 VanDerWaalsContact C-N 3.3Å
339	R	86.9	Confident	88.3	Confident	146 Å²	146	52 Å²	52	55%	0.551	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-7.3	176.5	-62.9	-168.8	-70.4	-165.5	-2.3	113.9	S337 L374	S337-R339 PolarHBondContact O-N 2.75Å; S337-R339 PolarHBondContact OG-N 2.72Å; R339-L374 HydrophobicContact CB-CD1 3.77Å
340	N	90.4	Very high	89.5	Confident	17 Å²	17	51.3 Å²	51.3	9%	0.091	26%	0.264	C	S	.	.	S	Bend	trans	-69.7	152.8	175.8	-75.5	-46.5	0	0	0	112.2	S337 F338 I344 L374	S337-N340 PolarHBondContact N-ND2 2.79Å; S337-N340 WeakPolarHBondContact O-CB 3.43Å; S337-N340 PolarHBondContact O-N 2.87Å; S337-N340 PolarHBondContact O-ND2 2.78Å; S337-N340 VanDerWaalsContact O-ND2 3.09Å; F338-N340 VanDerWaalsContact C-N 3.3Å; N340-I344 HydrophobicContact CB-CB 4.19Å; N340-I344 HydrophobicContact CB-CG2 4.11Å; N340-L374 PolarHBondContact ND2-O 3.1Å; N340-L374 PolarHBondContact OD1-N 2.56Å
341	S	88.4	Confident	90.3	Very high	47 Å²	47	50.9 Å²	50.9	33%	0.329	26%	0.257	S	S	.	.			trans	-68.4	156.2	175.7	78.5	0	0	0	0	111.7	Y343 I344 S345	S341-Y343 PolarHBondContact O-N 3.18Å; S341-I344 PolarHBondContact O-N 3.3Å; S341-I344 VanDerWaalsContact O-N 3.07Å; S341-I344 PolarHBondContact OG-N 2.92Å; S341-S345 PolarHBondContact O-N 2.82Å; S341-S345 PolarHBondContact O-OG 3.46Å
342	P	88.9	Confident	90.8	Very high	112 Å²	112	49.8 Å²	49.8	73%	0.727	26%	0.258	S	S	*	.	H	α-helix	trans	-56.1	-35.2	174.1	-26.4	35.2	0	0	0	112.9	I344 S345 S346	P342-I344 PolarHBondContact O-N 2.73Å; P342-S345 PolarHBondContact O-N 3.17Å; P342-S346 PolarHBondContact O-N 2.65Å; P342-S346 PolarHBondContact O-OG 3.46Å
343	Y	90.8	Very high	90.7	Very high	16 Å²	16	55.7 Å²	55.7	6%	0.063	29%	0.285	C	S	.	.	H	α-helix	trans	-59.5	-43.9	175.4	-172.2	-84	0	0	0	111.7	S341 S345 S346 H347 L363 E367 M368 L371	S341-Y343 PolarHBondContact O-N 3.18Å; Y343-S345 VanDerWaalsContact C-N 3.34Å; Y343-S345 PolarHBondContact O-N 3.1Å; Y343-S346 PolarHBondContact O-N 3.47Å; Y343-S346 PolarHBondContact O-OG 2.95Å; Y343-H347 AromaticContact CD1-ND1 3.63Å; Y343-H347 AromaticContact CD2-CE1 3.5Å; Y343-H347 AromaticContact CD2-ND1 3.79Å; Y343-H347 AromaticContact CE1-CE1 3.81Å; Y343-H347 AromaticContact CE1-CG 3.91Å; Y343-H347 AromaticContact CE1-ND1 3.58Å; Y343-H347 AromaticContact CE2-CE1 3.18Å; Y343-H347 WeakPolarHBondContact CE2-CE1 3.33Å; Y343-H347 AromaticContact CE2-ND1 3.74Å; Y343-H347 AromaticContact CE2-NE2 3.79Å; Y343-H347 AromaticContact CG-CE1 3.94Å; Y343-H347 AromaticContact CG-ND1 3.73Å; Y343-H347 AromaticContact CZ-CE1 3.36Å; Y343-H347 AromaticContact CZ-ND1 3.64Å; Y343-H347 AromaticContact CZ-NE2 3.66Å; Y343-H347 WeakPolarHBondContact O-CB 3.39Å; Y343-H347 PolarHBondContact O-N 3.09Å; Y343-H347 VanDerWaalsContact O-N 3.09Å; Y343-H347 PolarHBondContact O-ND1 2.79Å; Y343-L363 HydrophobicContact CE1-CD2 4.34Å; Y343-E367 HydrophobicContact CE2-CG 4.16Å; Y343-M368 HydrophobicContact CD1-CB 4.49Å; Y343-M368 HydrophobicContact CD1-CE 4.28Å; Y343-M368 HydrophobicContact CD1-CG 4.25Å; Y343-M368 HydrophobicContact CD1-SD 3.52Å; Y343-M368 VanDerWaalsContact CD1-SD 3.52Å; Y343-M368 HydrophobicContact CD2-CE 4.21Å; Y343-M368 HydrophobicContact CD2-CG 4.12Å; Y343-M368 HydrophobicContact CD2-SD 4.14Å; Y343-M368 HydrophobicContact CE1-CB 3.96Å; Y343-M368 HydrophobicContact CE1-CG 4.19Å; Y343-M368 HydrophobicContact CE1-SD 3.95Å; Y343-M368 HydrophobicContact CE2-CB 4.17Å; Y343-M368 HydrophobicContact CE2-CG 4.05Å; Y343-M368 HydrophobicContact CE2-SD 4.5Å; Y343-M368 HydrophobicContact CG-CE 3.8Å; Y343-M368 HydrophobicContact CG-CG 4.22Å; Y343-M368 HydrophobicContact CG-SD 3.64Å; Y343-L371 HydrophobicContact CD1-CD2 3.68Å; Y343-L371 HydrophobicContact CE1-CD2 3.46Å; Y343-L371 VanDerWaalsContact CE1-CD2 3.46Å
344	I	92.1	Very high	90.8	Very high	3 Å²	3	58.1 Å²	58.1	2%	0.015	30%	0.298	C	S	.	.	H	α-helix	trans	-63.7	-42.3	175.8	-62.6	-51.9	0	0	0	111	N340 S341 P342 S346 H347 F348 L371 I373	N340-I344 HydrophobicContact CB-CB 4.19Å; N340-I344 HydrophobicContact CB-CG2 4.11Å; S341-I344 PolarHBondContact O-N 3.3Å; S341-I344 VanDerWaalsContact O-N 3.07Å; S341-I344 PolarHBondContact OG-N 2.92Å; P342-I344 PolarHBondContact O-N 2.73Å; I344-S346 VanDerWaalsContact C-N 3.28Å; I344-S346 PolarHBondContact O-N 3.25Å; I344-H347 PolarHBondContact O-N 3.33Å; I344-F348 HydrophobicContact CD1-CD2 4.34Å; I344-F348 HydrophobicContact CD1-CE2 4.14Å; I344-F348 HydrophobicContact CG2-CD2 4.15Å; I344-F348 PolarHBondContact O-N 3.43Å; I344-L371 HydrophobicContact CD1-CB 4.05Å; I344-L371 HydrophobicContact CD1-CD2 3.83Å; I344-L371 HydrophobicContact CD1-CG 4.46Å; I344-I373 HydrophobicContact CD1-CD1 4.33Å; I344-I373 HydrophobicContact CD1-CG1 3.84Å; I344-I373 HydrophobicContact CG1-CG1 4.29Å; I344-I373 HydrophobicContact CG2-CB 4.37Å; I344-I373 HydrophobicContact CG2-CD1 4.27Å; I344-I373 HydrophobicContact CG2-CG1 3.87Å; I344-I373 HydrophobicContact CG2-CG2 3.99Å
345	S	88.6	Confident	90.6	Very high	62 Å²	62	57.5 Å²	57.5	43%	0.434	30%	0.295	S	S	.	.	H	α-helix	trans	-68.8	-25	-178.7	-55.8	0	0	0	0	113.3	S341 P342 Y343	S341-S345 PolarHBondContact O-N 2.82Å; S341-S345 PolarHBondContact O-OG 3.46Å; P342-S345 PolarHBondContact O-N 3.17Å; Y343-S345 VanDerWaalsContact C-N 3.34Å; Y343-S345 PolarHBondContact O-N 3.1Å
346	S	90.9	Very high	90.7	Very high	42 Å²	42	55.8 Å²	55.8	29%	0.294	29%	0.289	S	S	.	.	H	α-helix	trans	-83.7	-31.4	174.3	64.1	0	0	0	0	113	P342 Y343 I344 K360 Q361	P342-S346 PolarHBondContact O-N 2.65Å; P342-S346 PolarHBondContact O-OG 3.46Å; Y343-S346 PolarHBondContact O-N 3.47Å; Y343-S346 PolarHBondContact O-OG 2.95Å; I344-S346 VanDerWaalsContact C-N 3.28Å; I344-S346 PolarHBondContact O-N 3.25Å; S346-K360 WeakPolarHBondContact O-CD 3.36Å; S346-Q361 PolarHBondContact O-OE1 2.77Å
347	H	93.3	Very high	90.8	Very high	14 Å²	14	54 Å²	54	7%	0.065	28%	0.28	C	S	.	.	H	α-helix	trans	-97.4	-15	-174.4	-66.8	83.3	0	0	0	114.8	Y343 I344 K360 T362 L363	Y343-H347 AromaticContact CD1-ND1 3.63Å; Y343-H347 AromaticContact CD2-CE1 3.5Å; Y343-H347 AromaticContact CD2-ND1 3.79Å; Y343-H347 AromaticContact CE1-CE1 3.81Å; Y343-H347 AromaticContact CE1-CG 3.91Å; Y343-H347 AromaticContact CE1-ND1 3.58Å; Y343-H347 AromaticContact CE2-CE1 3.18Å; Y343-H347 WeakPolarHBondContact CE2-CE1 3.33Å; Y343-H347 AromaticContact CE2-ND1 3.74Å; Y343-H347 AromaticContact CE2-NE2 3.79Å; Y343-H347 AromaticContact CG-CE1 3.94Å; Y343-H347 AromaticContact CG-ND1 3.73Å; Y343-H347 AromaticContact CZ-CE1 3.36Å; Y343-H347 AromaticContact CZ-ND1 3.64Å; Y343-H347 AromaticContact CZ-NE2 3.66Å; Y343-H347 WeakPolarHBondContact O-CB 3.39Å; Y343-H347 PolarHBondContact O-N 3.09Å; Y343-H347 VanDerWaalsContact O-N 3.09Å; Y343-H347 PolarHBondContact O-ND1 2.79Å; I344-H347 PolarHBondContact O-N 3.33Å; H347-K360 WeakPolarHBondContact O-CB 3.48Å; H347-K360 PolarHBondContact O-N 3.4Å; H347-T362 PolarHBondContact CD2-O 3.38Å; H347-T362 VanDerWaalsContact CD2-O 3.32Å; H347-L363 HydrophobicContact CB-CD2 4.45Å
348	F	95.1	Very high	91.1	Very high	3 Å²	3	56 Å²	56	1%	0.013	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	154.7	-178.8	-61.2	-91.2	0	0	0	112.7	I315 I344 L357 F358 L359 L371 I373 I429	I315-F348 HydrophobicContact CG1-CD1 4.45Å; I315-F348 HydrophobicContact CG1-CE1 4.17Å; I344-F348 HydrophobicContact CD1-CD2 4.34Å; I344-F348 HydrophobicContact CD1-CE2 4.14Å; I344-F348 HydrophobicContact CG2-CD2 4.15Å; I344-F348 PolarHBondContact O-N 3.43Å; F348-L357 HydrophobicContact CB-CD1 4.11Å; F348-L357 HydrophobicContact CD1-CD2 4.41Å; F348-L357 HydrophobicContact CD1-CG 4.39Å; F348-F358 VanDerWaalsContact CA-O 3.32Å; F348-F358 WeakPolarHBondContact CA-O 3.32Å; F348-L359 HydrophobicContact CD1-CD1 4.37Å; F348-L359 HydrophobicContact CE1-CD1 3.86Å; F348-L359 HydrophobicContact CZ-CD1 4.01Å; F348-L371 HydrophobicContact CE2-CD1 4.21Å; F348-L371 HydrophobicContact CZ-CD1 4.15Å; F348-I373 HydrophobicContact CD1-CD1 4.05Å; F348-I373 HydrophobicContact CD2-CD1 3.83Å; F348-I373 HydrophobicContact CE1-CD1 4Å; F348-I373 HydrophobicContact CE2-CD1 3.78Å; F348-I373 HydrophobicContact CG-CD1 3.97Å; F348-I373 HydrophobicContact CZ-CD1 3.87Å; F348-I429 HydrophobicContact CE1-CD1 4.21Å; F348-I429 HydrophobicContact CZ-CD1 4.03Å
349	Y	94.1	Very high	91.5	Very high	85 Å²	85	47.3 Å²	47.3	33%	0.333	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	152.8	167.8	70.4	-91.1	0	0	0	111.2	L357 F358 K360	Y349-L357 WeakPolarHBondContact O-CA 3.37Å; Y349-F358 HydrophobicContact CD1-CB 3.95Å; Y349-F358 HydrophobicContact CD2-CB 4.22Å; Y349-F358 HydrophobicContact CD2-CD2 4.15Å; Y349-F358 HydrophobicContact CE1-CB 3.4Å; Y349-F358 VanDerWaalsContact CE1-CB 3.4Å; Y349-F358 HydrophobicContact CE1-CG 4.26Å; Y349-F358 HydrophobicContact CE2-CB 3.69Å; Y349-F358 AromaticContact CE2-CD2 3.48Å; Y349-F358 HydrophobicContact CE2-CD2 3.48Å; Y349-F358 VanDerWaalsContact CE2-CD2 3.48Å; Y349-F358 HydrophobicContact CE2-CE2 4.32Å; Y349-F358 AromaticContact CE2-CG 3.77Å; Y349-F358 HydrophobicContact CE2-CG 3.77Å; Y349-F358 HydrophobicContact CG-CB 4.33Å; Y349-F358 AromaticContact CZ-CD2 3.83Å; Y349-F358 AromaticContact CZ-CG 3.59Å; Y349-F358 PolarHBondContact N-O 3Å; Y349-F358 PolarHBondContact O-N 3.01Å; Y349-F358 WeakPolarHBondContact OH-CB 3.35Å; Y349-F358 WeakPolarHBondContact OH-CG 3.26Å; Y349-K360 HydrophobicContact CD1-CB 4.01Å; Y349-K360 HydrophobicContact CD1-CG 4.28Å
350	I	94.5	Very high	91.7	Very high	26 Å²	26	45.5 Å²	45.5	13%	0.133	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	142.2	-179.4	-163	170.6	0	0	0	110.7	F334 L336 G355 S356 L357 I375	F334-I350 HydrophobicContact CB-CD1 4.25Å; L336-I350 HydrophobicContact CG-CB 4.26Å; L336-I350 HydrophobicContact CG-CG2 3.99Å; I350-G355 WeakPolarHBondContact CD1-O 3.4Å; I350-G355 WeakPolarHBondContact CG1-O 3.37Å; I350-S356 CarbonylContact C-O 3.57Å; I350-S356 WeakPolarHBondContact CA-O 3.46Å; I350-L357 HydrophobicContact CB-CD1 4.33Å; I350-I375 HydrophobicContact CD1-CD1 4.2Å; I350-I375 HydrophobicContact CD1-CG1 4.28Å; I350-I375 HydrophobicContact CD1-CG2 3.57Å
351	N	92.3	Very high	91.7	Very high	51 Å²	51	49.1 Å²	49.1	27%	0.273	26%	0.262	S	S	.	.			trans	-80.9	120.2	172	178.1	-20.3	0	0	0	110	Q353 N354 G355 S356	N351-Q353 VanDerWaalsContact C-N 3.28Å; N351-Q353 PolarHBondContact O-N 3.03Å; N351-Q353 PolarHBondContact OD1-N 2.78Å; N351-N354 WeakPolarHBondContact CB-OD1 3.33Å; N351-N354 PolarHBondContact ND2-OD1 3.47Å; N351-G355 VanDerWaalsContact O-CA 3.26Å; N351-G355 WeakPolarHBondContact O-CA 3.46Å; N351-G355 PolarHBondContact O-N 2.87Å; N351-S356 PolarHBondContact N-O 2.99Å
352	P	90.5	Very high	91.7	Very high	70 Å²	70	50.7 Å²	50.7	46%	0.455	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-18.7	-173.3	27.5	-35	0	0	0	115	I333 F334	I333-P352 HydrophobicContact CG2-CB 4.4Å; F334-P352 PolarHBondContact N-O 2.92Å; F334-P352 WeakPolarHBondContact O-CA 2.93Å
353	Q	86.5	Confident	91.7	Very high	168 Å²	168	45.8 Å²	45.8	79%	0.785	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	-29.7	-176.8	-65.7	-179.3	-16.6	0	0	113.4	N351	N351-Q353 VanDerWaalsContact C-N 3.28Å; N351-Q353 PolarHBondContact O-N 3.03Å; N351-Q353 PolarHBondContact OD1-N 2.78Å
354	N	89.1	Confident	91.5	Very high	74 Å²	74	48.3 Å²	48.3	40%	0.396	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.6	-2.9	-174.2	74.6	-4.7	0	0	0	114.4	N351 S356	N351-N354 WeakPolarHBondContact CB-OD1 3.33Å; N351-N354 PolarHBondContact ND2-OD1 3.47Å; N354-S356 PolarHBondContact ND2-OG 3.09Å; N354-S356 PolarHBondContact O-N 2.88Å; N354-S356 PolarHBondContact OD1-N 2.92Å; N354-S356 VanDerWaalsContact OD1-N 3.1Å; N354-S356 PolarHBondContact OD1-OG 2.94Å
355	G	90.8	Very high	91.2	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.268	C	S	.	.			trans	78.6	3.7	176.2	0	0	0	0	0	116.7	P318 I350 N351 L357	P318-G355 VanDerWaalsContact CD-C 3.41Å; P318-G355 WeakPolarHBondContact CD-O 3.22Å; I350-G355 WeakPolarHBondContact CD1-O 3.4Å; I350-G355 WeakPolarHBondContact CG1-O 3.37Å; N351-G355 VanDerWaalsContact O-CA 3.26Å; N351-G355 WeakPolarHBondContact O-CA 3.46Å; N351-G355 PolarHBondContact O-N 2.87Å; G355-L357 PolarHBondContact O-N 3.17Å
356	S	94.2	Very high	90.9	Very high	12 Å²	12	55.7 Å²	55.7	8%	0.084	27%	0.274	C	S	.	.			trans	-64.4	127.6	-178	-62.7	0	0	0	0	113.1	T317 I350 N351 N354 F358	T317-S356 PolarHBondContact OG1-OG 2.93Å; I350-S356 CarbonylContact C-O 3.57Å; I350-S356 WeakPolarHBondContact CA-O 3.46Å; N351-S356 PolarHBondContact N-O 2.99Å; N354-S356 PolarHBondContact ND2-OG 3.09Å; N354-S356 PolarHBondContact O-N 2.88Å; N354-S356 PolarHBondContact OD1-N 2.92Å; N354-S356 VanDerWaalsContact OD1-N 3.1Å; N354-S356 PolarHBondContact OD1-OG 2.94Å; S356-F358 WeakPolarHBondContact O-CD2 3.42Å
357	L	94.8	Very high	90.5	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	130.2	-178.2	-174.7	75.6	0	0	0	111.9	I315 Y316 L336 F348 Y349 I350 G355 I373 L427	I315-L357 HydrophobicContact CB-CD2 4.34Å; I315-L357 HydrophobicContact CG2-CD2 4.26Å; I315-L357 PolarHBondContact N-O 3.24Å; Y316-L357 PolarHBondContact N-O 3.44Å; Y316-L357 PolarHBondContact O-N 2.97Å; L336-L357 HydrophobicContact CD2-CD1 3.87Å; F348-L357 HydrophobicContact CB-CD1 4.11Å; F348-L357 HydrophobicContact CD1-CD2 4.41Å; F348-L357 HydrophobicContact CD1-CG 4.39Å; Y349-L357 WeakPolarHBondContact O-CA 3.37Å; I350-L357 HydrophobicContact CB-CD1 4.33Å; G355-L357 PolarHBondContact O-N 3.17Å; L357-I373 HydrophobicContact CD2-CD1 4.16Å; L357-I373 HydrophobicContact CD2-CG2 4.44Å; L357-L427 HydrophobicContact CD2-CD2 3.56Å
358	F	95	Very high	90	Very high	46 Å²	46	61.6 Å²	61.6	20%	0.202	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	152.1	-175.5	-64.5	-92.3	0	0	0	112.9	K313 L314 F348 Y349 S356	K313-F358 WeakPolarHBondContact O-CA 3.42Å; L314-F358 HydrophobicContact CB-CD1 4.15Å; L314-F358 HydrophobicContact CB-CE1 3.9Å; L314-F358 HydrophobicContact CD1-CD1 4.27Å; L314-F358 HydrophobicContact CD1-CE1 3.83Å; L314-F358 HydrophobicContact CD1-CE2 4.29Å; L314-F358 HydrophobicContact CD1-CZ 3.84Å; L314-F358 HydrophobicContact CG-CE1 4.46Å; F348-F358 VanDerWaalsContact CA-O 3.32Å; F348-F358 WeakPolarHBondContact CA-O 3.32Å; Y349-F358 HydrophobicContact CD1-CB 3.95Å; Y349-F358 HydrophobicContact CD2-CB 4.22Å; Y349-F358 HydrophobicContact CD2-CD2 4.15Å; Y349-F358 HydrophobicContact CE1-CB 3.4Å; Y349-F358 VanDerWaalsContact CE1-CB 3.4Å; Y349-F358 HydrophobicContact CE1-CG 4.26Å; Y349-F358 HydrophobicContact CE2-CB 3.69Å; Y349-F358 AromaticContact CE2-CD2 3.48Å; Y349-F358 HydrophobicContact CE2-CD2 3.48Å; Y349-F358 VanDerWaalsContact CE2-CD2 3.48Å; Y349-F358 HydrophobicContact CE2-CE2 4.32Å; Y349-F358 AromaticContact CE2-CG 3.77Å; Y349-F358 HydrophobicContact CE2-CG 3.77Å; Y349-F358 HydrophobicContact CG-CB 4.33Å; Y349-F358 AromaticContact CZ-CD2 3.83Å; Y349-F358 AromaticContact CZ-CG 3.59Å; Y349-F358 PolarHBondContact N-O 3Å; Y349-F358 PolarHBondContact O-N 3.01Å; Y349-F358 WeakPolarHBondContact OH-CB 3.35Å; Y349-F358 WeakPolarHBondContact OH-CG 3.26Å; S356-F358 WeakPolarHBondContact O-CD2 3.42Å
359	L	94.3	Very high	89.5	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	123.8	172.8	-171.5	70.1	0	0	0	110.9	T309 N312 K313 I315 F348 Q361 L363	T309-L359 HydrophobicContact CG2-CD2 4.05Å; N312-L359 WeakPolarHBondContact CA-O 3.49Å; N312-L359 PolarHBondContact N-O 3.19Å; K313-L359 PolarHBondContact O-N 3.44Å; I315-L359 HydrophobicContact CD1-CB 4.33Å; I315-L359 HydrophobicContact CG1-CB 4.45Å; F348-L359 HydrophobicContact CD1-CD1 4.37Å; F348-L359 HydrophobicContact CE1-CD1 3.86Å; F348-L359 HydrophobicContact CZ-CD1 4.01Å; L359-Q361 VanDerWaalsContact CD1-O 3.3Å; L359-Q361 WeakPolarHBondContact CD1-O 3.3Å; L359-Q361 VanDerWaalsContact CG-O 3.31Å; L359-Q361 WeakPolarHBondContact CG-O 3.49Å; L359-L363 HydrophobicContact CD1-CD2 4.28Å; L359-L363 HydrophobicContact CD1-CG 4.43Å
360	K	91.5	Very high	89.4	Confident	107 Å²	107	67.9 Å²	67.9	47%	0.465	33%	0.334	S	S	.	.			trans	-94.6	-38.3	-177.5	-167.7	174.6	168.2	-172	0	113.3	S346 H347 Y349	S346-K360 WeakPolarHBondContact O-CD 3.36Å; H347-K360 WeakPolarHBondContact O-CB 3.48Å; H347-K360 PolarHBondContact O-N 3.4Å; Y349-K360 HydrophobicContact CD1-CB 4.01Å; Y349-K360 HydrophobicContact CD1-CG 4.28Å
361	Q	90.6	Very high	89.2	Confident	93 Å²	93	66.9 Å²	66.9	44%	0.435	33%	0.328	S	S	.	.	S	Bend	trans	-134.9	152.8	-177.5	-69.2	-177.5	-25.5	0	0	109.7	S346 L359	S346-Q361 PolarHBondContact O-OE1 2.77Å; L359-Q361 VanDerWaalsContact CD1-O 3.3Å; L359-Q361 WeakPolarHBondContact CD1-O 3.3Å; L359-Q361 VanDerWaalsContact CG-O 3.31Å; L359-Q361 WeakPolarHBondContact CG-O 3.49Å
362	T	87.5	Confident	89.2	Confident	80 Å²	80	68.7 Å²	68.7	49%	0.491	34%	0.338	S	S	.	.			trans	-62.8	155.6	173.4	49.9	0	0	0	0	110.4	T311 H347	T311-T362 HydrophobicContact CG2-CG2 4.32Å; H347-T362 PolarHBondContact CD2-O 3.38Å; H347-T362 VanDerWaalsContact CD2-O 3.32Å
363	L	90.1	Very high	89.4	Confident	9 Å²	9	65.3 Å²	65.3	5%	0.047	32%	0.316	C	S	.	.			trans	-94.8	159.5	179.6	-57.5	172.2	0	0	0	109.5	I305 E307 Y343 H347 L359 L371 V431	I305-L363 HydrophobicContact CB-CD1 4.37Å; I305-L363 HydrophobicContact CG2-CD1 4.02Å; E307-L363 CarbonylContact C-O 3.32Å; E307-L363 PolarHBondContact O-N 3.13Å; E307-L363 VanDerWaalsContact O-N 3.16Å; Y343-L363 HydrophobicContact CE1-CD2 4.34Å; H347-L363 HydrophobicContact CB-CD2 4.45Å; L359-L363 HydrophobicContact CD1-CD2 4.28Å; L359-L363 HydrophobicContact CD1-CG 4.43Å; L363-L371 HydrophobicContact CD1-CD1 4.4Å; L363-L371 HydrophobicContact CD2-CD1 4.26Å; L363-V431 HydrophobicContact CB-CG1 4.19Å; L363-V431 HydrophobicContact CD1-CG1 4.44Å; L363-V431 HydrophobicContact CD1-CG2 3.98Å
364	D	86.7	Confident	89.8	Confident	69 Å²	69	59 Å²	59	37%	0.369	29%	0.287	S	S	.	.			trans	-124.7	119.1	175.4	178.8	-17.6	0	0	0	108.2	K366 E367 M368	D364-K366 VanDerWaalsContact C-N 3.32Å; D364-K366 PolarHBondContact O-N 2.85Å; D364-K366 WeakPolarHBondContact OD1-CA 3.32Å; D364-K366 VanDerWaalsContact OD1-CB 3.28Å; D364-K366 WeakPolarHBondContact OD1-CB 3.39Å; D364-K366 PolarHBondContact OD1-N 3.27Å; D364-E367 HydrophobicContact CB-CB 3.92Å; D364-E367 PolarHBondContact O-N 2.88Å; D364-E367 PolarHBondContact OD1-N 2.96Å; D364-M368 PolarHBondContact O-N 3.09Å; D364-M368 VanDerWaalsContact O-N 3.11Å
365	Y	85.7	Confident	90	Very high	92 Å²	92	55.5 Å²	55.5	36%	0.361	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-38.7	-179.9	176.9	-95.9	0	0	0	112.7	E307 E367 P369 D433	E307-Y365 WeakPolarHBondContact OE2-CB 3.48Å; E307-Y365 PolarHBondContact OE2-N 3.16Å; Y365-E367 PolarHBondContact O-N 3.12Å; Y365-P369 HydrophobicContact CE2-CB 4.43Å; Y365-D433 HydrophobicContact CD1-CB 3.7Å; Y365-D433 HydrophobicContact CD2-CB 4.19Å; Y365-D433 HydrophobicContact CE1-CB 4.04Å; Y365-D433 HydrophobicContact CE2-CB 4.48Å; Y365-D433 HydrophobicContact CG-CB 3.79Å
366	K	80.6	Confident	90.1	Very high	128 Å²	128	55.9 Å²	55.9	56%	0.557	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-29.5	179.6	-168.3	175.1	-176.9	167.6	0	111.1	D364 D475	D364-K366 VanDerWaalsContact C-N 3.32Å; D364-K366 PolarHBondContact O-N 2.85Å; D364-K366 WeakPolarHBondContact OD1-CA 3.32Å; D364-K366 VanDerWaalsContact OD1-CB 3.28Å; D364-K366 WeakPolarHBondContact OD1-CB 3.39Å; D364-K366 PolarHBondContact OD1-N 3.27Å; K366-D475 IonicContact NZ-OD1 3.43Å; K366-D475 PolarHBondContact NZ-OD1 2.95Å; K366-D475 IonicContact NZ-OD2 3.39Å; K366-D475 PolarHBondContact NZ-OD2 2.99Å
367	E	83	Confident	90	Very high	120 Å²	120	55.3 Å²	55.3	56%	0.561	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-54.9	-176.8	-161.9	-176.2	175.3	0	0	113.9	Y343 D364 Y365	Y343-E367 HydrophobicContact CE2-CG 4.16Å; D364-E367 HydrophobicContact CB-CB 3.92Å; D364-E367 PolarHBondContact O-N 2.88Å; D364-E367 PolarHBondContact OD1-N 2.96Å; Y365-E367 PolarHBondContact O-N 3.12Å
368	M	83.2	Confident	89.7	Confident	60 Å²	60	55.9 Å²	55.9	30%	0.296	27%	0.27	S	S	.	.			trans	-142.2	98.2	-177.6	-84.9	-145.1	-175	0	0	113.8	Y343 D364 K370 L371 V431	Y343-M368 HydrophobicContact CD1-CB 4.49Å; Y343-M368 HydrophobicContact CD1-CE 4.28Å; Y343-M368 HydrophobicContact CD1-CG 4.25Å; Y343-M368 HydrophobicContact CD1-SD 3.52Å; Y343-M368 VanDerWaalsContact CD1-SD 3.52Å; Y343-M368 HydrophobicContact CD2-CE 4.21Å; Y343-M368 HydrophobicContact CD2-CG 4.12Å; Y343-M368 HydrophobicContact CD2-SD 4.14Å; Y343-M368 HydrophobicContact CE1-CB 3.96Å; Y343-M368 HydrophobicContact CE1-CG 4.19Å; Y343-M368 HydrophobicContact CE1-SD 3.95Å; Y343-M368 HydrophobicContact CE2-CB 4.17Å; Y343-M368 HydrophobicContact CE2-CG 4.05Å; Y343-M368 HydrophobicContact CE2-SD 4.5Å; Y343-M368 HydrophobicContact CG-CE 3.8Å; Y343-M368 HydrophobicContact CG-CG 4.22Å; Y343-M368 HydrophobicContact CG-SD 3.64Å; D364-M368 PolarHBondContact O-N 3.09Å; D364-M368 VanDerWaalsContact O-N 3.11Å; M368-K370 PolarHBondContact O-N 3.32Å; M368-L371 HydrophobicContact CB-CD2 4.17Å; M368-L371 HydrophobicContact SD-CD2 3.78Å; M368-V431 WeakPolarHBondContact O-CG2 3.15Å
369	P	85.2	Confident	89.2	Confident	64 Å²	64	54.2 Å²	54.2	42%	0.416	26%	0.262	S	S	.	.	S	Bend	trans	-77.2	-11.1	179.1	27.2	-33.6	0	0	0	115.6	Y365 V431	Y365-P369 HydrophobicContact CE2-CB 4.43Å; P369-V431 PolarHBondContact O-N 2.8Å
370	K	90.7	Very high	88.3	Confident	157 Å²	157	55.1 Å²	55.1	68%	0.683	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.1	142.6	-178.5	-64.3	-178.2	-178.7	176.6	0	112.5	M368 I429	M368-K370 PolarHBondContact O-N 3.32Å; K370-I429 WeakPolarHBondContact CA-O 3.47Å
371	L	91.2	Very high	87.3	Confident	4 Å²	4	54.8 Å²	54.8	2%	0.021	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	142.2	-172.9	-52.1	160.5	0	0	0	113.2	Y343 I344 F348 L363 M368 F428 I429 V431	Y343-L371 HydrophobicContact CD1-CD2 3.68Å; Y343-L371 HydrophobicContact CE1-CD2 3.46Å; Y343-L371 VanDerWaalsContact CE1-CD2 3.46Å; I344-L371 HydrophobicContact CD1-CB 4.05Å; I344-L371 HydrophobicContact CD1-CD2 3.83Å; I344-L371 HydrophobicContact CD1-CG 4.46Å; F348-L371 HydrophobicContact CE2-CD1 4.21Å; F348-L371 HydrophobicContact CZ-CD1 4.15Å; L363-L371 HydrophobicContact CD1-CD1 4.4Å; L363-L371 HydrophobicContact CD2-CD1 4.26Å; M368-L371 HydrophobicContact CB-CD2 4.17Å; M368-L371 HydrophobicContact SD-CD2 3.78Å; L371-F428 CarbonylContact O-C 3.51Å; L371-I429 HydrophobicContact CB-CB 4.14Å; L371-I429 HydrophobicContact CD1-CB 4.29Å; L371-I429 HydrophobicContact CD1-CG2 4.36Å; L371-I429 PolarHBondContact N-O 2.93Å; L371-I429 PolarHBondContact O-N 3.37Å; L371-V431 HydrophobicContact CD1-CG2 4.39Å
372	N	92.5	Very high	85.8	Confident	89 Å²	89	55.6 Å²	55.6	48%	0.476	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	129.6	172.2	-62.5	-1	0	0	0	110.4	L427 F428	N372-L427 CarbonylContact C-O 3.48Å; N372-L427 WeakPolarHBondContact CA-O 3.41Å; N372-F428 HydrophobicContact CB-CD1 4.49Å; N372-F428 WeakPolarHBondContact OD1-CD1 3.22Å
373	I	94.3	Very high	84.4	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	126.9	-171.9	-53.4	-179	0	0	0	111.2	L336 I344 F348 L357 E426 L427 I429	L336-I373 HydrophobicContact CD2-CG2 3.84Å; I344-I373 HydrophobicContact CD1-CD1 4.33Å; I344-I373 HydrophobicContact CD1-CG1 3.84Å; I344-I373 HydrophobicContact CG1-CG1 4.29Å; I344-I373 HydrophobicContact CG2-CB 4.37Å; I344-I373 HydrophobicContact CG2-CD1 4.27Å; I344-I373 HydrophobicContact CG2-CG1 3.87Å; I344-I373 HydrophobicContact CG2-CG2 3.99Å; F348-I373 HydrophobicContact CD1-CD1 4.05Å; F348-I373 HydrophobicContact CD2-CD1 3.83Å; F348-I373 HydrophobicContact CE1-CD1 4Å; F348-I373 HydrophobicContact CE2-CD1 3.78Å; F348-I373 HydrophobicContact CG-CD1 3.97Å; F348-I373 HydrophobicContact CZ-CD1 3.87Å; L357-I373 HydrophobicContact CD2-CD1 4.16Å; L357-I373 HydrophobicContact CD2-CG2 4.44Å; I373-E426 CarbonylContact O-C 3.35Å; I373-E426 WeakPolarHBondContact O-CA 3.05Å; I373-L427 HydrophobicContact CB-CB 4.23Å; I373-L427 HydrophobicContact CD1-CD2 4.35Å; I373-L427 PolarHBondContact N-O 3.35Å; I373-L427 PolarHBondContact O-N 2.89Å; I373-I429 HydrophobicContact CD1-CD1 3.81Å
374	L	94.3	Very high	83	Confident	34 Å²	34	64 Å²	64	18%	0.178	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	134.7	178.5	-65.3	170.6	0	0	0	112.4	S337 R339 N340 M425 E426	S337-L374 PolarHBondContact N-O 2.71Å; R339-L374 HydrophobicContact CB-CD1 3.77Å; N340-L374 PolarHBondContact ND2-O 3.1Å; N340-L374 PolarHBondContact OD1-N 2.56Å; L374-M425 WeakPolarHBondContact CA-O 3.4Å; L374-E426 HydrophobicContact CD2-CB 3.82Å; L374-E426 HydrophobicContact CD2-CG 3.76Å
375	I	94.4	Very high	81.7	Confident	2 Å²	2	64.3 Å²	64.3	1%	0.01	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	137.1	-179.5	-55.9	174.4	0	0	0	110.2	F296 E335 I350 T424 M425	F296-I375 HydrophobicContact CZ-CG2 4.12Å; E335-I375 WeakPolarHBondContact O-CA 3.31Å; I350-I375 HydrophobicContact CD1-CD1 4.2Å; I350-I375 HydrophobicContact CD1-CG1 4.28Å; I350-I375 HydrophobicContact CD1-CG2 3.57Å; I375-T424 CarbonylContact O-C 3.48Å; I375-T424 VanDerWaalsContact O-CA 3.3Å; I375-T424 WeakPolarHBondContact O-CA 3.35Å; I375-M425 HydrophobicContact CB-CG 3.89Å; I375-M425 PolarHBondContact N-O 3.42Å; I375-M425 PolarHBondContact O-N 2.85Å
376	T	92.7	Very high	79.8	Confident	8 Å²	8	64.7 Å²	64.7	5%	0.049	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	146.7	-178.7	-27.8	0	0	0	0	111	F334 E335 S337 H422 D423 T424	F334-T376 WeakPolarHBondContact CA-O 3.21Å; E335-T376 PolarHBondContact N-O 2.92Å; E335-T376 PolarHBondContact O-N 3Å; S337-T376 WeakPolarHBondContact CA-OG1 3.18Å; T376-H422 HydrophobicContact CG2-CB 4.39Å; T376-D423 WeakPolarHBondContact CA-O 3.38Å; T376-D423 WeakPolarHBondContact CG2-O 3.4Å; T376-T424 HydrophobicContact CG2-CG2 3.65Å
377	V	91.8	Very high	78.1	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	138.6	168.6	67.2	0	0	0	0	110.4	P294 F296 A320 L332 I333 F334 H422 D423	P294-V377 HydrophobicContact CB-CG1 4.07Å; P294-V377 HydrophobicContact CB-CG2 4.29Å; F296-V377 HydrophobicContact CD1-CG1 4.42Å; F296-V377 HydrophobicContact CD2-CB 4.49Å; F296-V377 HydrophobicContact CD2-CG1 3.69Å; F296-V377 HydrophobicContact CE1-CB 4.14Å; F296-V377 HydrophobicContact CE1-CG1 4.2Å; F296-V377 HydrophobicContact CE2-CB 3.8Å; F296-V377 HydrophobicContact CE2-CG1 3.44Å; F296-V377 VanDerWaalsContact CE2-CG1 3.44Å; F296-V377 HydrophobicContact CG-CG1 4.18Å; F296-V377 HydrophobicContact CZ-CB 3.58Å; F296-V377 HydrophobicContact CZ-CG1 3.7Å; A320-V377 HydrophobicContact CB-CB 4.47Å; A320-V377 HydrophobicContact CB-CG1 4.13Å; A320-V377 HydrophobicContact CB-CG2 4.06Å; L332-V377 HydrophobicContact CB-CG2 4.24Å; L332-V377 HydrophobicContact CD2-CG2 4.12Å; I333-V377 WeakPolarHBondContact O-CA 3.38Å; F334-V377 HydrophobicContact CD1-CB 4.22Å; F334-V377 HydrophobicContact CD1-CG2 4.18Å; F334-V377 HydrophobicContact CE1-CB 4.27Å; F334-V377 HydrophobicContact CE1-CG2 4.01Å; F334-V377 HydrophobicContact CZ-CG2 4.36Å; V377-H422 VanDerWaalsContact O-CA 3.22Å; V377-H422 WeakPolarHBondContact O-CA 3.43Å; V377-H422 VanDerWaalsContact O-CB 3.32Å; V377-H422 WeakPolarHBondContact O-CB 3.47Å; V377-D423 HydrophobicContact CG1-CB 4.02Å; V377-D423 PolarHBondContact N-O 2.77Å; V377-D423 PolarHBondContact O-N 2.97Å
378	R	88.6	Confident	76.2	Confident	12 Å²	12	67.1 Å²	67.1	5%	0.045	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	163.1	-176.9	61.5	174.6	-178.4	81.3	-1.9	112.6	I333 E335 E384 H422	I333-R378 HydrophobicContact CB-CG 4.33Å; I333-R378 PolarHBondContact N-O 3.05Å; I333-R378 PolarHBondContact O-N 2.81Å; I333-R378 VanDerWaalsContact O-N 3.09Å; E335-R378 IonicContact OE1-NE 3.24Å; E335-R378 IonicContact OE2-CZ 3.59Å; E335-R378 IonicContact OE2-NE 2.82Å; E335-R378 PolarHBondContact OE2-NE 2.63Å; E335-R378 IonicContact OE2-NH2 3.05Å; R378-E384 IonicContact CZ-OE1 2.72Å; R378-E384 IonicContact CZ-OE2 2.64Å; R378-E384 IonicContact NH1-OE1 2.68Å; R378-E384 IonicContact NH1-OE2 3.16Å; R378-E384 PolarHBondContact NH1-OE2 2.71Å; R378-E384 IonicContact NH2-OE1 2.73Å; R378-E384 PolarHBondContact NH2-OE1 3.23Å; R378-E384 IonicContact NH2-OE2 3.83Å; R378-E384 PolarHBondContact NH2-OE2 2.9Å; R378-H422 HydrophobicContact CB-CB 4.07Å
379	N	83.7	Confident	74.1	Confident	10 Å²	10	71 Å²	71	5%	0.053	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-71.5	162.6	164.7	-47.8	89.3	0	0	0	111.2	P294 D322 H329 L421	P294-N379 WeakPolarHBondContact CD-OD1 3.3Å; P294-N379 WeakPolarHBondContact CG-OD1 3.08Å; D322-N379 PolarHBondContact OD2-ND2 3.47Å; H329-N379 PolarHBondContact O-ND2 3.24Å; N379-L421 PolarHBondContact OD1-O 2.76Å
380	P	75.8	Confident	71.9	Confident	19 Å²	19	73.6 Å²	73.6	12%	0.123	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-63	140.4	174.9	-17.9	32	0	0	0	112	I328 Q331 I333	I328-P380 WeakPolarHBondContact O-CD 3.22Å; Q331-P380 HydrophobicContact CB-CG 3.68Å; Q331-P380 HydrophobicContact CG-CG 3.87Å; Q331-P380 WeakPolarHBondContact O-CD 3.39Å; I333-P380 HydrophobicContact CD1-CB 4.02Å; I333-P380 HydrophobicContact CD1-CG 4.08Å
381	R	70	Confident	69	Low	100 Å²	100	72.5 Å²	72.5	38%	0.377	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-74.6	156.2	172	-67.3	173.2	-169.6	158.6	8.5	110	E383 E384 L420	R381-E383 PolarHBondContact O-N 3.09Å; R381-E384 HydrophobicContact CB-CG 4.14Å; R381-E384 PolarHBondContact N-OE2 2.69Å; R381-E384 PolarHBondContact O-N 3.05Å; R381-L420 HydrophobicContact CG-CD2 4Å
382	T	58.9	Low	66.1	Low	111 Å²	111	79.2 Å²	79.2	68%	0.681	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-31.8	176.5	-16	0	0	0	0	112.5
383	E	58.4	Low	63.2	Low	179 Å²	179	82.1 Å²	82.1	84%	0.836	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-18.3	179.5	-59.1	173.6	172	0	0	114.2	R381	R381-E383 PolarHBondContact O-N 3.09Å
384	E	60.7	Low	60.3	Low	85 Å²	85	88.4 Å²	88.4	40%	0.397	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-7.2	-178.4	-65.9	172.4	165.5	0	0	112.4	R378 R381 D386	R378-E384 IonicContact CZ-OE1 2.72Å; R378-E384 IonicContact CZ-OE2 2.64Å; R378-E384 IonicContact NH1-OE1 2.68Å; R378-E384 IonicContact NH1-OE2 3.16Å; R378-E384 PolarHBondContact NH1-OE2 2.71Å; R378-E384 IonicContact NH2-OE1 2.73Å; R378-E384 PolarHBondContact NH2-OE1 3.23Å; R378-E384 IonicContact NH2-OE2 3.83Å; R378-E384 PolarHBondContact NH2-OE2 2.9Å; R381-E384 HydrophobicContact CB-CG 4.14Å; R381-E384 PolarHBondContact N-OE2 2.69Å; R381-E384 PolarHBondContact O-N 3.05Å; E384-D386 VanDerWaalsContact C-N 3.31Å; E384-D386 PolarHBondContact O-N 3.47Å; E384-D386 VanDerWaalsContact O-N 3.09Å
385	I	59.9	Low	57.1	Low	76 Å²	76	92.9 Å²	92.9	39%	0.39	48%	0.484	S	S	.	.			trans	-81.2	80.8	172.4	-53.6	164.5	0	0	0	107.1	I328	I328-I385 HydrophobicContact CD1-CD1 3.99Å; I328-I385 HydrophobicContact CD1-CG1 4.37Å; I328-I385 HydrophobicContact CD1-CG2 3.92Å; I328-I385 HydrophobicContact CG1-CD1 4.23Å; I328-I385 HydrophobicContact CG1-CG1 4.3Å; I328-I385 HydrophobicContact CG1-CG2 4.38Å; I328-I385 HydrophobicContact CG2-CD1 3.55Å; I328-I385 HydrophobicContact CG2-CG1 4.06Å
386	D	46.7	Very low	54.3	Low	101 Å²	101	101.6 Å²	101.6	54%	0.54	52%	0.524	S	S	.	.			trans	-77.9	123.9	179	-162.8	6.1	0	0	0	110.4	E384 K388	E384-D386 VanDerWaalsContact C-N 3.31Å; E384-D386 PolarHBondContact O-N 3.47Å; E384-D386 VanDerWaalsContact O-N 3.09Å; D386-K388 PolarHBondContact O-N 2.9Å
387	D	45	Very low	51.7	Low	140 Å²	140	109.5 Å²	109.5	75%	0.749	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	1.2	-179	-105.3	-22.8	0	0	0	114.9
388	K	41.8	Very low	49.1	Very low	159 Å²	159	113 Å²	113	69%	0.691	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	-9.1	-167.3	-73.6	177.3	-178.5	162.5	0	115.6	D386	D386-K388 PolarHBondContact O-N 2.9Å
389	T	39.7	Very low	46.4	Very low	141 Å²	141	120.9 Å²	120.9	87%	0.865	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	4	174.5	40	0	0	0	0	114.3	N391	T389-N391 VanDerWaalsContact C-N 3.33Å
390	M	38.4	Very low	44.2	Very low	119 Å²	119	127.7 Å²	127.7	59%	0.586	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	7.1	174.3	-123.2	-176.5	167.9	0	0	114.7	N392 L398	M390-N392 PolarHBondContact O-N 3.43Å; M390-L398 HydrophobicContact CE-CB 3.63Å; M390-L398 HydrophobicContact CE-CD1 3.7Å; M390-L398 HydrophobicContact CE-CD2 3.99Å; M390-L398 HydrophobicContact CE-CG 3.97Å
391	N	29.3	Very low	42.4	Very low	134 Å²	134	133.2 Å²	133.2	72%	0.717	67%	0.669	S	S	*	*			trans	-94.9	91.1	176.2	-83.6	-31	0	0	0	111.2	T389	T389-N391 VanDerWaalsContact C-N 3.33Å
392	N	31.4	Very low	40.7	Very low	144 Å²	144	134.9 Å²	134.9	77%	0.77	68%	0.681	S	S	*	*	S	Bend	trans	153.2	114.1	141.8	-76.6	-31.6	0	0	0	109.9	M390	M390-N392 PolarHBondContact O-N 3.43Å
393	N	32.2	Very low	39.5	Very low	151 Å²	151	139.4 Å²	139.4	81%	0.807	69%	0.686	S	S	*	*	S	Bend	trans	85	27.2	162.8	-57.2	-19.1	0	0	0	121.2
394	L	32.7	Very low	38.3	Very low	132 Å²	132	137.1 Å²	137.1	69%	0.691	67%	0.671	S	S	*	*			trans	-132.8	69.6	156	-87.8	105.5	0	0	0	111.1	L398	L394-L398 HydrophobicContact CB-CD1 4.43Å; L394-L398 HydrophobicContact CD2-CD1 4.33Å
395	T	28	Very low	37.1	Very low	128 Å²	128	138.4 Å²	138.4	79%	0.785	67%	0.673	S	S	*	*			trans	-77.8	123.8	170.4	49.8	0	0	0	0	109.5
396	H	34.6	Very low	35.8	Very low	185 Å²	185	143.6 Å²	143.6	86%	0.856	69%	0.693	S	S	*	*	S	Bend	trans	108.7	-7.5	164.6	-81.6	-76.6	0	0	0	121.7
397	E	37	Very low	35.2	Very low	173 Å²	173	143 Å²	143	81%	0.808	70%	0.696	S	S	*	*	S	Bend	trans	-117.3	-5.8	-177.6	-77.8	-178.9	165.5	0	0	116.6
398	L	38.7	Very low	34.9	Very low	73 Å²	73	139.6 Å²	139.6	38%	0.382	68%	0.678	S	S	.	*	S	Bend	trans	-112.8	-3.4	-173.3	-82.2	145.3	0	0	0	115.5	M390 L394	M390-L398 HydrophobicContact CE-CB 3.63Å; M390-L398 HydrophobicContact CE-CD1 3.7Å; M390-L398 HydrophobicContact CE-CD2 3.99Å; M390-L398 HydrophobicContact CE-CG 3.97Å; L394-L398 HydrophobicContact CB-CD1 4.43Å; L394-L398 HydrophobicContact CD2-CD1 4.33Å
399	F	32.3	Very low	34.8	Very low	179 Å²	179	135.3 Å²	135.3	79%	0.785	67%	0.665	S	S	*	*	S	Bend	trans	-85.7	-14.3	-171.7	-99.8	-88.2	0	0	0	115.7
400	D	37.1	Very low	34.7	Very low	153 Å²	153	132.7 Å²	132.7	82%	0.818	65%	0.653	S	S	*	*	S	Bend	trans	-97	-12.1	178.4	-80.8	-33.2	0	0	0	114.3
401	R	37.7	Very low	34.6	Very low	134 Å²	134	134.4 Å²	134.4	51%	0.506	66%	0.664	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.5	-17.5	175.9	-76.2	-174.4	-175.7	-164.4	-1.1	114	Y159	Y159-R401 HydrophobicContact CE1-CG 4.01Å
402	H	34.2	Very low	34.9	Very low	136 Å²	136	133 Å²	133	63%	0.63	66%	0.655	S	S	*	*	H	α-helix	trans	-78.6	-19.1	-174.5	-122.5	82.1	0	0	0	114.2
403	Y	33.3	Very low	35.1	Very low	205 Å²	205	132 Å²	132	80%	0.804	65%	0.649	S	S	*	*	H	α-helix	trans	-83.5	-23.1	-178.5	-117.3	-89.2	0	0	0	113.6
404	Y	33.8	Very low	35.4	Very low	132 Å²	132	129.3 Å²	129.3	52%	0.518	64%	0.642	S	S	.	*	H	α-helix	trans	-81.7	-34.1	-179.1	-124.1	-99.6	0	0	0	112.5	K406 S407 L408	Y404-K406 VanDerWaalsContact C-N 3.3Å; Y404-K406 PolarHBondContact O-N 3.36Å; Y404-S407 PolarHBondContact O-N 3.04Å; Y404-L408 HydrophobicContact CD1-CD1 3.49Å; Y404-L408 VanDerWaalsContact CD1-CD1 3.49Å; Y404-L408 HydrophobicContact CE1-CD1 3.73Å; Y404-L408 PolarHBondContact O-N 3.18Å
405	Y	34.2	Very low	35.6	Very low	111 Å²	111	126.8 Å²	126.8	44%	0.435	64%	0.636	S	S	.	*	H	α-helix	trans	-64.6	-33.7	177.8	-136.8	-94.7	0	0	0	112.1	V409	Y405-V409 HydrophobicContact CD1-CG2 4.19Å; Y405-V409 HydrophobicContact CE1-CG2 4.43Å; Y405-V409 WeakPolarHBondContact O-CB 3.41Å; Y405-V409 WeakPolarHBondContact O-CG2 3.44Å
406	K	33.6	Very low	36.2	Very low	186 Å²	186	129 Å²	129	81%	0.809	64%	0.639	S	S	*	*	H	α-helix	trans	-80.3	-17.5	-177.7	-135.9	172.1	-173.8	171.4	0	114.4	Y404	Y404-K406 VanDerWaalsContact C-N 3.3Å; Y404-K406 PolarHBondContact O-N 3.36Å
407	S	34.4	Very low	36.5	Very low	87 Å²	87	125.5 Å²	125.5	61%	0.608	63%	0.626	S	S	*	*	H	α-helix	trans	-98.2	-19.8	-175.4	177.7	0	0	0	0	114	Y404	Y404-S407 PolarHBondContact O-N 3.04Å
408	L	37.7	Very low	36.6	Very low	70 Å²	70	122.4 Å²	122.4	37%	0.366	62%	0.615	S	S	.	*	H	α-helix	trans	-98.8	-23.4	178.8	-80.7	148.9	0	0	0	112.6	M161 Y404 S410	M161-L408 HydrophobicContact CE-CB 3.7Å; M161-L408 HydrophobicContact CE-CD1 3.96Å; M161-L408 HydrophobicContact CE-CG 4.26Å; Y404-L408 HydrophobicContact CD1-CD1 3.49Å; Y404-L408 VanDerWaalsContact CD1-CD1 3.49Å; Y404-L408 HydrophobicContact CE1-CD1 3.73Å; Y404-L408 PolarHBondContact O-N 3.18Å; L408-S410 PolarHBondContact O-N 3.36Å
409	V	40.5	Very low	36.8	Very low	68 Å²	68	123 Å²	123	41%	0.412	62%	0.624	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.8	-7.3	-179.5	174	0	0	0	0	113.1	Y405 N411	Y405-V409 HydrophobicContact CD1-CG2 4.19Å; Y405-V409 HydrophobicContact CE1-CG2 4.43Å; Y405-V409 WeakPolarHBondContact O-CB 3.41Å; Y405-V409 WeakPolarHBondContact O-CG2 3.44Å; V409-N411 VanDerWaalsContact C-N 3.33Å; V409-N411 PolarHBondContact O-N 3.29Å
410	S	36.6	Very low	37.8	Very low	87 Å²	87	118 Å²	118	61%	0.608	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-3.6	179.8	68.5	0	0	0	0	115	L408	L408-S410 PolarHBondContact O-N 3.36Å
411	N	37.1	Very low	39.2	Very low	155 Å²	155	112.4 Å²	112.4	83%	0.829	58%	0.575	S	S	*	*	S	Bend	trans	-133.2	9.4	-177.6	-88.7	-19.4	0	0	0	114.1	V409	V409-N411 VanDerWaalsContact C-N 3.33Å; V409-N411 PolarHBondContact O-N 3.29Å
412	M	36	Very low	41.4	Very low	105 Å²	105	111.5 Å²	111.5	52%	0.517	58%	0.577	S	S	.	*	S	Bend	trans	-108.3	134.4	173.3	-80.1	-169.6	153.9	0	0	109.9	L164 S414	L164-M412 HydrophobicContact CD1-CE 3.27Å; L164-M412 HydrophobicContact CD1-SD 4.45Å; M412-S414 PolarHBondContact O-N 2.93Å; M412-S414 VanDerWaalsContact O-N 3.11Å
413	D	36.3	Very low	44	Very low	121 Å²	121	106.2 Å²	106.2	65%	0.647	55%	0.553	S	S	*	*			trans	-57.3	116.5	-179.9	-160.6	10.3	0	0	0	108.6	S415 M416	D413-S415 PolarHBondContact O-N 2.86Å; D413-S415 PolarHBondContact OD2-OG 3.04Å; D413-M416 PolarHBondContact O-N 2.97Å
414	S	37.6	Very low	46.8	Very low	95 Å²	95	98.4 Å²	98.4	66%	0.664	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-58.3	-7.6	-179.8	-164.8	0	0	0	0	112.6	M412 M416	M412-S414 PolarHBondContact O-N 2.93Å; M412-S414 VanDerWaalsContact O-N 3.11Å; S414-M416 VanDerWaalsContact C-N 3.32Å
415	S	37	Very low	49.6	Very low	80 Å²	80	92.5 Å²	92.5	56%	0.559	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-71.3	-17.7	172.4	68.5	0	0	0	0	114.4	D413	D413-S415 PolarHBondContact O-N 2.86Å; D413-S415 PolarHBondContact OD2-OG 3.04Å
416	M	39.6	Very low	52.5	Low	175 Å²	175	90 Å²	90	86%	0.862	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-91.2	-8.8	179.5	-84.2	-163.8	156.4	0	0	114.7	D413 S414	D413-M416 PolarHBondContact O-N 2.97Å; S414-M416 VanDerWaalsContact C-N 3.32Å
417	I	40.8	Very low	55.3	Low	111 Å²	111	81.3 Å²	81.3	57%	0.569	46%	0.459	S	S	*	.	S	Bend	trans	-102.9	-8.2	-175.4	-64.4	176.4	0	0	0	112.1
418	D	39.5	Very low	58.1	Low	108 Å²	108	79.3 Å²	79.3	58%	0.578	44%	0.439	S	S	*	.			trans	-129.5	38.1	-163.5	-147.5	13.4	0	0	0	115.1	L420	D418-L420 PolarHBondContact O-N 3.01Å
419	S	43.6	Very low	60.8	Low	84 Å²	84	76.4 Å²	76.4	59%	0.587	42%	0.424	S	S	*	.			trans	-87.6	90.6	160.1	64.1	0	0	0	0	108.4	L421	S419-L421 VanDerWaalsContact C-N 3.34Å; S419-L421 WeakPolarHBondContact O-CG 3.43Å; S419-L421 PolarHBondContact O-N 3.41Å
420	L	53.5	Low	63.2	Low	74 Å²	74	78.5 Å²	78.5	39%	0.387	43%	0.429	S	S	.	.			trans	-53.3	95	175.1	-100.3	123.4	0	0	0	110.9	R381 D418 H422	R381-L420 HydrophobicContact CG-CD2 4Å; D418-L420 PolarHBondContact O-N 3.01Å; L420-H422 PolarHBondContact O-N 3.29Å; L420-H422 PolarHBondContact O-ND1 2.65Å
421	L	66.2	Low	65.7	Low	36 Å²	36	74.6 Å²	74.6	19%	0.188	40%	0.402	C	S	.	.			trans	-67.3	118.9	176.7	-61.1	179.5	0	0	0	107.7	H292 S293 N379 S419	H292-L421 WeakPolarHBondContact O-CD1 3.45Å; S293-L421 WeakPolarHBondContact OG-CB 3.25Å; S293-L421 WeakPolarHBondContact OG-CD1 3.36Å; S293-L421 VanDerWaalsContact OG-CD2 3.31Å; S293-L421 WeakPolarHBondContact OG-CD2 3.37Å; S293-L421 WeakPolarHBondContact OG-CG 3.39Å; N379-L421 PolarHBondContact OD1-O 2.76Å; S419-L421 VanDerWaalsContact C-N 3.34Å; S419-L421 WeakPolarHBondContact O-CG 3.43Å; S419-L421 PolarHBondContact O-N 3.41Å
422	H	83	Confident	68.1	Low	115 Å²	115	71.4 Å²	71.4	53%	0.532	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	160.3	-175.6	69	-84.1	0	0	0	112	T376 V377 R378 L420	T376-H422 HydrophobicContact CG2-CB 4.39Å; V377-H422 VanDerWaalsContact O-CA 3.22Å; V377-H422 WeakPolarHBondContact O-CA 3.43Å; V377-H422 VanDerWaalsContact O-CB 3.32Å; V377-H422 WeakPolarHBondContact O-CB 3.47Å; R378-H422 HydrophobicContact CB-CB 4.07Å; L420-H422 PolarHBondContact O-N 3.29Å; L420-H422 PolarHBondContact O-ND1 2.65Å
423	D	90	Very high	70.5	Confident	25 Å²	25	69.1 Å²	69.1	13%	0.134	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	161.2	173.8	-166.6	14.1	0	0	0	111.3	P294 F296 T376 V377	P294-D423 WeakPolarHBondContact O-CB 3.49Å; F296-D423 HydrophobicContact CD2-CB 3.99Å; F296-D423 WeakPolarHBondContact CE2-O 3.3Å; F296-D423 PolarHBondContact N-OD2 2.8Å; T376-D423 WeakPolarHBondContact CA-O 3.38Å; T376-D423 WeakPolarHBondContact CG2-O 3.4Å; V377-D423 HydrophobicContact CG1-CB 4.02Å; V377-D423 PolarHBondContact N-O 2.77Å; V377-D423 PolarHBondContact O-N 2.97Å
424	T	91	Very high	73	Confident	41 Å²	41	66 Å²	66	25%	0.252	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	146.1	-175.2	51.8	0	0	0	0	114.7	I375 T376	I375-T424 CarbonylContact O-C 3.48Å; I375-T424 VanDerWaalsContact O-CA 3.3Å; I375-T424 WeakPolarHBondContact O-CA 3.35Å; T376-T424 HydrophobicContact CG2-CG2 3.65Å
425	M	93.4	Very high	75.4	Confident	9 Å²	9	63.5 Å²	63.5	4%	0.044	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	165.2	175.4	75.3	172.8	-52.4	0	0	114.4	F296 Q298 K299 V301 Y316 P318 L374 I375	F296-M425 HydrophobicContact CD1-SD 4.12Å; F296-M425 HydrophobicContact CD2-CB 4.39Å; F296-M425 HydrophobicContact CE1-CG 4.41Å; F296-M425 HydrophobicContact CE1-SD 4.05Å; F296-M425 HydrophobicContact CE2-CG 4.38Å; F296-M425 HydrophobicContact CZ-CG 4.3Å; F296-M425 HydrophobicContact CZ-SD 4.5Å; Q298-M425 WeakPolarHBondContact O-CE 3.48Å; K299-M425 WeakPolarHBondContact O-CA 3.43Å; K299-M425 WeakPolarHBondContact O-CB 3.36Å; V301-M425 HydrophobicContact CG2-CE 4.1Å; Y316-M425 HydrophobicContact CE1-CE 3.97Å; Y316-M425 HydrophobicContact CE1-SD 4.42Å; P318-M425 HydrophobicContact CB-SD 3.57Å; P318-M425 VanDerWaalsContact CB-SD 3.57Å; L374-M425 WeakPolarHBondContact CA-O 3.4Å; I375-M425 HydrophobicContact CB-CG 3.89Å; I375-M425 PolarHBondContact N-O 3.42Å; I375-M425 PolarHBondContact O-N 2.85Å
426	E	94.3	Very high	77.8	Confident	58 Å²	58	64 Å²	64	27%	0.271	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	142.2	-173.7	-167.9	170.7	-160.3	0	0	115.7	K299 N300 V301 I373 L374 F428	K299-E426 PolarHBondContact O-N 3.15Å; N300-E426 CarbonylContact C-O 3.09Å; N300-E426 VanDerWaalsContact CA-O 3.32Å; N300-E426 WeakPolarHBondContact CA-O 3.46Å; V301-E426 PolarHBondContact N-O 3.34Å; I373-E426 CarbonylContact O-C 3.35Å; I373-E426 WeakPolarHBondContact O-CA 3.05Å; L374-E426 HydrophobicContact CD2-CB 3.82Å; L374-E426 HydrophobicContact CD2-CG 3.76Å; E426-F428 VanDerWaalsContact CD-CZ 3.44Å; E426-F428 HydrophobicContact CG-CE2 3.89Å; E426-F428 HydrophobicContact CG-CZ 3.82Å
427	L	93.7	Very high	79.9	Confident	3 Å²	3	59.4 Å²	59.4	2%	0.016	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	134.1	-177.1	177.5	72.5	0	0	0	113.1	V301 L303 I315 L357 N372 I373 I429	V301-L427 HydrophobicContact CB-CD1 3.61Å; V301-L427 HydrophobicContact CG1-CD1 3.53Å; V301-L427 CarbonylContact O-C 3.54Å; V301-L427 WeakPolarHBondContact O-CA 3.13Å; L303-L427 HydrophobicContact CD1-CD1 3.83Å; L303-L427 HydrophobicContact CD1-CD2 4.45Å; L303-L427 HydrophobicContact CG-CD1 4.15Å; I315-L427 HydrophobicContact CG2-CD2 4.44Å; L357-L427 HydrophobicContact CD2-CD2 3.56Å; N372-L427 CarbonylContact C-O 3.48Å; N372-L427 WeakPolarHBondContact CA-O 3.41Å; I373-L427 HydrophobicContact CB-CB 4.23Å; I373-L427 HydrophobicContact CD1-CD2 4.35Å; I373-L427 PolarHBondContact N-O 3.35Å; I373-L427 PolarHBondContact O-N 2.89Å; L427-I429 HydrophobicContact CD2-CD1 4.39Å
428	F	93.8	Very high	82.2	Confident	46 Å²	46	60.2 Å²	60.2	20%	0.202	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	134.8	-175.5	-60	-91.9	0	0	0	114	V301 Y302 L303 L371 N372 E426	V301-F428 WeakPolarHBondContact O-CD2 3.36Å; V301-F428 PolarHBondContact O-N 2.94Å; Y302-F428 CarbonylContact C-O 3.4Å; Y302-F428 WeakPolarHBondContact CA-O 3.48Å; Y302-F428 HydrophobicContact CD1-CB 3.57Å; Y302-F428 AromaticContact CD1-CD2 3.79Å; Y302-F428 HydrophobicContact CD1-CD2 3.79Å; Y302-F428 AromaticContact CD1-CG 3.83Å; Y302-F428 HydrophobicContact CD1-CG 3.83Å; Y302-F428 HydrophobicContact CE1-CB 4Å; Y302-F428 HydrophobicContact CE1-CD1 4.41Å; Y302-F428 AromaticContact CE1-CD2 3.49Å; Y302-F428 HydrophobicContact CE1-CD2 3.49Å; Y302-F428 VanDerWaalsContact CE1-CD2 3.49Å; Y302-F428 HydrophobicContact CE1-CE2 4.09Å; Y302-F428 AromaticContact CE1-CG 3.71Å; Y302-F428 HydrophobicContact CE1-CG 3.71Å; Y302-F428 HydrophobicContact CE2-CD2 4.36Å; Y302-F428 HydrophobicContact CG-CB 4.29Å; Y302-F428 HydrophobicContact CG-CD2 4.32Å; Y302-F428 AromaticContact CZ-CD2 3.8Å; L303-F428 PolarHBondContact N-O 2.92Å; L371-F428 CarbonylContact O-C 3.51Å; N372-F428 HydrophobicContact CB-CD1 4.49Å; N372-F428 WeakPolarHBondContact OD1-CD1 3.22Å; E426-F428 VanDerWaalsContact CD-CZ 3.44Å; E426-F428 HydrophobicContact CG-CE2 3.89Å; E426-F428 HydrophobicContact CG-CZ 3.82Å
429	I	93.2	Very high	84.6	Confident	9 Å²	9	55.1 Å²	55.1	5%	0.046	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	147.7	-174	-44.4	179.1	0	0	0	115	L303 I305 I315 F348 K370 L371 I373 L427	L303-I429 HydrophobicContact CB-CG1 4.37Å; L303-I429 WeakPolarHBondContact O-CA 3.36Å; I305-I429 HydrophobicContact CB-CG2 4.37Å; I305-I429 HydrophobicContact CD1-CD1 4.37Å; I305-I429 HydrophobicContact CD1-CG2 3.75Å; I305-I429 HydrophobicContact CG1-CG2 3.81Å; I315-I429 HydrophobicContact CG2-CD1 4.31Å; F348-I429 HydrophobicContact CE1-CD1 4.21Å; F348-I429 HydrophobicContact CZ-CD1 4.03Å; K370-I429 WeakPolarHBondContact CA-O 3.47Å; L371-I429 HydrophobicContact CB-CB 4.14Å; L371-I429 HydrophobicContact CD1-CB 4.29Å; L371-I429 HydrophobicContact CD1-CG2 4.36Å; L371-I429 PolarHBondContact N-O 2.93Å; L371-I429 PolarHBondContact O-N 3.37Å; I373-I429 HydrophobicContact CD1-CD1 3.81Å; L427-I429 HydrophobicContact CD2-CD1 4.39Å
430	Q	90.8	Very high	86.9	Confident	111 Å²	111	55.1 Å²	55.1	52%	0.519	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	143.1	178.1	-179.6	174.2	-2.3	0	0	115.1	L303 I305	L303-Q430 PolarHBondContact O-N 2.75Å; I305-Q430 PolarHBondContact N-O 3.4Å
431	V	90.6	Very high	88.7	Confident	6 Å²	6	52.4 Å²	52.4	4%	0.036	27%	0.265	C	S	.	.			trans	-116.5	157.8	-171.4	-167.9	0	0	0	0	116	I305 E307 L363 M368 P369 L371	I305-V431 WeakPolarHBondContact O-CA 3.4Å; E307-V431 HydrophobicContact CB-CG1 3.92Å; L363-V431 HydrophobicContact CB-CG1 4.19Å; L363-V431 HydrophobicContact CD1-CG1 4.44Å; L363-V431 HydrophobicContact CD1-CG2 3.98Å; M368-V431 WeakPolarHBondContact O-CG2 3.15Å; P369-V431 PolarHBondContact O-N 2.8Å; L371-V431 HydrophobicContact CD1-CG2 4.39Å
432	I	86.9	Confident	89.8	Confident	87 Å²	87	52 Å²	52	45%	0.446	27%	0.265	S	S	.	.			trans	-140.3	139.3	-170.2	-54.6	170.4	0	0	0	114.3	L306 E307	L306-I432 HydrophobicContact CD2-CB 3.99Å; L306-I432 HydrophobicContact CD2-CD1 3.98Å; L306-I432 HydrophobicContact CD2-CG2 4.01Å; E307-I432 WeakPolarHBondContact CB-O 3.46Å; E307-I432 WeakPolarHBondContact CG-O 2.91Å; E307-I432 PolarHBondContact N-O 2.85Å
433	D	86.9	Confident	90.2	Very high	57 Å²	57	46.5 Å²	46.5	31%	0.305	24%	0.24	S	C	.	.			trans	-85.4	153.5	-170.5	-177.3	54.4	0	0	0	119.8	E307 Y365	E307-D433 WeakPolarHBondContact OE1-CA 3.16Å; Y365-D433 HydrophobicContact CD1-CB 3.7Å; Y365-D433 HydrophobicContact CD2-CB 4.19Å; Y365-D433 HydrophobicContact CE1-CB 4.04Å; Y365-D433 HydrophobicContact CE2-CB 4.48Å; Y365-D433 HydrophobicContact CG-CB 3.79Å
434	V	88.1	Confident	90.2	Very high	56 Å²	56	47.3 Å²	47.3	34%	0.339	24%	0.241	S	C	.	.			trans	-147.8	135.7	-175.8	-177.4	0	0	0	0	114.8	E307 N436	E307-V434 HydrophobicContact CG-CG2 4.29Å; E307-V434 WeakPolarHBondContact OE1-CB 3.06Å; E307-V434 PolarHBondContact OE1-N 3.25Å; V434-N436 VanDerWaalsContact O-CG 3.28Å; V434-N436 PolarHBondContact O-N 2.85Å; V434-N436 VanDerWaalsContact O-N 3.1Å; V434-N436 PolarHBondContact O-OD1 2.93Å
435	N	87.6	Confident	90	Very high	43 Å²	43	46.5 Å²	46.5	23%	0.23	24%	0.236	C	C	.	.			trans	-60.4	99	177.5	-171.9	31.8	0	0	0	114.2	D476 N480	N435-D476 PolarHBondContact OD1-OD2 2.7Å; N435-N480 HydrophobicContact CB-CB 4.21Å; N435-N480 VanDerWaalsContact CB-CG 3.44Å; N435-N480 WeakPolarHBondContact CB-ND2 3.41Å; N435-N480 VanDerWaalsContact CG-CG 3.4Å; N435-N480 WeakPolarHBondContact OD1-CB 3.38Å; N435-N480 VanDerWaalsContact OD1-CG 3.31Å
436	N	86.7	Confident	89.5	Confident	91 Å²	91	50 Å²	50	49%	0.487	26%	0.26	S	S	.	.			trans	-141.6	11.8	-172.6	63.5	7.2	0	0	0	116.1	V434 D476	V434-N436 VanDerWaalsContact O-CG 3.28Å; V434-N436 PolarHBondContact O-N 2.85Å; V434-N436 VanDerWaalsContact O-N 3.1Å; V434-N436 PolarHBondContact O-OD1 2.93Å; N436-D476 PolarHBondContact N-OD1 2.99Å; N436-D476 PolarHBondContact N-OD2 2.97Å; N436-D476 PolarHBondContact OD1-OD1 2.87Å
437	H	85.4	Confident	89	Confident	77 Å²	77	54.9 Å²	54.9	36%	0.356	29%	0.288	S	S	.	.			trans	-120.7	150.6	177.3	-62.7	90.7	0	0	0	113.1	D475 D476 L560	H437-D475 HydrophobicContact CB-CB 3.9Å; H437-D476 IonicContact CE1-OD1 3.99Å; H437-D476 IonicContact CG-OD1 3.65Å; H437-D476 PolarHBondContact N-OD1 3.05Å; H437-D476 PolarHBondContact N-OD2 3.41Å; H437-D476 IonicContact ND1-OD1 3.4Å; H437-D476 PolarHBondContact ND1-OD1 3.48Å; H437-L560 VanDerWaalsContact O-CD1 3.31Å; H437-L560 WeakPolarHBondContact O-CD1 3.27Å
438	K	89	Confident	88.3	Confident	128 Å²	128	56.7 Å²	56.7	56%	0.557	31%	0.308	S	S	*	.			trans	-116.5	162.4	-176.6	66.4	175.6	-179.8	174.2	0	112.3	L560	K438-L560 HydrophobicContact CB-CB 3.77Å; K438-L560 HydrophobicContact CB-CD1 3.86Å; K438-L560 HydrophobicContact CB-CG 4.47Å
439	P	90	Very high	87.9	Confident	1 Å²	1	57 Å²	57	1%	0.006	32%	0.315	C	S	.	.			trans	-60.9	136.6	177	-27.3	35.1	0	0	0	114.9	T473 D474 V483 D554 T562	P439-T473 CarbonylContact C-O 3.55Å; P439-T473 WeakPolarHBondContact CA-O 3.36Å; P439-D474 WeakPolarHBondContact CD-OD2 3.45Å; P439-V483 HydrophobicContact CB-CG1 3.79Å; P439-V483 HydrophobicContact CB-CG2 4.07Å; P439-V483 HydrophobicContact CG-CG1 4Å; P439-V483 HydrophobicContact CG-CG2 3.97Å; P439-D554 HydrophobicContact CG-CB 3.76Å; P439-T562 WeakPolarHBondContact O-CB 3.04Å; P439-T562 PolarHBondContact O-OG1 3.38Å
440	V	90.4	Very high	87.4	Confident	84 Å²	84	62 Å²	62	51%	0.509	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	127.1	179.3	-178.4	0	0	0	0	110	V472 T473	V440-V472 WeakPolarHBondContact O-CA 3.28Å; V440-V472 WeakPolarHBondContact O-CG1 3.18Å; V440-T473 PolarHBondContact N-O 2.8Å; V440-T473 PolarHBondContact O-N 2.7Å; V440-T473 VanDerWaalsContact O-N 3.09Å
441	I	91.6	Very high	87.2	Confident	17 Å²	17	61.9 Å²	61.9	9%	0.087	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	140.3	-178.9	-47.9	172.9	0	0	0	110	V470 S471 C552 T562 Y564	I441-V470 HydrophobicContact CG2-CG1 3.9Å; I441-S471 CarbonylContact C-O 3.58Å; I441-S471 WeakPolarHBondContact CA-O 3.22Å; I441-C552 HydrophobicContact CD1-CB 3.68Å; I441-C552 WeakPolarHBondContact CD1-SG 3.27Å; I441-C552 HydrophobicContact CG1-CB 3.94Å; I441-C552 WeakPolarHBondContact CG1-SG 3.18Å; I441-T562 HydrophobicContact CD1-CG2 3.8Å; I441-T562 WeakPolarHBondContact CD1-O 3.25Å; I441-T562 HydrophobicContact CG1-CG2 3.98Å; I441-Y564 HydrophobicContact CG2-CG 4.32Å
442	S	89.8	Confident	87.2	Confident	28 Å²	28	61.7 Å²	61.7	20%	0.196	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	138.4	175.9	171.3	0	0	0	0	111.2	H450 V470 S471	S442-H450 PolarHBondContact OG-NE2 2.89Å; S442-V470 CarbonylContact O-C 3.5Å; S442-V470 WeakPolarHBondContact O-CA 3.32Å; S442-V470 WeakPolarHBondContact O-CG1 3.13Å; S442-S471 PolarHBondContact N-O 3.29Å; S442-S471 PolarHBondContact O-N 3.11Å
443	A	90.5	Very high	87.3	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	133.8	172.9	0	0	0	0	0	110.8	H450 L469 V470 Y564	A443-H450 PolarHBondContact O-CD2 2.79Å; A443-L469 CarbonylContact C-O 3.46Å; A443-L469 VanDerWaalsContact CA-O 3.27Å; A443-L469 WeakPolarHBondContact CA-O 3.37Å; A443-V470 HydrophobicContact CB-CG2 4.06Å; A443-Y564 HydrophobicContact CB-CE1 3.63Å
444	Y	90.9	Very high	87.4	Confident	41 Å²	41	59.5 Å²	59.5	16%	0.161	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	150.5	-171.7	51.7	-81.7	0	0	0	111.6	S449 A468 L469 S471	Y444-S449 CarbonylContact C-O 3.56Å; Y444-S449 VanDerWaalsContact CA-O 3.23Å; Y444-S449 WeakPolarHBondContact CA-O 3.41Å; Y444-A468 CarbonylContact O-C 3.49Å; Y444-A468 WeakPolarHBondContact O-CA 3.18Å; Y444-L469 HydrophobicContact CD2-CB 4.01Å; Y444-L469 HydrophobicContact CD2-CD1 4.38Å; Y444-L469 HydrophobicContact CE1-CB 4.36Å; Y444-L469 HydrophobicContact CE2-CB 3.64Å; Y444-L469 HydrophobicContact CE2-CD1 3.73Å; Y444-L469 HydrophobicContact CE2-CG 4.31Å; Y444-L469 PolarHBondContact N-O 2.81Å; Y444-L469 WeakPolarHBondContact O-CA 3.39Å; Y444-L469 PolarHBondContact O-N 2.78Å; Y444-S471 WeakPolarHBondContact CE1-OG 3.45Å
445	T	87	Confident	87.4	Confident	24 Å²	24	62.3 Å²	62.3	15%	0.147	33%	0.334	C	S	.	.			trans	-62.8	162.4	172.4	63.8	0	0	0	0	110.6	N447 G448 S449 E451 L452	T445-N447 PolarHBondContact O-N 2.76Å; T445-G448 WeakPolarHBondContact O-CA 3.42Å; T445-G448 PolarHBondContact O-N 2.88Å; T445-S449 WeakPolarHBondContact CG2-O 3.25Å; T445-S449 PolarHBondContact N-O 2.98Å; T445-S449 VanDerWaalsContact OG1-CB 3.31Å; T445-S449 WeakPolarHBondContact OG1-CB 3.45Å; T445-S449 PolarHBondContact OG1-N 3.31Å; T445-S449 PolarHBondContact OG1-O 3.35Å; T445-E451 WeakPolarHBondContact CG2-O 3.27Å; T445-L452 HydrophobicContact CG2-CD2 4.03Å
446	P	82.7	Confident	87.6	Confident	84 Å²	84	60.6 Å²	60.6	55%	0.545	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-20.2	174	-28.1	36	0	0	0	114.5	F467	P446-F467 WeakPolarHBondContact CD-O 3.47Å
447	N	82.7	Confident	87.6	Confident	159 Å²	159	61.9 Å²	61.9	85%	0.85	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	4.1	176.3	-61.4	0.8	0	0	0	113	T445	T445-N447 PolarHBondContact O-N 2.76Å
448	G	80.4	Confident	87.7	Confident	42 Å²	42	60 Å²	60	43%	0.433	32%	0.32	S	S	.	.	S	Bend	trans	88.4	6.3	178.5	0	0	0	0	0	116	T445	T445-G448 WeakPolarHBondContact O-CA 3.42Å; T445-G448 PolarHBondContact O-N 2.88Å
449	S	84.7	Confident	87.5	Confident	51 Å²	51	57.7 Å²	57.7	36%	0.357	32%	0.318	S	S	.	.			trans	-82.1	127.8	179.8	-178.4	0	0	0	0	111.9	Y444 T445 E451	Y444-S449 CarbonylContact C-O 3.56Å; Y444-S449 VanDerWaalsContact CA-O 3.23Å; Y444-S449 WeakPolarHBondContact CA-O 3.41Å; T445-S449 WeakPolarHBondContact CG2-O 3.25Å; T445-S449 PolarHBondContact N-O 2.98Å; T445-S449 VanDerWaalsContact OG1-CB 3.31Å; T445-S449 WeakPolarHBondContact OG1-CB 3.45Å; T445-S449 PolarHBondContact OG1-N 3.31Å; T445-S449 PolarHBondContact OG1-O 3.35Å; S449-E451 PolarHBondContact O-N 2.79Å; S449-E451 PolarHBondContact OG-N 2.85Å; S449-E451 VanDerWaalsContact OG-N 3.1Å
450	H	83.8	Confident	87.2	Confident	116 Å²	116	63.6 Å²	63.6	54%	0.537	35%	0.354	S	S	.	.	S	Bend	trans	-70.5	-10.9	170	-65.6	79.1	0	0	0	113.6	S442 A443 L452	S442-H450 PolarHBondContact OG-NE2 2.89Å; A443-H450 PolarHBondContact O-CD2 2.79Å; H450-L452 PolarHBondContact O-N 3.4Å
451	E	85.3	Confident	87	Confident	107 Å²	107	64.9 Å²	64.9	50%	0.5	37%	0.366	S	S	.	.			trans	-85.4	109.7	175.1	-163.7	-178.9	-178.6	0	0	110.2	T445 S449 I453	T445-E451 WeakPolarHBondContact CG2-O 3.27Å; S449-E451 PolarHBondContact O-N 2.79Å; S449-E451 PolarHBondContact OG-N 2.85Å; S449-E451 VanDerWaalsContact OG-N 3.1Å; E451-I453 HydrophobicContact CG-CD1 4.04Å; E451-I453 HydrophobicContact CG-CG1 3.93Å
452	L	90.5	Very high	86.8	Confident	3 Å²	3	67.9 Å²	67.9	2%	0.016	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	112.6	-177.2	-53.1	-177.4	0	0	0	109.1	T445 H450 F467 A468 M532 A566 I568 H569	T445-L452 HydrophobicContact CG2-CD2 4.03Å; H450-L452 PolarHBondContact O-N 3.4Å; L452-F467 HydrophobicContact CB-CD2 4.24Å; L452-F467 HydrophobicContact CB-CE2 3.99Å; L452-F467 HydrophobicContact CD1-CE2 4.06Å; L452-F467 HydrophobicContact CG-CE2 4.44Å; L452-A468 HydrophobicContact CD2-CB 3.71Å; L452-M532 HydrophobicContact CD1-CE 3.62Å; L452-A566 HydrophobicContact CD1-CB 3.94Å; L452-I568 HydrophobicContact CB-CB 4.39Å; L452-I568 HydrophobicContact CB-CG1 4.02Å; L452-I568 HydrophobicContact CB-CG2 4.38Å; L452-I568 HydrophobicContact CD1-CG1 4.19Å; L452-I568 CarbonylContact O-C 3.54Å; L452-I568 VanDerWaalsContact O-CA 3.31Å; L452-I568 WeakPolarHBondContact O-CA 3.43Å; L452-H569 PolarHBondContact O-N 2.79Å
453	I	88.8	Confident	86.7	Confident	84 Å²	84	69 Å²	69	43%	0.431	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	140.3	-172.2	-55.5	173.5	0	0	0	111.1	E451 H569 A571	E451-I453 HydrophobicContact CG-CD1 4.04Å; E451-I453 HydrophobicContact CG-CG1 3.93Å; I453-H569 WeakPolarHBondContact CA-O 3.24Å; I453-A571 HydrophobicContact CG2-CB 4.12Å
454	I	90.6	Very high	86.6	Confident	14 Å²	14	73.4 Å²	73.4	7%	0.072	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	132.1	170.9	-57.2	177.4	0	0	0	108.2	L458 A534 F538 I568 H569 I570 A571	I454-L458 HydrophobicContact CG2-CD1 3.73Å; I454-A534 HydrophobicContact CD1-CB 3.93Å; I454-F538 HydrophobicContact CD1-CE2 4.06Å; I454-F538 HydrophobicContact CG2-CD2 4.09Å; I454-F538 HydrophobicContact CG2-CE2 4.47Å; I454-I568 HydrophobicContact CD1-CG2 3.76Å; I454-I568 HydrophobicContact CG1-CG2 3.89Å; I454-H569 PolarHBondContact N-O 2.64Å; I454-I570 HydrophobicContact CB-CD1 4.22Å; I454-I570 VanDerWaalsContact O-CA 3.26Å; I454-I570 WeakPolarHBondContact O-CA 3.39Å; I454-A571 PolarHBondContact O-N 3.1Å
455	Q	88.1	Confident	86.5	Confident	115 Å²	115	73.7 Å²	73.7	54%	0.537	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	144.2	178.1	-169.7	176.1	2.4	0	0	111.5	L458	Q455-L458 HydrophobicContact CB-CD2 4.26Å; Q455-L458 HydrophobicContact CB-CG 4.35Å; Q455-L458 WeakPolarHBondContact O-CG 3.32Å
456	E	90.6	Very high	86.7	Confident	6 Å²	6	76.3 Å²	76.3	3%	0.028	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	156	172.2	76.9	-175.4	138.8	0	0	112.8	L458 R540 I570 A571 D572 I573	E456-L458 VanDerWaalsContact C-N 3.31Å; E456-L458 PolarHBondContact O-N 2.92Å; E456-R540 WeakPolarHBondContact OE2-CB 2.76Å; E456-R540 PolarHBondContact OE2-N 3.2Å; E456-I570 HydrophobicContact CB-CG2 3.78Å; E456-A571 WeakPolarHBondContact CB-O 2.99Å; E456-A571 WeakPolarHBondContact CG-O 3.06Å; E456-A571 PolarHBondContact N-O 3.48Å; E456-D572 VanDerWaalsContact OE1-CA 3.3Å; E456-D572 WeakPolarHBondContact OE1-CA 3.23Å; E456-I573 HydrophobicContact CG-CD1 4.34Å; E456-I573 HydrophobicContact CG-CG1 4.5Å; E456-I573 PolarHBondContact OE1-N 2.66Å
457	H	87.1	Confident	87	Confident	118 Å²	118	73.1 Å²	73.1	55%	0.546	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	31.7	176.5	-59.9	-42.1	0	0	0	115.4	F538 D539	H457-F538 PolarHBondContact N-O 2.94Å; H457-D539 IonicContact CE1-OD2 3.04Å
458	L	86.7	Confident	87.5	Confident	38 Å²	38	65.6 Å²	65.6	20%	0.199	37%	0.368	C	S	.	.			trans	-62	137.5	173	-75	176.7	0	0	0	112.4	I454 Q455 E456 I462 S537	I454-L458 HydrophobicContact CG2-CD1 3.73Å; Q455-L458 HydrophobicContact CB-CD2 4.26Å; Q455-L458 HydrophobicContact CB-CG 4.35Å; Q455-L458 WeakPolarHBondContact O-CG 3.32Å; E456-L458 VanDerWaalsContact C-N 3.31Å; E456-L458 PolarHBondContact O-N 2.92Å; L458-I462 HydrophobicContact CB-CD1 4.35Å; L458-I462 HydrophobicContact CD2-CD1 4.2Å; L458-S537 PolarHBondContact N-OG 3.28Å; L458-S537 PolarHBondContact O-OG 3.11Å
459	P	86.2	Confident	88	Confident	80 Å²	80	65.2 Å²	65.2	52%	0.519	36%	0.356	S	S	.	.			trans	-66.6	143.4	179.5	-17.5	29.5	0	0	0	113.1	S461 I462	P459-S461 PolarHBondContact O-N 2.96Å; P459-S461 VanDerWaalsContact O-N 3.09Å; P459-I462 WeakPolarHBondContact O-CG1 3.45Å
460	V	82.6	Confident	88.3	Confident	125 Å²	125	62.9 Å²	62.9	76%	0.758	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-63.6	-19	-176.3	-178.9	0	0	0	0	114.3	I462 F463	V460-I462 VanDerWaalsContact C-N 3.27Å; V460-I462 PolarHBondContact O-N 2.91Å; V460-F463 WeakPolarHBondContact O-CD2 2.91Å
461	S	86.3	Confident	88.6	Confident	111 Å²	111	58.1 Å²	58.1	78%	0.776	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-75.3	-0.1	-172	55.6	0	0	0	0	116.3	P459	P459-S461 PolarHBondContact O-N 2.96Å; P459-S461 VanDerWaalsContact O-N 3.09Å
462	I	87.8	Confident	88.9	Confident	80 Å²	80	53.1 Å²	53.1	41%	0.41	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-113.9	1.7	-168.6	68.1	-179.1	0	0	0	115.4	L458 P459 V460 V465	L458-I462 HydrophobicContact CB-CD1 4.35Å; L458-I462 HydrophobicContact CD2-CD1 4.2Å; P459-I462 WeakPolarHBondContact O-CG1 3.45Å; V460-I462 VanDerWaalsContact C-N 3.27Å; V460-I462 PolarHBondContact O-N 2.91Å; I462-V465 HydrophobicContact CB-CG2 4.44Å; I462-V465 HydrophobicContact CD1-CG2 4.17Å; I462-V465 HydrophobicContact CG1-CG2 3.84Å; I462-V465 VanDerWaalsContact O-CG2 3.29Å; I462-V465 WeakPolarHBondContact O-CG2 3.1Å
463	F	86.5	Confident	88.8	Confident	52 Å²	52	56 Å²	56	23%	0.228	31%	0.314	C	S	.	.			trans	-83.8	146.3	-176.1	-63	-68.9	0	0	0	113.4	V460 V465 V536	V460-F463 WeakPolarHBondContact O-CD2 2.91Å; F463-V465 HydrophobicContact CD1-CG2 3.85Å; F463-V465 HydrophobicContact CE1-CG2 4.12Å; F463-V536 WeakPolarHBondContact CE1-O 3.29Å; F463-V536 WeakPolarHBondContact CZ-O 3.47Å
464	P	88.5	Confident	88.7	Confident	91 Å²	91	52.5 Å²	52.5	59%	0.591	30%	0.296	S	S	*	.	S	Bend	cis	-76.7	144.8	-0.4	32.2	-35.2	0	0	0	113.2	A534 V535	P464-A534 CarbonylContact C-O 3.5Å; P464-A534 VanDerWaalsContact CA-O 3.27Å; P464-A534 WeakPolarHBondContact CA-O 3.39Å; P464-V535 HydrophobicContact CB-CG1 4.2Å
465	V	89.7	Confident	88.4	Confident	47 Å²	47	56 Å²	56	29%	0.285	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	114	-179.9	179.5	0	0	0	0	109.7	I462 F463 F467 S533 A534	I462-V465 HydrophobicContact CB-CG2 4.44Å; I462-V465 HydrophobicContact CD1-CG2 4.17Å; I462-V465 HydrophobicContact CG1-CG2 3.84Å; I462-V465 VanDerWaalsContact O-CG2 3.29Å; I462-V465 WeakPolarHBondContact O-CG2 3.1Å; F463-V465 HydrophobicContact CD1-CG2 3.85Å; F463-V465 HydrophobicContact CE1-CG2 4.12Å; V465-F467 PolarHBondContact O-N 3.3Å; V465-S533 CarbonylContact O-C 3.6Å; V465-S533 WeakPolarHBondContact O-CA 3.37Å; V465-A534 PolarHBondContact N-O 2.95Å; V465-A534 PolarHBondContact O-N 3.16Å
466	D	90.4	Very high	88.3	Confident	79 Å²	79	50.6 Å²	50.6	42%	0.422	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	128.7	172.5	-67.6	-23.1	0	0	0	109.8	K531 S533	D466-K531 IonicContact OD1-NZ 3.08Å; D466-K531 PolarHBondContact OD1-NZ 2.86Å; D466-K531 WeakPolarHBondContact OD2-CE 3.47Å; D466-K531 IonicContact OD2-NZ 2.74Å; D466-K531 PolarHBondContact OD2-NZ 3.45Å; D466-S533 VanDerWaalsContact OD1-CB 3.31Å; D466-S533 WeakPolarHBondContact OD1-CB 3.45Å; D466-S533 PolarHBondContact OD1-OG 3.31Å
467	F	90.5	Very high	87.8	Confident	18 Å²	18	53.3 Å²	53.3	8%	0.079	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	-13	-178.9	73.1	-82.8	0	0	0	114.7	P446 L452 V465 F495 M532 A534 I568	P446-F467 WeakPolarHBondContact CD-O 3.47Å; L452-F467 HydrophobicContact CB-CD2 4.24Å; L452-F467 HydrophobicContact CB-CE2 3.99Å; L452-F467 HydrophobicContact CD1-CE2 4.06Å; L452-F467 HydrophobicContact CG-CE2 4.44Å; V465-F467 PolarHBondContact O-N 3.3Å; F467-F495 AromaticContact CE1-CD1 3.69Å; F467-F495 HydrophobicContact CE1-CD1 3.69Å; F467-F495 HydrophobicContact CE1-CE1 4.01Å; F467-F495 AromaticContact CZ-CD1 3.73Å; F467-F495 HydrophobicContact CZ-CD1 3.73Å; F467-F495 AromaticContact CZ-CE1 3.8Å; F467-F495 HydrophobicContact CZ-CE1 3.8Å; F467-M532 HydrophobicContact CE1-CG 4.05Å; F467-M532 HydrophobicContact CE2-CE 3.77Å; F467-M532 HydrophobicContact CZ-CE 3.68Å; F467-M532 HydrophobicContact CZ-CG 3.98Å; F467-M532 HydrophobicContact CZ-SD 4.19Å; F467-M532 PolarHBondContact N-O 3.25Å; F467-M532 VanDerWaalsContact N-O 3.1Å; F467-A534 HydrophobicContact CD1-CB 3.88Å; F467-A534 HydrophobicContact CE1-CB 3.9Å; F467-I568 HydrophobicContact CE2-CG1 3.94Å; F467-I568 HydrophobicContact CE2-CG2 4.4Å; F467-I568 HydrophobicContact CZ-CG1 4.21Å
468	A	91.9	Very high	87.4	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.008	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	166.7	-176.7	0	0	0	0	0	115.5	Y444 L452 M532	Y444-A468 CarbonylContact O-C 3.49Å; Y444-A468 WeakPolarHBondContact O-CA 3.18Å; L452-A468 HydrophobicContact CD2-CB 3.71Å; A468-M532 HydrophobicContact CB-CB 4.13Å; A468-M532 HydrophobicContact CB-CE 3.58Å; A468-M532 PolarHBondContact N-O 2.74Å; A468-M532 VanDerWaalsContact N-O 3.15Å; A468-M532 PolarHBondContact O-N 2.85Å
469	L	91.3	Very high	87.2	Confident	34 Å²	34	55 Å²	55	18%	0.178	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	158.3	175.4	-64.2	178.1	0	0	0	109.5	A443 Y444 I500 Y530 K531	A443-L469 CarbonylContact C-O 3.46Å; A443-L469 VanDerWaalsContact CA-O 3.27Å; A443-L469 WeakPolarHBondContact CA-O 3.37Å; Y444-L469 HydrophobicContact CD2-CB 4.01Å; Y444-L469 HydrophobicContact CD2-CD1 4.38Å; Y444-L469 HydrophobicContact CE1-CB 4.36Å; Y444-L469 HydrophobicContact CE2-CB 3.64Å; Y444-L469 HydrophobicContact CE2-CD1 3.73Å; Y444-L469 HydrophobicContact CE2-CG 4.31Å; Y444-L469 PolarHBondContact N-O 2.81Å; Y444-L469 WeakPolarHBondContact O-CA 3.39Å; Y444-L469 PolarHBondContact O-N 2.78Å; L469-I500 HydrophobicContact CD2-CD1 3.72Å; L469-Y530 CarbonylContact C-O 3.57Å; L469-Y530 WeakPolarHBondContact CA-O 3.37Å; L469-K531 HydrophobicContact CD2-CB 4.07Å; L469-K531 HydrophobicContact CD2-CG 4.21Å
470	V	91.6	Very high	87	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.006	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	128.1	-179.9	-175.9	0	0	0	0	110.8	I441 S442 A443 L497 I529 Y530 I550	I441-V470 HydrophobicContact CG2-CG1 3.9Å; S442-V470 CarbonylContact O-C 3.5Å; S442-V470 WeakPolarHBondContact O-CA 3.32Å; S442-V470 WeakPolarHBondContact O-CG1 3.13Å; A443-V470 HydrophobicContact CB-CG2 4.06Å; V470-L497 HydrophobicContact CB-CD1 4.49Å; V470-L497 HydrophobicContact CG2-CD1 3.84Å; V470-I529 CarbonylContact O-C 3.48Å; V470-I529 VanDerWaalsContact O-CA 3.3Å; V470-I529 WeakPolarHBondContact O-CA 3.22Å; V470-Y530 PolarHBondContact N-O 2.77Å; V470-Y530 PolarHBondContact O-N 3.15Å; V470-I550 HydrophobicContact CG1-CD1 4.13Å; V470-I550 HydrophobicContact CG2-CD1 3.83Å
471	S	90.3	Very high	86.9	Confident	17 Å²	17	47.2 Å²	47.2	12%	0.119	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	156	-179	69.6	0	0	0	0	115.1	I441 S442 Y444 I528	I441-S471 CarbonylContact C-O 3.58Å; I441-S471 WeakPolarHBondContact CA-O 3.22Å; S442-S471 PolarHBondContact N-O 3.29Å; S442-S471 PolarHBondContact O-N 3.11Å; Y444-S471 WeakPolarHBondContact CE1-OG 3.45Å; S471-I528 CarbonylContact C-O 3.38Å; S471-I528 WeakPolarHBondContact CA-O 3.3Å
472	V	90.3	Very high	86.7	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.012	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	135.8	-173	-164.1	0	0	0	0	114.5	V440 V483 C485 I528 C552	V440-V472 WeakPolarHBondContact O-CA 3.28Å; V440-V472 WeakPolarHBondContact O-CG1 3.18Å; V472-V483 HydrophobicContact CG1-CB 4.27Å; V472-V483 HydrophobicContact CG1-CG1 3.54Å; V472-C485 VanDerWaalsContact CG2-SG 3.6Å; V472-I528 HydrophobicContact CB-CB 4.28Å; V472-I528 PolarHBondContact N-O 3.11Å; V472-I528 PolarHBondContact O-N 2.92Å; V472-I528 VanDerWaalsContact O-N 3.17Å; V472-C552 HydrophobicContact CG1-CB 4.37Å
473	T	88.9	Confident	86.6	Confident	63 Å²	63	44 Å²	44	39%	0.387	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	164.6	-179.5	60.1	0	0	0	0	115	P439 V440 L527	P439-T473 CarbonylContact C-O 3.55Å; P439-T473 WeakPolarHBondContact CA-O 3.36Å; V440-T473 PolarHBondContact N-O 2.8Å; V440-T473 PolarHBondContact O-N 2.7Å; V440-T473 VanDerWaalsContact O-N 3.09Å; T473-L527 HydrophobicContact CG2-CD1 3.44Å; T473-L527 VanDerWaalsContact CG2-CD1 3.44Å
474	D	86.9	Confident	86.7	Confident	10 Å²	10	49.5 Å²	49.5	5%	0.053	27%	0.268	C	S	.	.			trans	-147.6	143.3	172.3	-155.8	-46.4	0	0	0	111.1	P439 V483	P439-D474 WeakPolarHBondContact CD-OD2 3.45Å; D474-V483 HydrophobicContact CB-CG2 3.95Å
475	D	84.3	Confident	86.8	Confident	87 Å²	87	46.1 Å²	46.1	47%	0.465	25%	0.246	S	C	.	.			trans	-107.1	-8.4	-157.9	-114.7	-3.9	0	0	0	115.5	K366 H437	K366-D475 IonicContact NZ-OD1 3.43Å; K366-D475 PolarHBondContact NZ-OD1 2.95Å; K366-D475 IonicContact NZ-OD2 3.39Å; K366-D475 PolarHBondContact NZ-OD2 2.99Å; H437-D475 HydrophobicContact CB-CB 3.9Å
476	D	85.5	Confident	86.9	Confident	3 Å²	3	49.5 Å²	49.5	2%	0.016	26%	0.259	C	S	.	.	S	Bend	trans	-81.7	161	176.9	-70.8	-36.9	0	0	0	112.7	N435 N436 H437 N480	N435-D476 PolarHBondContact OD1-OD2 2.7Å; N436-D476 PolarHBondContact N-OD1 2.99Å; N436-D476 PolarHBondContact N-OD2 2.97Å; N436-D476 PolarHBondContact OD1-OD1 2.87Å; H437-D476 IonicContact CE1-OD1 3.99Å; H437-D476 IonicContact CG-OD1 3.65Å; H437-D476 PolarHBondContact N-OD1 3.05Å; H437-D476 PolarHBondContact N-OD2 3.41Å; H437-D476 IonicContact ND1-OD1 3.4Å; H437-D476 PolarHBondContact ND1-OD1 3.48Å; D476-N480 HydrophobicContact CB-CB 3.3Å
477	S	80.8	Confident	87	Confident	62 Å²	62	48.1 Å²	48.1	43%	0.434	25%	0.251	S	S	.	.	S	Bend	trans	-88.4	147.7	177.8	-72.6	0	0	0	0	113.3	N480	S477-N480 WeakPolarHBondContact O-CB 3.35Å
478	G	79.4	Confident	86.8	Confident	34 Å²	34	50.2 Å²	50.2	35%	0.351	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	77.2	-142.3	175.6	0	0	0	0	0	113.7	N480 G481 T524	G478-N480 PolarHBondContact O-N 2.88Å; G478-G481 PolarHBondContact O-N 2.74Å; G478-T524 VanDerWaalsContact O-CG2 3.28Å; G478-T524 WeakPolarHBondContact O-CG2 3.22Å
479	R	81.3	Confident	86.5	Confident	157 Å²	157	60.7 Å²	60.7	59%	0.592	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-64.4	-19	178.4	-72.2	-173.4	62	176.5	-7	113.7	G481 L555 G556	R479-G481 PolarHBondContact O-N 3.04Å; R479-L555 CarbonylContact O-C 3.59Å; R479-G556 PolarHBondContact O-N 3.28Å
480	N	83	Confident	86.1	Confident	31 Å²	31	65.2 Å²	65.2	17%	0.166	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-64.3	-13	177.4	-61.5	-17.6	0	0	0	112.2	N435 D476 S477 G478	N435-N480 HydrophobicContact CB-CB 4.21Å; N435-N480 VanDerWaalsContact CB-CG 3.44Å; N435-N480 WeakPolarHBondContact CB-ND2 3.41Å; N435-N480 VanDerWaalsContact CG-CG 3.4Å; N435-N480 WeakPolarHBondContact OD1-CB 3.38Å; N435-N480 VanDerWaalsContact OD1-CG 3.31Å; D476-N480 HydrophobicContact CB-CB 3.3Å; S477-N480 WeakPolarHBondContact O-CB 3.35Å; G478-N480 PolarHBondContact O-N 2.88Å
481	G	79.6	Confident	86.1	Confident	11 Å²	11	65.4 Å²	65.4	11%	0.113	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-121.7	32.8	-174	0	0	0	0	0	119.9	G478 R479	G478-G481 PolarHBondContact O-N 2.74Å; R479-G481 PolarHBondContact O-N 3.04Å
482	Q	81.2	Confident	85.9	Confident	95 Å²	95	68 Å²	68	44%	0.444	35%	0.346	S	S	.	.			trans	-119.3	139.4	-179.3	-68	-178.4	-20.3	0	0	113.7	D554 L555	Q482-D554 CarbonylContact O-C 3.59Å; Q482-D554 WeakPolarHBondContact O-CA 3.43Å; Q482-L555 HydrophobicContact CB-CB 4.21Å; Q482-L555 HydrophobicContact CB-CD1 3.78Å; Q482-L555 HydrophobicContact CB-CG 4.11Å; Q482-L555 WeakPolarHBondContact O-CG 3.38Å; Q482-L555 PolarHBondContact O-N 2.67Å; Q482-L555 VanDerWaalsContact O-N 3.08Å
483	V	87.2	Confident	85.8	Confident	29 Å²	29	73.9 Å²	73.9	18%	0.176	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	159.8	-161.3	-169.7	0	0	0	0	119.3	P439 V472 D474 I528 C552 T553	P439-V483 HydrophobicContact CB-CG1 3.79Å; P439-V483 HydrophobicContact CB-CG2 4.07Å; P439-V483 HydrophobicContact CG-CG1 4Å; P439-V483 HydrophobicContact CG-CG2 3.97Å; V472-V483 HydrophobicContact CG1-CB 4.27Å; V472-V483 HydrophobicContact CG1-CG1 3.54Å; D474-V483 HydrophobicContact CB-CG2 3.95Å; V483-I528 HydrophobicContact CB-CD1 4Å; V483-I528 WeakPolarHBondContact O-CD1 3.46Å; V483-C552 HydrophobicContact CG1-CB 4.11Å; V483-T553 CarbonylContact C-O 3.49Å; V483-T553 VanDerWaalsContact CA-O 3.27Å; V483-T553 WeakPolarHBondContact CA-O 3.29Å
484	K	87.5	Confident	85.9	Confident	167 Å²	167	73.7 Å²	73.7	73%	0.726	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.1	146.1	176.1	177.2	-175.5	175.7	-172.9	0	117.2	C552 T553	K484-C552 CarbonylContact O-C 3.57Å; K484-C552 WeakPolarHBondContact O-CA 3.36Å; K484-T553 PolarHBondContact N-O 3.47Å; K484-T553 VanDerWaalsContact N-O 3.07Å; K484-T553 PolarHBondContact O-N 3.07Å
485	C	91.6	Very high	86.2	Confident	21 Å²	21	73.5 Å²	73.5	14%	0.142	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	161.8	-174.1	-46.9	0	0	0	0	123.6	V472 Y530 R551 C552	V472-C485 VanDerWaalsContact CG2-SG 3.6Å; C485-Y530 HydrophobicContact CB-CE2 4.03Å; C485-R551 CarbonylContact C-O 3.56Å; C485-R551 WeakPolarHBondContact CA-O 3.49Å; C485-R551 VanDerWaalsContact CB-O 3.3Å; C485-R551 WeakPolarHBondContact CB-O 3.31Å; C485-C552 HydrophobicContact CB-CB 4.11Å; C485-C552 WeakPolarHBondContact CB-SG 3.27Å; C485-C552 WeakPolarHBondContact SG-CB 3.27Å; C485-C552 CovalentContact SG-SG 2.02Å; C485-C552 PolarHBondContact SG-SG 2.79Å
486	E	91.6	Very high	86.5	Confident	118 Å²	118	75.7 Å²	75.7	55%	0.551	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-155.8	165.7	-179.4	65.8	-175.8	-175.3	0	0	119.3	I550 R551	E486-I550 CarbonylContact O-C 3.53Å; E486-I550 VanDerWaalsContact O-CA 3.3Å; E486-I550 WeakPolarHBondContact O-CA 3.34Å; E486-R551 HydrophobicContact CG-CB 4.22Å; E486-R551 PolarHBondContact N-O 2.74Å; E486-R551 PolarHBondContact O-N 2.71Å
487	L	91.7	Very high	86.8	Confident	49 Å²	49	77.3 Å²	77.3	26%	0.257	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	152.5	176.6	-89.8	-178.8	0	0	0	114.7	L497 T549 I550	L487-L497 HydrophobicContact CD1-CB 3.5Å; L487-L497 VanDerWaalsContact CD1-CB 3.5Å; L487-L497 HydrophobicContact CG-CB 3.71Å; L487-L497 HydrophobicContact CG-CD2 4.12Å; L487-L497 HydrophobicContact CG-CG 4.48Å; L487-T549 VanDerWaalsContact CD2-O 3.25Å; L487-T549 WeakPolarHBondContact CD2-O 3.34Å; L487-I550 HydrophobicContact CD2-CG1 3.74Å
488	D	87.7	Confident	87.2	Confident	62 Å²	62	77.1 Å²	77.1	33%	0.332	38%	0.383	S	S	.	.			trans	-80.8	172.5	175.1	101.5	-32.9	0	0	0	115.7	N490 S491 T549	D488-N490 PolarHBondContact OD1-N 3.34Å; D488-S491 WeakPolarHBondContact OD1-CB 2.91Å; D488-S491 PolarHBondContact OD1-N 3.4Å; D488-S491 PolarHBondContact OD1-OG 2.74Å; D488-T549 HydrophobicContact CB-CG2 4.37Å; D488-T549 PolarHBondContact N-O 3.4Å
489	R	84.6	Confident	87.5	Confident	222 Å²	222	79.6 Å²	79.6	84%	0.838	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-46.5	-174.6	-72.6	-173.1	-176.8	-177.3	1.8	114.6	S492	R489-S492 PolarHBondContact O-N 3.01Å; R489-S492 PolarHBondContact O-OG 3.48Å
490	N	84.2	Confident	87.6	Confident	128 Å²	128	76.5 Å²	76.5	68%	0.684	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-34.2	-174.9	-72.9	-8.7	0	0	0	111.9	D488 S492 D493	D488-N490 PolarHBondContact OD1-N 3.34Å; N490-S492 PolarHBondContact O-N 3.39Å; N490-D493 PolarHBondContact O-N 2.69Å
491	S	89.6	Confident	87.2	Confident	5 Å²	5	76.3 Å²	76.3	4%	0.035	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-65.4	-25.7	177.3	-51.4	0	0	0	0	112	D488 D493 L494 F495 A548 T549	D488-S491 WeakPolarHBondContact OD1-CB 2.91Å; D488-S491 PolarHBondContact OD1-N 3.4Å; D488-S491 PolarHBondContact OD1-OG 2.74Å; S491-D493 VanDerWaalsContact C-N 3.26Å; S491-D493 PolarHBondContact O-N 2.73Å; S491-L494 PolarHBondContact O-N 2.71Å; S491-F495 WeakPolarHBondContact O-CA 3.14Å; S491-F495 WeakPolarHBondContact O-CB 3.33Å; S491-F495 PolarHBondContact O-N 3.08Å; S491-A548 VanDerWaalsContact OG-CA 3.22Å; S491-A548 WeakPolarHBondContact OG-CA 3.43Å; S491-T549 PolarHBondContact OG-N 2.98Å
492	S	87.1	Confident	86.8	Confident	71 Å²	71	83.3 Å²	83.3	50%	0.497	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-70.6	-15.1	-176.9	74.6	0	0	0	0	114.8	R489 N490	R489-S492 PolarHBondContact O-N 3.01Å; R489-S492 PolarHBondContact O-OG 3.48Å; N490-S492 PolarHBondContact O-N 3.39Å
493	D	87.4	Confident	85.5	Confident	126 Å²	126	84.4 Å²	84.4	67%	0.674	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-82.7	-24.7	174.5	-71.6	-25.3	0	0	0	112.9	N490 S491 V535	N490-D493 PolarHBondContact O-N 2.69Å; S491-D493 VanDerWaalsContact C-N 3.26Å; S491-D493 PolarHBondContact O-N 2.73Å; D493-V535 WeakPolarHBondContact O-CG2 3.5Å
494	L	90.8	Very high	83.7	Confident	60 Å²	60	86 Å²	86	31%	0.314	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-23.7	-177.9	-60.3	176.8	0	0	0	112.7	S491 V535 V536	S491-L494 PolarHBondContact O-N 2.71Å; L494-V535 WeakPolarHBondContact O-CG2 3.03Å; L494-V535 PolarHBondContact O-N 2.87Å; L494-V536 HydrophobicContact CD2-CG2 4.13Å
495	F	93.4	Very high	81.5	Confident	6 Å²	6	84.2 Å²	84.2	3%	0.026	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	165.2	-169.3	-48.7	-70.6	0	0	0	114.5	F467 S491 S533 A534 V546 Y547 A548 I568	F467-F495 AromaticContact CE1-CD1 3.69Å; F467-F495 HydrophobicContact CE1-CD1 3.69Å; F467-F495 HydrophobicContact CE1-CE1 4.01Å; F467-F495 AromaticContact CZ-CD1 3.73Å; F467-F495 HydrophobicContact CZ-CD1 3.73Å; F467-F495 AromaticContact CZ-CE1 3.8Å; F467-F495 HydrophobicContact CZ-CE1 3.8Å; S491-F495 WeakPolarHBondContact O-CA 3.14Å; S491-F495 WeakPolarHBondContact O-CB 3.33Å; S491-F495 PolarHBondContact O-N 3.08Å; F495-S533 CarbonylContact C-O 3.53Å; F495-S533 WeakPolarHBondContact CA-O 3.39Å; F495-A534 HydrophobicContact CD1-CB 4.41Å; F495-A534 HydrophobicContact CE1-CB 4.43Å; F495-V546 HydrophobicContact CZ-CG2 4.08Å; F495-Y547 WeakPolarHBondContact CE2-O 3.31Å; F495-A548 HydrophobicContact CD2-CB 3.64Å; F495-A548 HydrophobicContact CE2-CB 3.89Å; F495-A548 HydrophobicContact CG-CB 4.4Å; F495-I568 HydrophobicContact CE1-CD1 4.3Å; F495-I568 HydrophobicContact CE1-CG1 4.49Å; F495-I568 HydrophobicContact CE2-CD1 4.08Å; F495-I568 HydrophobicContact CZ-CD1 3.69Å; F495-I568 HydrophobicContact CZ-CG1 4.27Å
496	K	91.9	Very high	78.9	Confident	132 Å²	132	85.9 Å²	85.9	57%	0.574	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.6	137.7	178.5	-177.6	-179.4	178.5	-178	0	112.6	M532 S533	K496-M532 VanDerWaalsContact O-CA 3.26Å; K496-M532 WeakPolarHBondContact O-CA 3.26Å; K496-S533 PolarHBondContact N-O 2.47Å; K496-S533 VanDerWaalsContact N-O 3.13Å; K496-S533 PolarHBondContact O-N 3.16Å; K496-S533 VanDerWaalsContact O-N 3.13Å
497	L	90.8	Very high	76.1	Confident	37 Å²	37	87.9 Å²	87.9	19%	0.194	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	137	179.1	-169.4	74	0	0	0	113.4	V470 L487 Y530 K531 M532	V470-L497 HydrophobicContact CB-CD1 4.49Å; V470-L497 HydrophobicContact CG2-CD1 3.84Å; L487-L497 HydrophobicContact CD1-CB 3.5Å; L487-L497 VanDerWaalsContact CD1-CB 3.5Å; L487-L497 HydrophobicContact CG-CB 3.71Å; L487-L497 HydrophobicContact CG-CD2 4.12Å; L487-L497 HydrophobicContact CG-CG 4.48Å; L497-Y530 HydrophobicContact CD1-CG 4.46Å; L497-Y530 HydrophobicContact CD2-CD1 4.1Å; L497-Y530 HydrophobicContact CD2-CG 4.41Å; L497-Y530 HydrophobicContact CG-CD1 4.12Å; L497-Y530 HydrophobicContact CG-CG 4.38Å; L497-K531 CarbonylContact C-O 3.38Å; L497-K531 VanDerWaalsContact CA-O 3.3Å; L497-K531 WeakPolarHBondContact CA-O 3.18Å; L497-M532 HydrophobicContact CD1-CB 4.39Å
498	T	89	Confident	73.6	Confident	59 Å²	59	94.6 Å²	94.6	36%	0.362	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	126.6	-176	-50.1	0	0	0	0	112.7	Y530 K531	T498-Y530 CarbonylContact O-C 3.58Å; T498-Y530 WeakPolarHBondContact O-CA 3.16Å; T498-K531 PolarHBondContact N-O 2.88Å; T498-K531 PolarHBondContact O-N 3.45Å
499	L	86.3	Confident	71	Confident	85 Å²	85	100.2 Å²	100.2	45%	0.445	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	135.9	177.2	179.7	70.9	0	0	0	111.4	I528 I529 Y530	L499-I528 HydrophobicContact CD1-CG2 4.04Å; L499-I529 WeakPolarHBondContact CD1-O 3.39Å; L499-Y530 HydrophobicContact CB-CD1 3.87Å; L499-Y530 HydrophobicContact CB-CE1 3.86Å; L499-Y530 HydrophobicContact CD1-CD1 4.07Å; L499-Y530 HydrophobicContact CD1-CD2 4.35Å; L499-Y530 HydrophobicContact CD1-CE1 3.79Å; L499-Y530 HydrophobicContact CD1-CE2 4.09Å; L499-Y530 HydrophobicContact CD1-CG 4.33Å; L499-Y530 HydrophobicContact CG-CE1 4.41Å
500	I	82.9	Confident	68.8	Low	92 Å²	92	96.2 Å²	96.2	47%	0.472	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	-18.9	-177.5	61.8	169.9	0	0	0	116	L469 I529 K531	L469-I500 HydrophobicContact CD2-CD1 3.72Å; I500-I529 HydrophobicContact CD1-CB 4.36Å; I500-I529 HydrophobicContact CD1-CG2 3.64Å; I500-I529 HydrophobicContact CG1-CB 3.95Å; I500-I529 HydrophobicContact CG1-CG2 3.73Å; I500-I529 VanDerWaalsContact CG1-O 3.25Å; I500-I529 WeakPolarHBondContact CG1-O 3.22Å; I500-I529 PolarHBondContact N-O 2.93Å; I500-K531 HydrophobicContact CG2-CB 4Å
501	G	76.1	Confident	66.4	Low	27 Å²	27	94.3 Å²	94.3	28%	0.278	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	163.9	-178.9	173.7	0	0	0	0	0	116.4	I529	G501-I529 PolarHBondContact N-O 2.78Å; G501-I529 PolarHBondContact O-N 2.97Å
502	Y	69.9	Low	63.8	Low	159 Å²	159	101.5 Å²	101.5	62%	0.624	57%	0.569	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-118.7	134.5	170.1	-56.1	-89.8	0	0	0	108.9	L527 I528	Y502-L527 CarbonylContact C-O 3.53Å; Y502-L527 VanDerWaalsContact CA-O 3.28Å; Y502-L527 WeakPolarHBondContact CA-O 3.49Å; Y502-I528 HydrophobicContact CD1-CB 4.4Å; Y502-I528 HydrophobicContact CD1-CG1 3.86Å; Y502-I528 HydrophobicContact CD1-CG2 4.33Å; Y502-I528 HydrophobicContact CE1-CB 4.47Å; Y502-I528 HydrophobicContact CE1-CD1 4.26Å; Y502-I528 HydrophobicContact CE1-CG1 3.9Å; Y502-I528 HydrophobicContact CE1-CG2 4.05Å
503	E	54.2	Low	61.3	Low	117 Å²	117	105.3 Å²	105.3	55%	0.547	58%	0.584	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.2	107.5	-179.7	-157.2	169.7	-153.4	0	0	109.5	L527 I529	E503-L527 HydrophobicContact CB-CB 4.18Å; E503-L527 HydrophobicContact CB-CD2 4.29Å; E503-L527 PolarHBondContact N-O 3.19Å; E503-L527 PolarHBondContact O-N 3.49Å; E503-I529 HydrophobicContact CB-CD1 4.36Å
504	S	49.7	Very low	58.7	Low	63 Å²	63	110.8 Å²	110.8	44%	0.441	60%	0.597	S	S	.	*			trans	-86.3	139.7	172.5	-175.3	0	0	0	0	109.9	G506 D526	S504-G506 PolarHBondContact O-N 2.83Å; S504-D526 WeakPolarHBondContact CA-OD1 3.22Å; S504-D526 WeakPolarHBondContact CB-OD1 3.37Å; S504-D526 PolarHBondContact OG-OD1 3.09Å
505	S	41.2	Very low	56.1	Low	130 Å²	130	115.2 Å²	115.2	91%	0.909	62%	0.621	S	S	*	*	S	Bend	trans	-63.2	76.4	171.9	165.9	0	0	0	0	110.6
506	G	36.7	Very low	53.4	Low	55 Å²	55	126.4 Å²	126.4	57%	0.567	66%	0.663	S	S	*	*	S	Bend	trans	149.1	92.6	175.9	0	0	0	0	0	113.7	S504	S504-G506 PolarHBondContact O-N 2.83Å
507	D	32.6	Very low	50.8	Low	160 Å²	160	127.5 Å²	127.5	86%	0.856	68%	0.675	S	S	*	*	S	Bend	trans	41.7	106.2	156.4	-71.4	-24.9	0	0	0	120
508	K	39.5	Very low	48.3	Very low	190 Å²	190	134.8 Å²	134.8	83%	0.826	71%	0.708	S	S	*	*			trans	121.8	115.6	149.7	-70.5	172.8	178.6	173.5	0	114.7	V510	K508-V510 PolarHBondContact O-N 3.27Å
509	L	33.3	Very low	45.8	Very low	181 Å²	181	139.4 Å²	139.4	95%	0.948	73%	0.73	S	S	*	*			trans	-58.3	102.7	158.3	-71.6	163.2	0	0	0	109.1
510	V	38.6	Very low	43.3	Very low	137 Å²	137	140.5 Å²	140.5	83%	0.83	75%	0.745	S	S	*	*			trans	-89.8	106.3	173.3	-179.5	0	0	0	0	108.4	K508	K508-V510 PolarHBondContact O-N 3.27Å
511	A	34	Very low	41	Very low	88 Å²	88	143.4 Å²	143.4	73%	0.727	76%	0.761	S	S	*	*			trans	-80.2	134	171.5	0	0	0	0	0	111.2	N513	A511-N513 PolarHBondContact O-N 3.46Å
512	D	34.6	Very low	39	Very low	156 Å²	156	147.5 Å²	147.5	83%	0.834	78%	0.776	S	S	*	*	S	Bend	trans	6.6	94.1	158.6	-65.5	-22.9	0	0	0	117.5
513	N	34.1	Very low	37.5	Very low	152 Å²	152	148.2 Å²	148.2	81%	0.813	79%	0.785	S	S	*	*			trans	170.2	89	144.6	-95.8	-31.5	0	0	0	109.8	A511	A511-N513 PolarHBondContact O-N 3.46Å
514	Y	33.5	Very low	37	Very low	240 Å²	240	145.1 Å²	145.1	94%	0.941	77%	0.774	S	S	*	*			trans	-161.3	143.4	152.3	-109.2	-77.2	0	0	0	111
515	D	36.1	Very low	37.1	Very low	154 Å²	154	147.5 Å²	147.5	82%	0.824	78%	0.782	S	S	*	*			trans	-58.6	151.7	-169.9	-91.6	-48.7	0	0	0	115.8	D517	D515-D517 VanDerWaalsContact C-N 3.31Å; D515-D517 PolarHBondContact O-N 2.98Å; D515-D517 VanDerWaalsContact O-N 3.07Å
516	R	36.6	Very low	37.9	Very low	240 Å²	240	144.3 Å²	144.3	91%	0.906	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	10.5	-160.1	-138.7	-166.5	-74.8	-161.3	-2.2	117.1
517	D	37.7	Very low	39.5	Very low	155 Å²	155	143.8 Å²	143.8	83%	0.829	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.2	16.7	-163.8	-74.9	-25.8	0	0	0	116.8	D515	D515-D517 VanDerWaalsContact C-N 3.31Å; D515-D517 PolarHBondContact O-N 2.98Å; D515-D517 VanDerWaalsContact O-N 3.07Å
518	Q	36.9	Very low	41.9	Very low	190 Å²	190	136.8 Å²	136.8	89%	0.888	70%	0.701	S	S	*	*			trans	-138.9	50.3	179.4	-68	-167.1	9	0	0	115.6
519	L	38.1	Very low	44.2	Very low	157 Å²	157	128.8 Å²	128.8	82%	0.822	67%	0.667	S	S	*	*			trans	-120.9	72.3	178.8	-136.9	85.5	0	0	0	111.7	L522	L519-L522 HydrophobicContact CD1-CD1 3.9Å; L519-L522 HydrophobicContact CG-CD1 4.01Å
520	S	33.2	Very low	46.9	Very low	108 Å²	108	121.6 Å²	121.6	76%	0.755	63%	0.628	S	S	*	*			trans	-119.8	-3.2	174.7	64.6	0	0	0	0	115.3
521	D	34.5	Very low	49.4	Very low	152 Å²	152	118.3 Å²	118.3	81%	0.813	60%	0.602	S	S	*	*			trans	-125.9	45.3	-172.2	-72.1	-4.6	0	0	0	113.3
522	L	34.3	Very low	52.2	Low	113 Å²	113	114.1 Å²	114.1	59%	0.592	57%	0.567	S	S	*	*			trans	-118.3	118.8	175.2	-85.7	147.7	0	0	0	111.1	L519	L519-L522 HydrophobicContact CD1-CD1 3.9Å; L519-L522 HydrophobicContact CG-CD1 4.01Å
523	Q	39.1	Very low	54.9	Low	175 Å²	175	107 Å²	107	82%	0.818	53%	0.529	S	S	*	.			trans	-59.9	135.3	-172.9	-71.7	173.1	-43.2	0	0	111.9	N525	Q523-N525 PolarHBondContact O-N 3.09Å
524	T	43.6	Very low	57.7	Low	51 Å²	51	99.9 Å²	99.9	31%	0.313	49%	0.492	S	S	.	.	S	Bend	trans	-50.8	114.6	172.3	49	0	0	0	0	111.3	G478	G478-T524 VanDerWaalsContact O-CG2 3.28Å; G478-T524 WeakPolarHBondContact O-CG2 3.22Å
525	N	50.8	Low	60.5	Low	114 Å²	114	91.3 Å²	91.3	61%	0.61	47%	0.465	S	S	*	.			trans	152	18.7	160.8	-76.5	-3.4	0	0	0	115.3	Q523	Q523-N525 PolarHBondContact O-N 3.09Å
526	D	59.2	Low	63.1	Low	62 Å²	62	86.8 Å²	86.8	33%	0.332	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-77.2	132.5	-175.3	-66.8	-23.7	0	0	0	114	S504	S504-D526 WeakPolarHBondContact CA-OD1 3.22Å; S504-D526 WeakPolarHBondContact CB-OD1 3.37Å; S504-D526 PolarHBondContact OG-OD1 3.09Å
527	L	69.9	Low	65.6	Low	44 Å²	44	77.8 Å²	77.8	23%	0.23	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	130.1	179.4	178.6	73	0	0	0	111.7	T473 Y502 E503 I529	T473-L527 HydrophobicContact CG2-CD1 3.44Å; T473-L527 VanDerWaalsContact CG2-CD1 3.44Å; Y502-L527 CarbonylContact C-O 3.53Å; Y502-L527 VanDerWaalsContact CA-O 3.28Å; Y502-L527 WeakPolarHBondContact CA-O 3.49Å; E503-L527 HydrophobicContact CB-CB 4.18Å; E503-L527 HydrophobicContact CB-CD2 4.29Å; E503-L527 PolarHBondContact N-O 3.19Å; E503-L527 PolarHBondContact O-N 3.49Å; L527-I529 HydrophobicContact CD2-CD1 4.15Å; L527-I529 HydrophobicContact CD2-CG1 4.33Å; L527-I529 HydrophobicContact CG-CG1 4.25Å
528	I	82.8	Confident	68.2	Low	14 Å²	14	72.1 Å²	72.1	7%	0.072	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	136.4	178.8	-48	176	0	0	0	110.7	S471 V472 V483 L499 Y502 Y530	S471-I528 CarbonylContact C-O 3.38Å; S471-I528 WeakPolarHBondContact CA-O 3.3Å; V472-I528 HydrophobicContact CB-CB 4.28Å; V472-I528 PolarHBondContact N-O 3.11Å; V472-I528 PolarHBondContact O-N 2.92Å; V472-I528 VanDerWaalsContact O-N 3.17Å; V483-I528 HydrophobicContact CB-CD1 4Å; V483-I528 WeakPolarHBondContact O-CD1 3.46Å; L499-I528 HydrophobicContact CD1-CG2 4.04Å; Y502-I528 HydrophobicContact CD1-CB 4.4Å; Y502-I528 HydrophobicContact CD1-CG1 3.86Å; Y502-I528 HydrophobicContact CD1-CG2 4.33Å; Y502-I528 HydrophobicContact CE1-CB 4.47Å; Y502-I528 HydrophobicContact CE1-CD1 4.26Å; Y502-I528 HydrophobicContact CE1-CG1 3.9Å; Y502-I528 HydrophobicContact CE1-CG2 4.05Å; I528-Y530 HydrophobicContact CG2-CE2 3.96Å
529	I	87.1	Confident	70.8	Confident	22 Å²	22	64.8 Å²	64.8	11%	0.113	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	137.1	-174.8	-45.2	178.6	0	0	0	115	V470 L499 I500 G501 E503 L527	V470-I529 CarbonylContact O-C 3.48Å; V470-I529 VanDerWaalsContact O-CA 3.3Å; V470-I529 WeakPolarHBondContact O-CA 3.22Å; L499-I529 WeakPolarHBondContact CD1-O 3.39Å; I500-I529 HydrophobicContact CD1-CB 4.36Å; I500-I529 HydrophobicContact CD1-CG2 3.64Å; I500-I529 HydrophobicContact CG1-CB 3.95Å; I500-I529 HydrophobicContact CG1-CG2 3.73Å; I500-I529 VanDerWaalsContact CG1-O 3.25Å; I500-I529 WeakPolarHBondContact CG1-O 3.22Å; I500-I529 PolarHBondContact N-O 2.93Å; G501-I529 PolarHBondContact N-O 2.78Å; G501-I529 PolarHBondContact O-N 2.97Å; E503-I529 HydrophobicContact CB-CD1 4.36Å; L527-I529 HydrophobicContact CD2-CD1 4.15Å; L527-I529 HydrophobicContact CD2-CG1 4.33Å; L527-I529 HydrophobicContact CG-CG1 4.25Å
530	Y	90.7	Very high	73.4	Confident	30 Å²	30	59.6 Å²	59.6	12%	0.118	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	165.7	174.6	-56.9	-105.9	0	0	0	113.7	L469 V470 C485 L497 T498 L499 I528	L469-Y530 CarbonylContact C-O 3.57Å; L469-Y530 WeakPolarHBondContact CA-O 3.37Å; V470-Y530 PolarHBondContact N-O 2.77Å; V470-Y530 PolarHBondContact O-N 3.15Å; C485-Y530 HydrophobicContact CB-CE2 4.03Å; L497-Y530 HydrophobicContact CD1-CG 4.46Å; L497-Y530 HydrophobicContact CD2-CD1 4.1Å; L497-Y530 HydrophobicContact CD2-CG 4.41Å; L497-Y530 HydrophobicContact CG-CD1 4.12Å; L497-Y530 HydrophobicContact CG-CG 4.38Å; T498-Y530 CarbonylContact O-C 3.58Å; T498-Y530 WeakPolarHBondContact O-CA 3.16Å; L499-Y530 HydrophobicContact CB-CD1 3.87Å; L499-Y530 HydrophobicContact CB-CE1 3.86Å; L499-Y530 HydrophobicContact CD1-CD1 4.07Å; L499-Y530 HydrophobicContact CD1-CD2 4.35Å; L499-Y530 HydrophobicContact CD1-CE1 3.79Å; L499-Y530 HydrophobicContact CD1-CE2 4.09Å; L499-Y530 HydrophobicContact CD1-CG 4.33Å; L499-Y530 HydrophobicContact CG-CE1 4.41Å; I528-Y530 HydrophobicContact CG2-CE2 3.96Å
531	K	90.9	Very high	76.2	Confident	67 Å²	67	58.6 Å²	58.6	29%	0.291	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	140.3	176.9	-175.1	-179.4	76.9	161.5	0	113.5	D466 L469 L497 T498 I500	D466-K531 IonicContact OD1-NZ 3.08Å; D466-K531 PolarHBondContact OD1-NZ 2.86Å; D466-K531 WeakPolarHBondContact OD2-CE 3.47Å; D466-K531 IonicContact OD2-NZ 2.74Å; D466-K531 PolarHBondContact OD2-NZ 3.45Å; L469-K531 HydrophobicContact CD2-CB 4.07Å; L469-K531 HydrophobicContact CD2-CG 4.21Å; L497-K531 CarbonylContact C-O 3.38Å; L497-K531 VanDerWaalsContact CA-O 3.3Å; L497-K531 WeakPolarHBondContact CA-O 3.18Å; T498-K531 PolarHBondContact N-O 2.88Å; T498-K531 PolarHBondContact O-N 3.45Å; I500-K531 HydrophobicContact CG2-CB 4Å
532	M	92.1	Very high	78.7	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	135.6	-177.8	-177.2	169.5	66.8	0	0	114.9	L452 F467 A468 K496 L497	L452-M532 HydrophobicContact CD1-CE 3.62Å; F467-M532 HydrophobicContact CE1-CG 4.05Å; F467-M532 HydrophobicContact CE2-CE 3.77Å; F467-M532 HydrophobicContact CZ-CE 3.68Å; F467-M532 HydrophobicContact CZ-CG 3.98Å; F467-M532 HydrophobicContact CZ-SD 4.19Å; F467-M532 PolarHBondContact N-O 3.25Å; F467-M532 VanDerWaalsContact N-O 3.1Å; A468-M532 HydrophobicContact CB-CB 4.13Å; A468-M532 HydrophobicContact CB-CE 3.58Å; A468-M532 PolarHBondContact N-O 2.74Å; A468-M532 VanDerWaalsContact N-O 3.15Å; A468-M532 PolarHBondContact O-N 2.85Å; K496-M532 VanDerWaalsContact O-CA 3.26Å; K496-M532 WeakPolarHBondContact O-CA 3.26Å; L497-M532 HydrophobicContact CD1-CB 4.39Å
533	S	92.9	Very high	81.3	Confident	6 Å²	6	59.1 Å²	59.1	4%	0.042	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	146.7	-171.8	-33	0	0	0	0	114.4	V465 D466 F495 K496	V465-S533 CarbonylContact O-C 3.6Å; V465-S533 WeakPolarHBondContact O-CA 3.37Å; D466-S533 VanDerWaalsContact OD1-CB 3.31Å; D466-S533 WeakPolarHBondContact OD1-CB 3.45Å; D466-S533 PolarHBondContact OD1-OG 3.31Å; F495-S533 CarbonylContact C-O 3.53Å; F495-S533 WeakPolarHBondContact CA-O 3.39Å; K496-S533 PolarHBondContact N-O 2.47Å; K496-S533 VanDerWaalsContact N-O 3.13Å; K496-S533 PolarHBondContact O-N 3.16Å; K496-S533 VanDerWaalsContact O-N 3.13Å
534	A	92.5	Very high	83.7	Confident	4 Å²	4	53 Å²	53	3%	0.033	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	149.7	178.2	0	0	0	0	0	113.3	I454 P464 V465 F467 F495	I454-A534 HydrophobicContact CD1-CB 3.93Å; P464-A534 CarbonylContact C-O 3.5Å; P464-A534 VanDerWaalsContact CA-O 3.27Å; P464-A534 WeakPolarHBondContact CA-O 3.39Å; V465-A534 PolarHBondContact N-O 2.95Å; V465-A534 PolarHBondContact O-N 3.16Å; F467-A534 HydrophobicContact CD1-CB 3.88Å; F467-A534 HydrophobicContact CE1-CB 3.9Å; F495-A534 HydrophobicContact CD1-CB 4.41Å; F495-A534 HydrophobicContact CE1-CB 4.43Å
535	V	91.4	Very high	85.9	Confident	59 Å²	59	52.7 Å²	52.7	36%	0.358	28%	0.277	S	S	.	.			trans	-123.7	3.6	-173.6	-52.1	0	0	0	0	116.8	P464 D493 L494	P464-V535 HydrophobicContact CB-CG1 4.2Å; D493-V535 WeakPolarHBondContact O-CG2 3.5Å; L494-V535 WeakPolarHBondContact O-CG2 3.03Å; L494-V535 PolarHBondContact O-N 2.87Å
536	V	90.8	Very high	87.8	Confident	60 Å²	60	48.3 Å²	48.3	36%	0.364	26%	0.255	S	S	.	.	S	Bend	trans	-146.7	170.8	-178.7	-61.6	0	0	0	0	114.8	F463 L494 F538	F463-V536 WeakPolarHBondContact CE1-O 3.29Å; F463-V536 WeakPolarHBondContact CZ-O 3.47Å; L494-V536 HydrophobicContact CD2-CG2 4.13Å; V536-F538 HydrophobicContact CG2-CE1 4.21Å; V536-F538 HydrophobicContact CG2-CE2 4.19Å; V536-F538 HydrophobicContact CG2-CZ 3.65Å; V536-F538 WeakPolarHBondContact O-CE2 3.07Å
537	S	89.7	Confident	89.4	Confident	50 Å²	50	51.9 Å²	51.9	35%	0.35	26%	0.264	S	S	.	.			trans	-108.4	158.7	-177.5	-171.8	0	0	0	0	115.1	L458	L458-S537 PolarHBondContact N-OG 3.28Å; L458-S537 PolarHBondContact O-OG 3.11Å
538	F	92	Very high	90.4	Very high	37 Å²	37	49.8 Å²	49.8	16%	0.162	25%	0.253	C	S	.	.			trans	-138.8	164.6	-166.5	-56.9	-79.6	0	0	0	115.8	I454 H457 V536 V546 I570	I454-F538 HydrophobicContact CD1-CE2 4.06Å; I454-F538 HydrophobicContact CG2-CD2 4.09Å; I454-F538 HydrophobicContact CG2-CE2 4.47Å; H457-F538 PolarHBondContact N-O 2.94Å; V536-F538 HydrophobicContact CG2-CE1 4.21Å; V536-F538 HydrophobicContact CG2-CE2 4.19Å; V536-F538 HydrophobicContact CG2-CZ 3.65Å; V536-F538 WeakPolarHBondContact O-CE2 3.07Å; F538-V546 HydrophobicContact CD1-CG1 4.37Å; F538-V546 HydrophobicContact CE1-CG1 3.85Å; F538-V546 HydrophobicContact CZ-CG1 4.49Å; F538-V546 HydrophobicContact CZ-CG2 4.4Å; F538-I570 HydrophobicContact CB-CD1 3.67Å; F538-I570 HydrophobicContact CB-CG1 4Å; F538-I570 HydrophobicContact CB-CG2 3.94Å; F538-I570 HydrophobicContact CD1-CD1 4.14Å; F538-I570 HydrophobicContact CD2-CD1 3.71Å; F538-I570 HydrophobicContact CE2-CD1 4.39Å; F538-I570 HydrophobicContact CG-CD1 3.56Å; F538-I570 HydrophobicContact CG-CG1 4.29Å
539	D	91.5	Very high	90.9	Very high	36 Å²	36	51.1 Å²	51.1	19%	0.193	26%	0.262	C	S	.	.			trans	-142.1	126.4	-177.8	167.9	-15.1	0	0	0	109.9	H457 E541 K542 N543	H457-D539 IonicContact CE1-OD2 3.04Å; D539-E541 PolarHBondContact OD1-N 3.34Å; D539-K542 PolarHBondContact OD1-N 3.28Å; D539-K542 WeakPolarHBondContact OD2-CD 2.89Å; D539-K542 WeakPolarHBondContact OD2-CE 3.09Å; D539-K542 IonicContact OD2-NZ 2.67Å; D539-K542 PolarHBondContact OD2-NZ 2.93Å; D539-N543 PolarHBondContact O-N 3.17Å
540	R	92.8	Very high	91.2	Very high	47 Å²	47	50.1 Å²	50.1	18%	0.177	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-44.3	-165	-167.7	-137.1	69.7	106	-14.6	114.2	E456 K542 N543 I570 D572 S614	E456-R540 WeakPolarHBondContact OE2-CB 2.76Å; E456-R540 PolarHBondContact OE2-N 3.2Å; R540-K542 PolarHBondContact O-N 3.46Å; R540-N543 PolarHBondContact O-N 3.49Å; R540-I570 HydrophobicContact CB-CG2 4.41Å; R540-D572 WeakPolarHBondContact CD-OD1 3.46Å; R540-D572 IonicContact CZ-OD1 3.64Å; R540-D572 IonicContact NE-OD1 3.92Å; R540-D572 PolarHBondContact NE-OD1 3.13Å; R540-D572 IonicContact NH2-OD1 3.75Å; R540-S614 PolarHBondContact NH1-OG 2.96Å
541	E	91.6	Very high	91.3	Very high	87 Å²	87	54.4 Å²	54.4	41%	0.407	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-18.2	176.1	-75.8	60.3	-125.1	0	0	111.5	D539	D539-E541 PolarHBondContact OD1-N 3.34Å
542	K	87.9	Confident	91.4	Very high	159 Å²	159	51.3 Å²	51.3	69%	0.691	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-60.2	170	-67.3	-170.2	-175.5	111.7	0	114.6	D539 R540	D539-K542 PolarHBondContact OD1-N 3.28Å; D539-K542 WeakPolarHBondContact OD2-CD 2.89Å; D539-K542 WeakPolarHBondContact OD2-CE 3.09Å; D539-K542 IonicContact OD2-NZ 2.67Å; D539-K542 PolarHBondContact OD2-NZ 2.93Å; R540-K542 PolarHBondContact O-N 3.46Å
543	N	88	Confident	91.4	Very high	118 Å²	118	53.6 Å²	53.6	63%	0.631	27%	0.274	S	S	*	.			trans	-141.9	111.1	-175.5	-91	4.8	0	0	0	111.9	D539 R540	D539-N543 PolarHBondContact O-N 3.17Å; R540-N543 PolarHBondContact O-N 3.49Å
544	A	89.1	Confident	91.3	Very high	47 Å²	47	53.5 Å²	53.5	39%	0.388	27%	0.273	S	S	.	.			trans	-83.3	-9.6	-174.9	0	0	0	0	0	116.4	I570	A544-I570 PolarHBondContact O-N 2.93Å
545	T	90.4	Very high	91	Very high	43 Å²	43	57.6 Å²	57.6	26%	0.264	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	145.6	-172	-55.7	0	0	0	0	114.5	Y547 Q567 I568	T545-Y547 HydrophobicContact CG2-CE1 4.31Å; T545-Y547 HydrophobicContact CG2-CE2 4.31Å; T545-Q567 HydrophobicContact CG2-CG 3.66Å; T545-I568 WeakPolarHBondContact CA-O 3.47Å
546	V	91	Very high	90.6	Very high	22 Å²	22	55 Å²	55	13%	0.133	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	164.8	175.7	-59.8	0	0	0	0	112.6	F495 F538 I568	F495-V546 HydrophobicContact CZ-CG2 4.08Å; F538-V546 HydrophobicContact CD1-CG1 4.37Å; F538-V546 HydrophobicContact CE1-CG1 3.85Å; F538-V546 HydrophobicContact CZ-CG1 4.49Å; F538-V546 HydrophobicContact CZ-CG2 4.4Å; V546-I568 HydrophobicContact CG2-CB 3.74Å; V546-I568 HydrophobicContact CG2-CD1 4.43Å; V546-I568 HydrophobicContact CG2-CG2 4.1Å; V546-I568 PolarHBondContact N-O 3.45Å; V546-I568 WeakPolarHBondContact O-CD1 3.25Å; V546-I568 PolarHBondContact O-N 2.91Å
547	Y	91.8	Very high	90.1	Very high	137 Å²	137	58.7 Å²	58.7	54%	0.537	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	151.8	-167.7	-59.4	-83.3	0	0	0	116.2	F495 T545 A566 Q567	F495-Y547 WeakPolarHBondContact CE2-O 3.31Å; T545-Y547 HydrophobicContact CG2-CE1 4.31Å; T545-Y547 HydrophobicContact CG2-CE2 4.31Å; Y547-A566 CarbonylContact C-O 3.48Å; Y547-A566 WeakPolarHBondContact CA-O 3.24Å; Y547-Q567 HydrophobicContact CD1-CB 4.12Å; Y547-Q567 HydrophobicContact CD1-CG 4.22Å; Y547-Q567 HydrophobicContact CE1-CB 4.05Å; Y547-Q567 HydrophobicContact CE1-CG 3.76Å
548	A	91.6	Very high	89.9	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	153.5	174.4	0	0	0	0	0	114.8	S491 F495 V565 A566 I568	S491-A548 VanDerWaalsContact OG-CA 3.22Å; S491-A548 WeakPolarHBondContact OG-CA 3.43Å; F495-A548 HydrophobicContact CD2-CB 3.64Å; F495-A548 HydrophobicContact CE2-CB 3.89Å; F495-A548 HydrophobicContact CG-CB 4.4Å; A548-V565 CarbonylContact O-C 3.56Å; A548-V565 WeakPolarHBondContact O-CA 3.36Å; A548-A566 HydrophobicContact CB-CB 4.34Å; A548-A566 PolarHBondContact N-O 2.88Å; A548-A566 PolarHBondContact O-N 2.88Å; A548-I568 HydrophobicContact CB-CD1 4.31Å
549	T	93.1	Very high	89.6	Confident	42 Å²	42	64.2 Å²	64.2	26%	0.258	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	133.9	-174.6	-56.5	0	0	0	0	116	L487 D488 S491 Y564 V565	L487-T549 VanDerWaalsContact CD2-O 3.25Å; L487-T549 WeakPolarHBondContact CD2-O 3.34Å; D488-T549 HydrophobicContact CB-CG2 4.37Å; D488-T549 PolarHBondContact N-O 3.4Å; S491-T549 PolarHBondContact OG-N 2.98Å; T549-Y564 CarbonylContact C-O 3.49Å; T549-Y564 WeakPolarHBondContact CA-O 3.12Å; T549-V565 HydrophobicContact CG2-CG2 4.27Å
550	I	93	Very high	89.6	Confident	2 Å²	2	65.8 Å²	65.8	1%	0.01	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	149.8	-173.3	-55.8	162.1	0	0	0	112.8	V470 E486 L487 D563 Y564	V470-I550 HydrophobicContact CG1-CD1 4.13Å; V470-I550 HydrophobicContact CG2-CD1 3.83Å; E486-I550 CarbonylContact O-C 3.53Å; E486-I550 VanDerWaalsContact O-CA 3.3Å; E486-I550 WeakPolarHBondContact O-CA 3.34Å; L487-I550 HydrophobicContact CD2-CG1 3.74Å; I550-D563 CarbonylContact O-C 3.31Å; I550-Y564 HydrophobicContact CD1-CD1 4.16Å; I550-Y564 PolarHBondContact N-O 3.08Å; I550-Y564 PolarHBondContact O-N 2.93Å
551	R	93.4	Very high	89.6	Confident	120 Å²	120	68.8 Å²	68.8	45%	0.453	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	141.1	-178.2	170.1	173.1	-68.9	164.7	0.9	115.1	C485 E486 T562 D563	C485-R551 CarbonylContact C-O 3.56Å; C485-R551 WeakPolarHBondContact CA-O 3.49Å; C485-R551 VanDerWaalsContact CB-O 3.3Å; C485-R551 WeakPolarHBondContact CB-O 3.31Å; E486-R551 HydrophobicContact CG-CB 4.22Å; E486-R551 PolarHBondContact N-O 2.74Å; E486-R551 PolarHBondContact O-N 2.71Å; R551-T562 CarbonylContact C-O 3.56Å; R551-D563 VanDerWaalsContact CB-OD1 3.25Å; R551-D563 WeakPolarHBondContact CB-OD1 3.47Å; R551-D563 WeakPolarHBondContact CG-OD1 3.49Å; R551-D563 IonicContact CZ-OD1 3.58Å; R551-D563 IonicContact CZ-OD2 2.69Å; R551-D563 IonicContact NE-OD1 2.73Å; R551-D563 PolarHBondContact NE-OD1 2.66Å; R551-D563 IonicContact NE-OD2 3.13Å; R551-D563 IonicContact NH2-OD1 3.53Å; R551-D563 IonicContact NH2-OD2 2.95Å; R551-D563 PolarHBondContact NH2-OD2 2.66Å
552	C	92.7	Very high	89.7	Confident	1 Å²	1	65.9 Å²	65.9	1%	0.007	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	160.8	178.3	-55.9	0	0	0	0	117.7	I441 V472 V483 K484 C485 I561 T562	I441-C552 HydrophobicContact CD1-CB 3.68Å; I441-C552 WeakPolarHBondContact CD1-SG 3.27Å; I441-C552 HydrophobicContact CG1-CB 3.94Å; I441-C552 WeakPolarHBondContact CG1-SG 3.18Å; V472-C552 HydrophobicContact CG1-CB 4.37Å; V483-C552 HydrophobicContact CG1-CB 4.11Å; K484-C552 CarbonylContact O-C 3.57Å; K484-C552 WeakPolarHBondContact O-CA 3.36Å; C485-C552 HydrophobicContact CB-CB 4.11Å; C485-C552 WeakPolarHBondContact CB-SG 3.27Å; C485-C552 WeakPolarHBondContact SG-CB 3.27Å; C485-C552 CovalentContact SG-SG 2.02Å; C485-C552 PolarHBondContact SG-SG 2.79Å; C552-I561 WeakPolarHBondContact O-CG2 3.45Å; C552-T562 PolarHBondContact N-O 2.93Å; C552-T562 PolarHBondContact O-N 3.25Å
553	T	92.6	Very high	89.9	Confident	49 Å²	49	62.6 Å²	62.6	30%	0.301	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	142.9	-174.7	-53	0	0	0	0	116.6	V483 K484 I561	V483-T553 CarbonylContact C-O 3.49Å; V483-T553 VanDerWaalsContact CA-O 3.27Å; V483-T553 WeakPolarHBondContact CA-O 3.29Å; K484-T553 PolarHBondContact N-O 3.47Å; K484-T553 VanDerWaalsContact N-O 3.07Å; K484-T553 PolarHBondContact O-N 3.07Å; T553-I561 HydrophobicContact CG2-CG1 3.77Å
554	D	90	Very high	90.1	Very high	3 Å²	3	60 Å²	60	2%	0.016	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	179.2	178.5	81.1	51.2	0	0	0	117.3	P439 Q482 G556 P559 L560	P439-D554 HydrophobicContact CG-CB 3.76Å; Q482-D554 CarbonylContact O-C 3.59Å; Q482-D554 WeakPolarHBondContact O-CA 3.43Å; D554-G556 PolarHBondContact OD1-N 2.78Å; D554-P559 WeakPolarHBondContact OD1-CA 3.46Å; D554-L560 VanDerWaalsContact CG-N 3.31Å; D554-L560 PolarHBondContact N-O 3.32Å; D554-L560 PolarHBondContact OD1-N 3.08Å; D554-L560 VanDerWaalsContact OD2-CA 3.29Å; D554-L560 WeakPolarHBondContact OD2-CA 3.47Å; D554-L560 WeakPolarHBondContact OD2-CB 3.35Å; D554-L560 PolarHBondContact OD2-N 2.67Å
555	L	86.2	Confident	90.2	Very high	91 Å²	91	62.1 Å²	62.1	48%	0.476	32%	0.323	S	S	.	.			trans	-121.5	17.9	-175.8	-59.9	-176.4	0	0	0	117.2	R479 Q482	R479-L555 CarbonylContact O-C 3.59Å; Q482-L555 HydrophobicContact CB-CB 4.21Å; Q482-L555 HydrophobicContact CB-CD1 3.78Å; Q482-L555 HydrophobicContact CB-CG 4.11Å; Q482-L555 WeakPolarHBondContact O-CG 3.38Å; Q482-L555 PolarHBondContact O-N 2.67Å; Q482-L555 VanDerWaalsContact O-N 3.08Å
556	G	82.6	Confident	90.2	Very high	5 Å²	5	60 Å²	60	5%	0.052	31%	0.31	C	S	.	.	S	Bend	trans	-66.5	174.1	178.5	0	0	0	0	0	114.4	R479 D554 N558	R479-G556 PolarHBondContact O-N 3.28Å; D554-G556 PolarHBondContact OD1-N 2.78Å; G556-N558 PolarHBondContact O-N 3.44Å
557	D	80	Confident	90.2	Very high	136 Å²	136	63.3 Å²	63.3	73%	0.727	32%	0.324	S	S	*	.	S	Bend	trans	-64	-21.5	176	-80.3	-16.7	0	0	0	112.1
558	N	85.5	Confident	90.2	Very high	125 Å²	125	56.8 Å²	56.8	67%	0.668	30%	0.299	S	S	*	.	S	Bend	trans	-131.1	90.7	170.2	-65.5	-55.9	0	0	0	110	G556	G556-N558 PolarHBondContact O-N 3.44Å
559	P	86.9	Confident	90.2	Very high	79 Å²	79	59.6 Å²	59.6	51%	0.513	31%	0.312	S	S	.	.			trans	-70.6	145.1	-167.6	-19.9	30.6	0	0	0	116.3	D554	D554-P559 WeakPolarHBondContact OD1-CA 3.46Å
560	L	91.3	Very high	90.2	Very high	68 Å²	68	58.2 Å²	58.2	36%	0.356	30%	0.302	S	S	.	.			trans	-112.9	151.5	177.6	-46.5	177.1	0	0	0	112.6	H437 K438 D554	H437-L560 VanDerWaalsContact O-CD1 3.31Å; H437-L560 WeakPolarHBondContact O-CD1 3.27Å; K438-L560 HydrophobicContact CB-CB 3.77Å; K438-L560 HydrophobicContact CB-CD1 3.86Å; K438-L560 HydrophobicContact CB-CG 4.47Å; D554-L560 VanDerWaalsContact CG-N 3.31Å; D554-L560 PolarHBondContact N-O 3.32Å; D554-L560 PolarHBondContact OD1-N 3.08Å; D554-L560 VanDerWaalsContact OD2-CA 3.29Å; D554-L560 WeakPolarHBondContact OD2-CA 3.47Å; D554-L560 WeakPolarHBondContact OD2-CB 3.35Å; D554-L560 PolarHBondContact OD2-N 2.67Å
561	I	92	Very high	90	Very high	111 Å²	111	59.9 Å²	59.9	57%	0.569	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.8	147.5	-169.1	-57.9	173.4	0	0	0	112.2	C552 T553	C552-I561 WeakPolarHBondContact O-CG2 3.45Å; T553-I561 HydrophobicContact CG2-CG1 3.77Å
562	T	93.8	Very high	89.9	Confident	25 Å²	25	56.2 Å²	56.2	15%	0.153	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	135.7	177.9	-60.2	0	0	0	0	113.9	P439 I441 R551 C552	P439-T562 WeakPolarHBondContact O-CB 3.04Å; P439-T562 PolarHBondContact O-OG1 3.38Å; I441-T562 HydrophobicContact CD1-CG2 3.8Å; I441-T562 WeakPolarHBondContact CD1-O 3.25Å; I441-T562 HydrophobicContact CG1-CG2 3.98Å; R551-T562 CarbonylContact C-O 3.56Å; C552-T562 PolarHBondContact N-O 2.93Å; C552-T562 PolarHBondContact O-N 3.25Å
563	D	92.3	Very high	89.7	Confident	91 Å²	91	60.4 Å²	60.4	49%	0.487	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	145.6	173.1	-79.1	-12.5	0	0	0	111.1	I550 R551	I550-D563 CarbonylContact O-C 3.31Å; R551-D563 VanDerWaalsContact CB-OD1 3.25Å; R551-D563 WeakPolarHBondContact CB-OD1 3.47Å; R551-D563 WeakPolarHBondContact CG-OD1 3.49Å; R551-D563 IonicContact CZ-OD1 3.58Å; R551-D563 IonicContact CZ-OD2 2.69Å; R551-D563 IonicContact NE-OD1 2.73Å; R551-D563 PolarHBondContact NE-OD1 2.66Å; R551-D563 IonicContact NE-OD2 3.13Å; R551-D563 IonicContact NH2-OD1 3.53Å; R551-D563 IonicContact NH2-OD2 2.95Å; R551-D563 PolarHBondContact NH2-OD2 2.66Å
564	Y	91.7	Very high	89.7	Confident	63 Å²	63	60 Å²	60	25%	0.247	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	133.6	-175.5	-179	-96.2	0	0	0	113.7	I441 A443 T549 I550 A566	I441-Y564 HydrophobicContact CG2-CG 4.32Å; A443-Y564 HydrophobicContact CB-CE1 3.63Å; T549-Y564 CarbonylContact C-O 3.49Å; T549-Y564 WeakPolarHBondContact CA-O 3.12Å; I550-Y564 HydrophobicContact CD1-CD1 4.16Å; I550-Y564 PolarHBondContact N-O 3.08Å; I550-Y564 PolarHBondContact O-N 2.93Å; Y564-A566 HydrophobicContact CE1-CB 4Å
565	V	92.3	Very high	89.6	Confident	91 Å²	91	64.9 Å²	64.9	55%	0.552	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.6	118.6	178.2	-177.7	0	0	0	0	110.4	A548 T549	A548-V565 CarbonylContact O-C 3.56Å; A548-V565 WeakPolarHBondContact O-CA 3.36Å; T549-V565 HydrophobicContact CG2-CG2 4.27Å
566	A	89.8	Confident	89.9	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	129.1	177.9	0	0	0	0	0	112	L452 Y547 A548 Y564	L452-A566 HydrophobicContact CD1-CB 3.94Å; Y547-A566 CarbonylContact C-O 3.48Å; Y547-A566 WeakPolarHBondContact CA-O 3.24Å; A548-A566 HydrophobicContact CB-CB 4.34Å; A548-A566 PolarHBondContact N-O 2.88Å; A548-A566 PolarHBondContact O-N 2.88Å; Y564-A566 HydrophobicContact CE1-CB 4Å
567	Q	92.1	Very high	90.3	Very high	91 Å²	91	69.4 Å²	69.4	43%	0.425	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	131.6	176.1	179.8	175.1	-5	0	0	110.1	T545 Y547 H569	T545-Q567 HydrophobicContact CG2-CG 3.66Å; Y547-Q567 HydrophobicContact CD1-CB 4.12Å; Y547-Q567 HydrophobicContact CD1-CG 4.22Å; Y547-Q567 HydrophobicContact CE1-CB 4.05Å; Y547-Q567 HydrophobicContact CE1-CG 3.76Å; Q567-H569 PolarHBondContact NE2-CE1 3.01Å; Q567-H569 VanDerWaalsContact NE2-CE1 3.3Å
568	I	92.2	Very high	91	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	126.7	-175.7	-53.1	92.7	0	0	0	110.3	L452 I454 F467 F495 T545 V546 A548	L452-I568 HydrophobicContact CB-CB 4.39Å; L452-I568 HydrophobicContact CB-CG1 4.02Å; L452-I568 HydrophobicContact CB-CG2 4.38Å; L452-I568 HydrophobicContact CD1-CG1 4.19Å; L452-I568 CarbonylContact O-C 3.54Å; L452-I568 VanDerWaalsContact O-CA 3.31Å; L452-I568 WeakPolarHBondContact O-CA 3.43Å; I454-I568 HydrophobicContact CD1-CG2 3.76Å; I454-I568 HydrophobicContact CG1-CG2 3.89Å; F467-I568 HydrophobicContact CE2-CG1 3.94Å; F467-I568 HydrophobicContact CE2-CG2 4.4Å; F467-I568 HydrophobicContact CZ-CG1 4.21Å; F495-I568 HydrophobicContact CE1-CD1 4.3Å; F495-I568 HydrophobicContact CE1-CG1 4.49Å; F495-I568 HydrophobicContact CE2-CD1 4.08Å; F495-I568 HydrophobicContact CZ-CD1 3.69Å; F495-I568 HydrophobicContact CZ-CG1 4.27Å; T545-I568 WeakPolarHBondContact CA-O 3.47Å; V546-I568 HydrophobicContact CG2-CB 3.74Å; V546-I568 HydrophobicContact CG2-CD1 4.43Å; V546-I568 HydrophobicContact CG2-CG2 4.1Å; V546-I568 PolarHBondContact N-O 3.45Å; V546-I568 WeakPolarHBondContact O-CD1 3.25Å; V546-I568 PolarHBondContact O-N 2.91Å; A548-I568 HydrophobicContact CB-CD1 4.31Å
569	H	91.5	Very high	91.4	Very high	59 Å²	59	66.5 Å²	66.5	27%	0.273	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	146.4	-175.8	-67.7	-72.6	0	0	0	113.4	L452 I453 I454 Q567	L452-H569 PolarHBondContact O-N 2.79Å; I453-H569 WeakPolarHBondContact CA-O 3.24Å; I454-H569 PolarHBondContact N-O 2.64Å; Q567-H569 PolarHBondContact NE2-CE1 3.01Å; Q567-H569 VanDerWaalsContact NE2-CE1 3.3Å
570	I	91.9	Very high	91.8	Very high	13 Å²	13	64.1 Å²	64.1	7%	0.067	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	130.7	176.1	-48.2	-54.9	0	0	0	110.4	I454 E456 F538 R540 A544	I454-I570 HydrophobicContact CB-CD1 4.22Å; I454-I570 VanDerWaalsContact O-CA 3.26Å; I454-I570 WeakPolarHBondContact O-CA 3.39Å; E456-I570 HydrophobicContact CB-CG2 3.78Å; F538-I570 HydrophobicContact CB-CD1 3.67Å; F538-I570 HydrophobicContact CB-CG1 4Å; F538-I570 HydrophobicContact CB-CG2 3.94Å; F538-I570 HydrophobicContact CD1-CD1 4.14Å; F538-I570 HydrophobicContact CD2-CD1 3.71Å; F538-I570 HydrophobicContact CE2-CD1 4.39Å; F538-I570 HydrophobicContact CG-CD1 3.56Å; F538-I570 HydrophobicContact CG-CG1 4.29Å; R540-I570 HydrophobicContact CB-CG2 4.41Å; A544-I570 PolarHBondContact O-N 2.93Å
571	A	89.7	Confident	91.7	Very high	36 Å²	36	66.2 Å²	66.2	30%	0.298	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	145.8	-174.1	0	0	0	0	0	115.2	I453 I454 E456	I453-A571 HydrophobicContact CG2-CB 4.12Å; I454-A571 PolarHBondContact O-N 3.1Å; E456-A571 WeakPolarHBondContact CB-O 2.99Å; E456-A571 WeakPolarHBondContact CG-O 3.06Å; E456-A571 PolarHBondContact N-O 3.48Å
572	D	91	Very high	91.5	Very high	44 Å²	44	66.8 Å²	66.8	24%	0.235	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-90.7	160.5	-169.6	-173.2	81.4	0	0	0	117.1	E456 R540 S614 N617	E456-D572 VanDerWaalsContact OE1-CA 3.3Å; E456-D572 WeakPolarHBondContact OE1-CA 3.23Å; R540-D572 WeakPolarHBondContact CD-OD1 3.46Å; R540-D572 IonicContact CZ-OD1 3.64Å; R540-D572 IonicContact NE-OD1 3.92Å; R540-D572 PolarHBondContact NE-OD1 3.13Å; R540-D572 IonicContact NH2-OD1 3.75Å; D572-S614 WeakPolarHBondContact OD1-CB 3.11Å; D572-S614 PolarHBondContact OD1-N 3.42Å; D572-N617 PolarHBondContact OD2-ND2 2.99Å
573	I	89.3	Confident	91.3	Very high	89 Å²	89	70.4 Å²	70.4	46%	0.456	36%	0.361	S	S	.	.			trans	-137.1	140.7	173.4	-60.4	179	0	0	0	112	E456 D575	E456-I573 HydrophobicContact CG-CD1 4.34Å; E456-I573 HydrophobicContact CG-CG1 4.5Å; E456-I573 PolarHBondContact OE1-N 2.66Å; I573-D575 PolarHBondContact O-N 3Å
574	N	90.9	Very high	91.4	Very high	40 Å²	40	70.3 Å²	70.3	21%	0.214	36%	0.36	C	S	.	.			trans	-76.9	101.9	-173.9	-170	27.1	0	0	0	115.6	D613 N617 G666 V668	N574-D613 PolarHBondContact OD1-OD2 3.49Å; N574-N617 WeakPolarHBondContact CA-ND2 3.34Å; N574-N617 HydrophobicContact CB-CB 3.83Å; N574-N617 VanDerWaalsContact CB-OD1 3.3Å; N574-N617 WeakPolarHBondContact CB-OD1 2.88Å; N574-N617 PolarHBondContact N-ND2 2.83Å; N574-N617 WeakPolarHBondContact OD1-CB 2.96Å; N574-G666 WeakPolarHBondContact ND2-CA 3.29Å; N574-V668 PolarHBondContact ND2-O 2.86Å
575	D	89.4	Confident	91.4	Very high	106 Å²	106	70.4 Å²	70.4	57%	0.567	36%	0.363	S	S	*	.			trans	-126.4	11.4	-178.9	74.9	2.2	0	0	0	118.2	I573 D613	I573-D575 PolarHBondContact O-N 3Å; D575-D613 PolarHBondContact N-OD1 2.74Å; D575-D613 VanDerWaalsContact N-OD1 3.11Å; D575-D613 PolarHBondContact N-OD2 3.39Å; D575-D613 VanDerWaalsContact N-OD2 3.14Å
576	N	90.9	Very high	91.5	Very high	61 Å²	61	74.5 Å²	74.5	33%	0.326	37%	0.37	S	S	.	.			trans	-130.4	173.9	-178.6	-64.4	-78.5	0	0	0	116.1	D611 A612 D613 K670	N576-D611 VanDerWaalsContact CB-OD1 3.31Å; N576-D611 WeakPolarHBondContact CB-OD1 3.17Å; N576-A612 HydrophobicContact CB-CB 4Å; N576-D613 WeakPolarHBondContact CA-OD2 3.33Å; N576-D613 WeakPolarHBondContact CB-OD2 3.03Å; N576-D613 PolarHBondContact N-OD1 3.03Å; N576-D613 PolarHBondContact N-OD2 3.33Å; N576-D613 PolarHBondContact ND2-OD1 3.2Å; N576-K670 WeakPolarHBondContact O-CD 3.37Å; N576-K670 PolarHBondContact O-NZ 2.82Å
577	E	91.9	Very high	91.5	Very high	130 Å²	130	76.7 Å²	76.7	61%	0.607	38%	0.381	S	S	*	.			trans	-141.5	156.5	-175.8	88.2	-179.6	168.4	0	0	117.1	D611 K670	E577-D611 VanDerWaalsContact CA-OD2 3.31Å; E577-D611 WeakPolarHBondContact CA-OD2 3.11Å; E577-D611 PolarHBondContact N-OD1 2.69Å; E577-K670 HydrophobicContact CB-CB 3.75Å; E577-K670 HydrophobicContact CB-CD 3.35Å; E577-K670 HydrophobicContact CB-CG 4.2Å
578	P	95.5	Very high	91.5	Very high	6 Å²	6	79.8 Å²	79.8	4%	0.039	39%	0.393	C	S	.	.			trans	-81.6	147.3	-176.4	-16.8	31.5	0	0	0	119.2	T610 D611 I620 D664 S672	P578-T610 WeakPolarHBondContact CA-O 3.46Å; P578-D611 WeakPolarHBondContact CD-OD2 3.14Å; P578-I620 HydrophobicContact CB-CD1 3.97Å; P578-I620 HydrophobicContact CB-CG1 4.06Å; P578-I620 HydrophobicContact CG-CD1 4.49Å; P578-I620 HydrophobicContact CG-CG1 4.1Å; P578-D664 HydrophobicContact CG-CB 3.72Å; P578-S672 PolarHBondContact O-OG 3.18Å
579	R	93.2	Very high	91.5	Very high	193 Å²	193	80.4 Å²	80.4	73%	0.728	40%	0.396	S	S	*	.	B	Isolated β-bridge	trans	-145.7	129.9	-175.4	-178	-179.5	175.4	-171.3	-0.6	118.3	A609 T610	R579-A609 WeakPolarHBondContact O-CA 2.99Å; R579-A609 WeakPolarHBondContact O-CB 2.98Å; R579-T610 PolarHBondContact N-O 2.74Å; R579-T610 PolarHBondContact O-N 2.91Å
580	F	94.7	Very high	91.4	Very high	29 Å²	29	80 Å²	80	13%	0.127	40%	0.395	C	S	.	.			trans	-89.9	155.9	172.3	-71.4	-73.8	0	0	0	115.8	V607 I608 A609 Y622 V660 A662 V674	F580-V607 HydrophobicContact CE1-CB 3.95Å; F580-V607 HydrophobicContact CE1-CG2 3.97Å; F580-I608 WeakPolarHBondContact CD1-O 3.36Å; F580-A609 HydrophobicContact CD1-CB 4.08Å; F580-A609 HydrophobicContact CE1-CB 4.18Å; F580-A609 HydrophobicContact CG-CB 4.34Å; F580-Y622 HydrophobicContact CE1-CD1 4.03Å; F580-Y622 AromaticContact CE1-CE1 3.62Å; F580-Y622 HydrophobicContact CE1-CE1 3.62Å; F580-Y622 AromaticContact CZ-CD1 3.84Å; F580-Y622 HydrophobicContact CZ-CD1 3.84Å; F580-Y622 AromaticContact CZ-CE1 3.79Å; F580-Y622 HydrophobicContact CZ-CE1 3.79Å; F580-V660 HydrophobicContact CZ-CG1 4.47Å; F580-A662 HydrophobicContact CD2-CB 4.32Å; F580-A662 HydrophobicContact CE1-CB 4.33Å; F580-A662 HydrophobicContact CE2-CB 3.42Å; F580-A662 VanDerWaalsContact CE2-CB 3.42Å; F580-A662 HydrophobicContact CZ-CB 3.43Å; F580-A662 VanDerWaalsContact CZ-CB 3.43Å; F580-V674 HydrophobicContact CE1-CG1 4.4Å; F580-V674 HydrophobicContact CZ-CG1 4.37Å
581	P	89.9	Confident	91.3	Very high	112 Å²	112	79.4 Å²	79.4	73%	0.727	39%	0.392	S	S	*	.	S	Bend	trans	-79.4	-36.1	174.4	-17.8	30.3	0	0	0	118.1	I608	P581-I608 WeakPolarHBondContact CD-O 3.37Å
582	Q	88.6	Confident	91.1	Very high	123 Å²	123	79 Å²	79	58%	0.575	38%	0.384	S	S	*	.			trans	-134.7	171.5	-174.1	-64.2	-165.2	14.6	0	0	113	E585	Q582-E585 PolarHBondContact OE1-OE1 3.35Å
583	T	89.2	Confident	90.8	Very high	102 Å²	102	79.3 Å²	79.3	63%	0.626	39%	0.39	S	S	*	.	S	Bend	trans	-113.4	-22.4	-176.7	57.5	0	0	0	0	117.5	Y675	T583-Y675 PolarHBondContact O-N 2.9Å
584	N	93.3	Very high	90.6	Very high	88 Å²	88	76.1 Å²	76.1	47%	0.471	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	146.5	-177.8	-63.1	-40.1	0	0	0	113.9	Y675	N584-Y675 CarbonylContact C-O 3.41Å; N584-Y675 WeakPolarHBondContact CA-O 3.43Å; N584-Y675 WeakPolarHBondContact OD1-CB 2.93Å
585	E	92.3	Very high	90	Very high	65 Å²	65	78.4 Å²	78.4	30%	0.304	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	147.5	-176.4	-66.5	-75.3	-176.7	0	0	114.8	Q582 M605 Y675 I676 H677	Q582-E585 PolarHBondContact OE1-OE1 3.35Å; E585-M605 HydrophobicContact CB-CE 3.79Å; E585-M605 HydrophobicContact CB-SD 4.17Å; E585-M605 HydrophobicContact CG-CE 3.64Å; E585-Y675 PolarHBondContact N-O 2.92Å; E585-I676 HydrophobicContact CB-CG1 4.4Å; E585-I676 WeakPolarHBondContact O-CA 3.39Å; E585-H677 PolarHBondContact O-N 2.87Å; E585-H677 VanDerWaalsContact O-N 3.14Å
586	Y	93.3	Very high	89.4	Confident	178 Å²	178	80.4 Å²	80.4	70%	0.698	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.5	138.5	-177.6	-65.2	-90.7	0	0	0	114.2	H677	Y586-H677 HydrophobicContact CD1-CB 3.78Å; Y586-H677 AromaticContact CD1-CD2 3.95Å; Y586-H677 HydrophobicContact CE1-CB 4.09Å
587	I	91.6	Very high	88.8	Confident	46 Å²	46	77.7 Å²	77.7	24%	0.236	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	153	-175.1	-168.1	153	0	0	0	115.3	V604 H677 L678 T679	I587-V604 HydrophobicContact CD1-CG1 3.85Å; I587-V604 WeakPolarHBondContact CD1-O 3.14Å; I587-V604 HydrophobicContact CG2-CG1 4.11Å; I587-H677 PolarHBondContact N-O 2.67Å; I587-L678 HydrophobicContact CG2-CB 4.04Å; I587-L678 HydrophobicContact CG2-CD1 3.59Å; I587-L678 HydrophobicContact CG2-CG 4.41Å; I587-L678 WeakPolarHBondContact O-CA 3.48Å; I587-T679 PolarHBondContact O-N 2.83Å
588	K	92	Very high	87.3	Confident	155 Å²	155	74.9 Å²	74.9	67%	0.674	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.5	144.8	174.4	-66.6	-175.6	178.9	-176.9	0	110.5
589	L	90.7	Very high	85.8	Confident	14 Å²	14	81.6 Å²	81.6	7%	0.073	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	133.3	-172.5	-158.3	63.7	0	0	0	112.3	Y602 V604 T644 L648 L678 T679 I680 Q681	L589-Y602 HydrophobicContact CD1-CD1 4.06Å; L589-Y602 HydrophobicContact CD1-CE1 3.5Å; L589-Y602 VanDerWaalsContact CD1-CE1 3.5Å; L589-Y602 HydrophobicContact CD2-CD1 4.37Å; L589-V604 HydrophobicContact CD2-CG2 4.18Å; L589-T644 HydrophobicContact CD2-CG2 3.86Å; L589-L648 HydrophobicContact CD2-CD2 4.15Å; L589-L678 HydrophobicContact CB-CD1 3.66Å; L589-L678 HydrophobicContact CD2-CD1 4.16Å; L589-T679 PolarHBondContact N-O 3.13Å; L589-I680 CarbonylContact O-C 3.42Å; L589-I680 VanDerWaalsContact O-CA 3.29Å; L589-I680 WeakPolarHBondContact O-CA 3.27Å; L589-Q681 PolarHBondContact O-N 2.73Å
590	M	89.4	Confident	84.5	Confident	51 Å²	51	77.7 Å²	77.7	25%	0.251	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	153.6	171.2	-164.6	62.7	72.2	0	0	110.5	D594 R597 Q681	M590-D594 HydrophobicContact CB-CB 4.14Å; M590-D594 HydrophobicContact CG-CB 3.47Å; M590-D594 VanDerWaalsContact CG-CB 3.47Å; M590-D594 WeakPolarHBondContact CG-OD2 3.38Å; M590-R597 WeakPolarHBondContact O-CD 3.28Å; M590-R597 VanDerWaalsContact O-CZ 3.32Å; M590-R597 PolarHBondContact O-NE 2.9Å; M590-R597 PolarHBondContact O-NH1 3.07Å; M590-Q681 HydrophobicContact CE-CB 4.14Å; M590-Q681 VanDerWaalsContact SD-C 3.6Å; M590-Q681 HydrophobicContact SD-CB 3.58Å; M590-Q681 VanDerWaalsContact SD-CB 3.58Å; M590-Q681 VanDerWaalsContact SD-O 3.38Å
591	E	90.3	Very high	83.7	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	43%	0.425	C	S	.	.			trans	-64.1	168.8	173.7	76.1	-167.6	123.9	0	0	113.7	S593 D594 L648 R650 I680 Q681 D682 Y683	E591-S593 PolarHBondContact O-N 2.69Å; E591-D594 PolarHBondContact O-N 2.84Å; E591-L648 WeakPolarHBondContact CB-O 3.4Å; E591-R650 WeakPolarHBondContact OE2-CB 3.02Å; E591-R650 PolarHBondContact OE2-N 3.06Å; E591-I680 HydrophobicContact CB-CG2 4.13Å; E591-Q681 PolarHBondContact N-O 3.06Å; E591-D682 WeakPolarHBondContact OE1-CA 3.49Å; E591-Y683 PolarHBondContact OE1-N 2.84Å
592	D	86.5	Confident	83.5	Confident	26 Å²	26	77.5 Å²	77.5	14%	0.139	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-19.7	-173.5	-84.8	-51.4	0	0	0	114.1	D594 R597 G646 Q647 L648	D592-D594 PolarHBondContact O-N 3.09Å; D592-R597 IonicContact OD1-CZ 3.45Å; D592-R597 VanDerWaalsContact OD1-CZ 3.24Å; D592-R597 IonicContact OD1-NE 2.71Å; D592-R597 PolarHBondContact OD1-NE 2.73Å; D592-R597 IonicContact OD1-NH2 3.84Å; D592-R597 PolarHBondContact OD1-NH2 2.83Å; D592-R597 IonicContact OD2-NH2 2.87Å; D592-R597 PolarHBondContact OD2-NH2 3.39Å; D592-R597 VanDerWaalsContact OD2-NH2 3.13Å; D592-G646 WeakPolarHBondContact OD2-CA 3.36Å; D592-Q647 PolarHBondContact OD2-N 2.86Å; D592-Q647 VanDerWaalsContact OD2-N 3.16Å; D592-L648 PolarHBondContact N-O 3.01Å; D592-L648 WeakPolarHBondContact OD2-CA 3.31Å; D592-L648 WeakPolarHBondContact OD2-CB 3.05Å; D592-L648 PolarHBondContact OD2-N 2.91Å
593	S	84.3	Confident	83.5	Confident	51 Å²	51	77.4 Å²	77.4	36%	0.357	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-11.6	179.3	-64.2	0	0	0	0	114.7	E591 P595 Y683 D685	E591-S593 PolarHBondContact O-N 2.69Å; S593-P595 WeakPolarHBondContact O-CD 3.4Å; S593-Y683 VanDerWaalsContact O-CD1 3.3Å; S593-Y683 WeakPolarHBondContact O-CD1 3.34Å; S593-Y683 VanDerWaalsContact O-CE1 3.25Å; S593-Y683 WeakPolarHBondContact O-CE1 2.99Å; S593-D685 WeakPolarHBondContact CB-OD2 3.02Å; S593-D685 PolarHBondContact OG-OD2 3.3Å
594	D	84.9	Confident	83.5	Confident	22 Å²	22	73 Å²	73	12%	0.118	37%	0.371	C	S	.	.	S	Bend	trans	-67.6	122.6	170.3	178	0.3	0	0	0	110.6	M590 E591 D592 L596 R597 A598 Y683	M590-D594 HydrophobicContact CB-CB 4.14Å; M590-D594 HydrophobicContact CG-CB 3.47Å; M590-D594 VanDerWaalsContact CG-CB 3.47Å; M590-D594 WeakPolarHBondContact CG-OD2 3.38Å; E591-D594 PolarHBondContact O-N 2.84Å; D592-D594 PolarHBondContact O-N 3.09Å; D594-L596 PolarHBondContact O-N 3.37Å; D594-L596 WeakPolarHBondContact OD1-CB 2.98Å; D594-L596 PolarHBondContact OD1-N 2.9Å; D594-R597 HydrophobicContact CB-CB 4.2Å; D594-R597 CarbonylContact O-C 3.52Å; D594-R597 WeakPolarHBondContact O-CA 3.35Å; D594-R597 WeakPolarHBondContact O-CB 3.37Å; D594-R597 PolarHBondContact O-N 3.42Å; D594-A598 PolarHBondContact O-N 3.15Å; D594-A598 VanDerWaalsContact O-N 3.16Å; D594-Y683 HydrophobicContact CB-CD2 3.75Å; D594-Y683 HydrophobicContact CB-CE2 4.21Å; D594-Y683 HydrophobicContact CB-CG 4.13Å
595	P	78.9	Confident	83.5	Confident	88 Å²	88	70 Å²	70	57%	0.571	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-26.7	176.8	-25.2	32.3	0	0	0	114.3	S593 R597 Y683	S593-P595 WeakPolarHBondContact O-CD 3.4Å; P595-R597 PolarHBondContact O-N 2.84Å; P595-Y683 WeakPolarHBondContact CD-OH 3.13Å; P595-Y683 WeakPolarHBondContact CG-OH 3.26Å
596	L	76.5	Confident	83.6	Confident	149 Å²	149	70.7 Å²	70.7	78%	0.78	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-8.7	175.7	-61.3	175	0	0	0	112.9	D594	D594-L596 PolarHBondContact O-N 3.37Å; D594-L596 WeakPolarHBondContact OD1-CB 2.98Å; D594-L596 PolarHBondContact OD1-N 2.9Å
597	R	76.8	Confident	83.6	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.015	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.1	-4.7	-177.3	-119.2	-158	79.8	162.6	2.6	114.7	M590 D592 D594 P595 E599 Y602 T644	M590-R597 WeakPolarHBondContact O-CD 3.28Å; M590-R597 VanDerWaalsContact O-CZ 3.32Å; M590-R597 PolarHBondContact O-NE 2.9Å; M590-R597 PolarHBondContact O-NH1 3.07Å; D592-R597 IonicContact OD1-CZ 3.45Å; D592-R597 VanDerWaalsContact OD1-CZ 3.24Å; D592-R597 IonicContact OD1-NE 2.71Å; D592-R597 PolarHBondContact OD1-NE 2.73Å; D592-R597 IonicContact OD1-NH2 3.84Å; D592-R597 PolarHBondContact OD1-NH2 2.83Å; D592-R597 IonicContact OD2-NH2 2.87Å; D592-R597 PolarHBondContact OD2-NH2 3.39Å; D592-R597 VanDerWaalsContact OD2-NH2 3.13Å; D594-R597 HydrophobicContact CB-CB 4.2Å; D594-R597 CarbonylContact O-C 3.52Å; D594-R597 WeakPolarHBondContact O-CA 3.35Å; D594-R597 WeakPolarHBondContact O-CB 3.37Å; D594-R597 PolarHBondContact O-N 3.42Å; P595-R597 PolarHBondContact O-N 2.84Å; R597-E599 PolarHBondContact O-N 3.43Å; R597-Y602 HydrophobicContact CB-CD2 4.32Å; R597-Y602 HydrophobicContact CB-CE2 4.32Å; R597-Y602 HydrophobicContact CG-CD1 4.16Å; R597-Y602 HydrophobicContact CG-CD2 3.64Å; R597-Y602 HydrophobicContact CG-CE1 4.06Å; R597-Y602 HydrophobicContact CG-CE2 3.49Å; R597-Y602 VanDerWaalsContact CG-CE2 3.49Å; R597-Y602 HydrophobicContact CG-CG 3.95Å; R597-T644 PolarHBondContact NH2-OG1 3.11Å; R597-T644 VanDerWaalsContact NH2-OG1 3.1Å
598	A	60.4	Low	83.7	Confident	70 Å²	70	65 Å²	65	58%	0.579	34%	0.339	S	S	*	.			trans	-64.6	10.7	-169.7	0	0	0	0	0	116.2	D594	D594-A598 PolarHBondContact O-N 3.15Å; D594-A598 VanDerWaalsContact O-N 3.16Å
599	E	65.1	Low	83.8	Confident	148 Å²	148	58 Å²	58	69%	0.692	31%	0.311	S	S	*	.	S	Bend	trans	-80.8	121.4	173	-68.3	-173.6	176.2	0	0	110.2	R597 N601 Y602	R597-E599 PolarHBondContact O-N 3.43Å; E599-N601 PolarHBondContact O-N 2.66Å; E599-Y602 PolarHBondContact O-N 3.06Å; E599-Y602 VanDerWaalsContact O-N 3.08Å
600	V	66.1	Low	84	Confident	110 Å²	110	62.1 Å²	62.1	67%	0.667	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	133.2	166	-174.1	0	0	0	0	107.8
601	N	76.8	Confident	84.2	Confident	68 Å²	68	61.3 Å²	61.3	36%	0.364	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.2	38.9	-171.8	-40.6	-47.6	0	0	0	113.3	E599 Y603 Q634 Q643 T644	E599-N601 PolarHBondContact O-N 2.66Å; N601-Y603 PolarHBondContact O-N 2.82Å; N601-Q634 PolarHBondContact OD1-NE2 2.96Å; N601-Q643 HydrophobicContact CB-CB 4.09Å; N601-Q643 HydrophobicContact CB-CG 4.4Å; N601-Q643 PolarHBondContact O-NE2 3.11Å; N601-T644 WeakPolarHBondContact CA-O 3.06Å; N601-T644 PolarHBondContact N-O 3.4Å
602	Y	86.3	Confident	84.3	Confident	69 Å²	69	64.4 Å²	64.4	27%	0.271	36%	0.359	S	S	.	.			trans	-52.2	127.7	176	-173.7	-90.9	0	0	0	111.2	L589 R597 E599 V604 Q643 T644	L589-Y602 HydrophobicContact CD1-CD1 4.06Å; L589-Y602 HydrophobicContact CD1-CE1 3.5Å; L589-Y602 VanDerWaalsContact CD1-CE1 3.5Å; L589-Y602 HydrophobicContact CD2-CD1 4.37Å; R597-Y602 HydrophobicContact CB-CD2 4.32Å; R597-Y602 HydrophobicContact CB-CE2 4.32Å; R597-Y602 HydrophobicContact CG-CD1 4.16Å; R597-Y602 HydrophobicContact CG-CD2 3.64Å; R597-Y602 HydrophobicContact CG-CE1 4.06Å; R597-Y602 HydrophobicContact CG-CE2 3.49Å; R597-Y602 VanDerWaalsContact CG-CE2 3.49Å; R597-Y602 HydrophobicContact CG-CG 3.95Å; E599-Y602 PolarHBondContact O-N 3.06Å; E599-Y602 VanDerWaalsContact O-N 3.08Å; Y602-V604 PolarHBondContact O-N 2.83Å; Y602-Q643 WeakPolarHBondContact O-CA 3.35Å; Y602-T644 PolarHBondContact O-N 3.3Å; Y602-T644 VanDerWaalsContact O-N 3.11Å
603	Y	89.2	Confident	84.6	Confident	122 Å²	122	63.8 Å²	63.8	48%	0.478	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	115.2	179.2	175.2	-90.9	0	0	0	110.5	N601 M605 Q606 I641	N601-Y603 PolarHBondContact O-N 2.82Å; Y603-M605 VanDerWaalsContact CZ-CA 3.49Å; Y603-Q606 HydrophobicContact CE2-CB 4.09Å; Y603-Q606 PolarHBondContact OH-N 2.86Å; Y603-I641 HydrophobicContact CD2-CG2 3.65Å; Y603-I641 HydrophobicContact CE2-CG2 3.98Å
604	V	89.8	Confident	84.8	Confident	9 Å²	9	63.6 Å²	63.6	6%	0.055	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-58.6	172.4	-177.3	0	0	0	0	109.1	I587 L589 Y602 I642 T644	I587-V604 HydrophobicContact CD1-CG1 3.85Å; I587-V604 WeakPolarHBondContact CD1-O 3.14Å; I587-V604 HydrophobicContact CG2-CG1 4.11Å; L589-V604 HydrophobicContact CD2-CG2 4.18Å; Y602-V604 PolarHBondContact O-N 2.83Å; V604-I642 HydrophobicContact CB-CG2 4.17Å; V604-I642 WeakPolarHBondContact CB-O 3.42Å; V604-I642 PolarHBondContact N-O 3.49Å; V604-T644 HydrophobicContact CG2-CG2 3.46Å; V604-T644 VanDerWaalsContact CG2-CG2 3.46Å
605	M	92	Very high	85	Confident	24 Å²	24	65 Å²	65	12%	0.118	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	177	176.7	69.4	-179.1	-51	0	0	112.1	E585 Y603 I642 I676	E585-M605 HydrophobicContact CB-CE 3.79Å; E585-M605 HydrophobicContact CB-SD 4.17Å; E585-M605 HydrophobicContact CG-CE 3.64Å; Y603-M605 VanDerWaalsContact CZ-CA 3.49Å; M605-I642 HydrophobicContact CG-CB 4.28Å; M605-I642 HydrophobicContact CG-CD1 3.89Å; M605-I642 PolarHBondContact N-O 2.7Å; M605-I642 PolarHBondContact O-N 3.49Å; M605-I642 HydrophobicContact SD-CD1 4.4Å; M605-I676 HydrophobicContact SD-CD1 3.94Å; M605-I676 HydrophobicContact SD-CG1 4.4Å; M605-I676 HydrophobicContact SD-CG2 4.16Å
606	Q	93.9	Very high	85.4	Confident	80 Å²	80	67.6 Å²	67.6	37%	0.374	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	138	174	-175.8	-179.3	15.7	0	0	111.7	Y603 I608 N639 I641	Y603-Q606 HydrophobicContact CE2-CB 4.09Å; Y603-Q606 PolarHBondContact OH-N 2.86Å; Q606-I608 HydrophobicContact CG-CG1 4.06Å; Q606-N639 WeakPolarHBondContact CG-O 3.22Å; Q606-N639 PolarHBondContact NE2-O 3.15Å; Q606-I641 HydrophobicContact CB-CG1 4.16Å; Q606-I641 HydrophobicContact CG-CG1 3.84Å
607	V	94.3	Very high	86.1	Confident	11 Å²	11	61.7 Å²	61.7	7%	0.067	35%	0.345	C	S	.	.			trans	-109	147.1	168.4	-58.1	0	0	0	0	110.9	F580 Y622 I635 G640 I642 V660 V674	F580-V607 HydrophobicContact CE1-CB 3.95Å; F580-V607 HydrophobicContact CE1-CG2 3.97Å; V607-Y622 HydrophobicContact CG2-CD1 4.04Å; V607-Y622 HydrophobicContact CG2-CE1 4.28Å; V607-I635 HydrophobicContact CG2-CD1 3.99Å; V607-G640 WeakPolarHBondContact CG2-O 3.38Å; V607-G640 PolarHBondContact N-O 2.73Å; V607-G640 WeakPolarHBondContact O-CA 3.33Å; V607-I642 HydrophobicContact CG1-CD1 4.4Å; V607-V660 HydrophobicContact CG2-CG1 3.86Å; V607-V674 HydrophobicContact CG1-CG1 4.11Å
608	I	94.2	Very high	86.8	Confident	93 Å²	93	62.7 Å²	62.7	48%	0.477	35%	0.354	S	S	.	.			trans	-138	133.1	-172.7	-57.3	177.5	0	0	0	111.8	F580 P581 Q606	F580-I608 WeakPolarHBondContact CD1-O 3.36Å; P581-I608 WeakPolarHBondContact CD-O 3.37Å; Q606-I608 HydrophobicContact CG-CG1 4.06Å
609	A	94.2	Very high	88.3	Confident	10 Å²	10	63.8 Å²	63.8	8%	0.083	35%	0.348	C	S	.	.			trans	-133.4	161.1	171.6	0	0	0	0	0	113	R579 F580 I620 Y622 A662	R579-A609 WeakPolarHBondContact O-CA 2.99Å; R579-A609 WeakPolarHBondContact O-CB 2.98Å; F580-A609 HydrophobicContact CD1-CB 4.08Å; F580-A609 HydrophobicContact CE1-CB 4.18Å; F580-A609 HydrophobicContact CG-CB 4.34Å; A609-I620 VanDerWaalsContact C-CD1 3.47Å; A609-I620 HydrophobicContact CB-CD1 4.16Å; A609-I620 WeakPolarHBondContact O-CD1 3.46Å; A609-Y622 HydrophobicContact CB-CE1 4.11Å; A609-Y622 PolarHBondContact N-OH 2.92Å; A609-Y622 PolarHBondContact O-OH 2.8Å; A609-A662 HydrophobicContact CB-CB 3.94Å
610	T	94.1	Very high	89.7	Confident	99 Å²	99	57.8 Å²	57.8	61%	0.607	32%	0.32	S	S	*	.	B	Isolated β-bridge	trans	-137.9	147.2	-173.3	57.8	0	0	0	0	116	P578 R579	P578-T610 WeakPolarHBondContact CA-O 3.46Å; R579-T610 PolarHBondContact N-O 2.74Å; R579-T610 PolarHBondContact O-N 2.91Å
611	D	94.5	Very high	91.1	Very high	35 Å²	35	53.9 Å²	53.9	19%	0.187	30%	0.295	C	S	.	.			trans	-144.1	154.8	179.4	-154.4	-37.5	0	0	0	112.8	N576 E577 P578 A618 I620	N576-D611 VanDerWaalsContact CB-OD1 3.31Å; N576-D611 WeakPolarHBondContact CB-OD1 3.17Å; E577-D611 VanDerWaalsContact CA-OD2 3.31Å; E577-D611 WeakPolarHBondContact CA-OD2 3.11Å; E577-D611 PolarHBondContact N-OD1 2.69Å; P578-D611 WeakPolarHBondContact CD-OD2 3.14Å; D611-A618 HydrophobicContact CB-CB 4.02Å; D611-I620 HydrophobicContact CB-CD1 4.23Å; D611-I620 HydrophobicContact CB-CG1 4.34Å
612	A	90.8	Very high	92	Very high	65 Å²	65	51.1 Å²	51.1	54%	0.537	28%	0.279	S	S	.	.			trans	-112.6	-10	-163.8	0	0	0	0	0	118.1	N576	N576-A612 HydrophobicContact CB-CB 4Å
613	D	93.6	Very high	92.4	Very high	13 Å²	13	51.8 Å²	51.8	7%	0.07	28%	0.282	C	S	.	.	S	Bend	trans	-74.1	-169.2	177.9	-60.9	-42.1	0	0	0	113.7	N574 D575 N576 N617 A618	N574-D613 PolarHBondContact OD1-OD2 3.49Å; D575-D613 PolarHBondContact N-OD1 2.74Å; D575-D613 VanDerWaalsContact N-OD1 3.11Å; D575-D613 PolarHBondContact N-OD2 3.39Å; D575-D613 VanDerWaalsContact N-OD2 3.14Å; N576-D613 WeakPolarHBondContact CA-OD2 3.33Å; N576-D613 WeakPolarHBondContact CB-OD2 3.03Å; N576-D613 PolarHBondContact N-OD1 3.03Å; N576-D613 PolarHBondContact N-OD2 3.33Å; N576-D613 PolarHBondContact ND2-OD1 3.2Å; D613-N617 HydrophobicContact CB-CB 3.3Å; D613-A618 HydrophobicContact CB-CB 4.18Å; D613-A618 WeakPolarHBondContact O-CB 3.36Å
614	S	87.5	Confident	92.7	Very high	47 Å²	47	46.5 Å²	46.5	33%	0.329	26%	0.262	S	S	.	.	S	Bend	trans	-108	151	171.6	-156.9	0	0	0	0	113.8	R540 D572 K616 N617	R540-S614 PolarHBondContact NH1-OG 2.96Å; D572-S614 WeakPolarHBondContact OD1-CB 3.11Å; D572-S614 PolarHBondContact OD1-N 3.42Å; S614-K616 PolarHBondContact O-N 3.11Å; S614-N617 WeakPolarHBondContact O-CB 3.24Å; S614-N617 PolarHBondContact O-N 2.86Å
615	G	89.1	Confident	92.8	Very high	51 Å²	51	48.3 Å²	48.3	53%	0.526	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	57.1	-132.6	175	0	0	0	0	0	112.1	N617 A618 E619	G615-N617 PolarHBondContact O-N 3.28Å; G615-N617 VanDerWaalsContact O-N 3.11Å; G615-A618 PolarHBondContact O-N 3.36Å; G615-A618 VanDerWaalsContact O-N 3.12Å; G615-E619 PolarHBondContact O-N 3.05Å
616	K	89.1	Confident	92.9	Very high	142 Å²	142	50 Å²	50	62%	0.617	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-57.8	-28.2	-176.5	-69.7	-171.8	176.8	-178.5	0	113.6	S614 A618 E619 L665 G666	S614-K616 PolarHBondContact O-N 3.11Å; K616-A618 VanDerWaalsContact C-N 3.27Å; K616-A618 PolarHBondContact O-N 2.93Å; K616-E619 PolarHBondContact O-N 2.79Å; K616-L665 HydrophobicContact CB-CB 3.99Å; K616-L665 HydrophobicContact CG-CB 4.45Å; K616-L665 CarbonylContact O-C 3.34Å; K616-L665 WeakPolarHBondContact O-CA 3.4Å; K616-L665 VanDerWaalsContact O-CB 3.22Å; K616-L665 WeakPolarHBondContact O-CB 3.17Å; K616-L665 PolarHBondContact O-N 3.03Å; K616-G666 PolarHBondContact O-N 2.81Å
617	N	91	Very high	92.6	Very high	25 Å²	25	53.2 Å²	53.2	13%	0.134	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-68.3	-29.8	-176.7	-62.2	-21	0	0	0	111.5	D572 N574 D613 S614 G615	D572-N617 PolarHBondContact OD2-ND2 2.99Å; N574-N617 WeakPolarHBondContact CA-ND2 3.34Å; N574-N617 HydrophobicContact CB-CB 3.83Å; N574-N617 VanDerWaalsContact CB-OD1 3.3Å; N574-N617 WeakPolarHBondContact CB-OD1 2.88Å; N574-N617 PolarHBondContact N-ND2 2.83Å; N574-N617 WeakPolarHBondContact OD1-CB 2.96Å; D613-N617 HydrophobicContact CB-CB 3.3Å; S614-N617 WeakPolarHBondContact O-CB 3.24Å; S614-N617 PolarHBondContact O-N 2.86Å; G615-N617 PolarHBondContact O-N 3.28Å; G615-N617 VanDerWaalsContact O-N 3.11Å
618	A	91.1	Very high	92.3	Very high	26 Å²	26	57.4 Å²	57.4	22%	0.215	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-107.1	4.1	175.7	0	0	0	0	0	114.6	D611 D613 G615 K616 I620	D611-A618 HydrophobicContact CB-CB 4.02Å; D613-A618 HydrophobicContact CB-CB 4.18Å; D613-A618 WeakPolarHBondContact O-CB 3.36Å; G615-A618 PolarHBondContact O-N 3.36Å; G615-A618 VanDerWaalsContact O-N 3.12Å; K616-A618 VanDerWaalsContact C-N 3.27Å; K616-A618 PolarHBondContact O-N 2.93Å; A618-I620 PolarHBondContact O-N 2.98Å
619	E	92.4	Very high	92.1	Very high	93 Å²	93	53.1 Å²	53.1	44%	0.435	31%	0.309	S	S	.	.			trans	-85.3	115.1	-174.2	-171.6	175	174	0	0	110.8	G615 K616 D664 L665	G615-E619 PolarHBondContact O-N 3.05Å; K616-E619 PolarHBondContact O-N 2.79Å; E619-D664 CarbonylContact O-C 3.44Å; E619-D664 WeakPolarHBondContact O-CA 3.43Å; E619-L665 HydrophobicContact CB-CB 4.37Å; E619-L665 HydrophobicContact CB-CD1 4.03Å; E619-L665 HydrophobicContact CB-CG 4.3Å; E619-L665 HydrophobicContact CG-CD1 3.75Å; E619-L665 HydrophobicContact CG-CG 4.42Å; E619-L665 WeakPolarHBondContact O-CG 3.49Å; E619-L665 PolarHBondContact O-N 2.78Å; E619-L665 VanDerWaalsContact O-N 3.08Å
620	I	94.3	Very high	91.5	Very high	21 Å²	21	58.3 Å²	58.3	11%	0.108	33%	0.326	C	S	.	.			trans	-98	133.6	-174.4	-59.5	170.4	0	0	0	110.9	P578 A609 D611 A618 Y622 A662 K663	P578-I620 HydrophobicContact CB-CD1 3.97Å; P578-I620 HydrophobicContact CB-CG1 4.06Å; P578-I620 HydrophobicContact CG-CD1 4.49Å; P578-I620 HydrophobicContact CG-CG1 4.1Å; A609-I620 VanDerWaalsContact C-CD1 3.47Å; A609-I620 HydrophobicContact CB-CD1 4.16Å; A609-I620 WeakPolarHBondContact O-CD1 3.46Å; D611-I620 HydrophobicContact CB-CD1 4.23Å; D611-I620 HydrophobicContact CB-CG1 4.34Å; A618-I620 PolarHBondContact O-N 2.98Å; I620-Y622 HydrophobicContact CG2-CE1 4.31Å; I620-Y622 HydrophobicContact CG2-CE2 4.21Å; I620-A662 HydrophobicContact CG2-CB 3.78Å; I620-K663 CarbonylContact C-O 3.42Å; I620-K663 WeakPolarHBondContact CA-O 3.45Å
621	I	95.1	Very high	91.1	Very high	28 Å²	28	59.3 Å²	59.3	14%	0.144	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	131.5	169.8	-51.6	-166.9	0	0	0	112.3	Y623 Q637 A662 K663 L665	I621-Y623 HydrophobicContact CB-CE2 3.81Å; I621-Y623 WeakPolarHBondContact CB-OH 3.35Å; I621-Y623 HydrophobicContact CG2-CD1 4.36Å; I621-Y623 HydrophobicContact CG2-CD2 4.33Å; I621-Y623 HydrophobicContact CG2-CE1 3.59Å; I621-Y623 HydrophobicContact CG2-CE2 3.56Å; I621-Y623 WeakPolarHBondContact CG2-OH 3.43Å; I621-Q637 CarbonylContact C-O 3.39Å; I621-Q637 VanDerWaalsContact CA-O 3.29Å; I621-Q637 WeakPolarHBondContact CA-O 3.2Å; I621-Q637 HydrophobicContact CG2-CB 3.86Å; I621-Q637 HydrophobicContact CG2-CG 4.23Å; I621-A662 CarbonylContact O-C 3.58Å; I621-A662 WeakPolarHBondContact O-CA 3.17Å; I621-K663 PolarHBondContact N-O 2.92Å; I621-K663 PolarHBondContact O-N 3.49Å; I621-L665 HydrophobicContact CD1-CD1 3.87Å; I621-L665 HydrophobicContact CD1-CD2 3.62Å; I621-L665 HydrophobicContact CD1-CG 4.11Å; I621-L665 HydrophobicContact CG1-CD1 4.13Å; I621-L665 HydrophobicContact CG1-CD2 3.96Å; I621-L665 HydrophobicContact CG1-CG 4.12Å
622	Y	96.4	Very high	90.8	Very high	10 Å²	10	58.5 Å²	58.5	4%	0.039	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	144.5	175.5	-56.4	-85	0	0	0	113.4	F580 V607 A609 I620 Q637 I661 A662	F580-Y622 HydrophobicContact CE1-CD1 4.03Å; F580-Y622 AromaticContact CE1-CE1 3.62Å; F580-Y622 HydrophobicContact CE1-CE1 3.62Å; F580-Y622 AromaticContact CZ-CD1 3.84Å; F580-Y622 HydrophobicContact CZ-CD1 3.84Å; F580-Y622 AromaticContact CZ-CE1 3.79Å; F580-Y622 HydrophobicContact CZ-CE1 3.79Å; V607-Y622 HydrophobicContact CG2-CD1 4.04Å; V607-Y622 HydrophobicContact CG2-CE1 4.28Å; A609-Y622 HydrophobicContact CB-CE1 4.11Å; A609-Y622 PolarHBondContact N-OH 2.92Å; A609-Y622 PolarHBondContact O-OH 2.8Å; I620-Y622 HydrophobicContact CG2-CE1 4.31Å; I620-Y622 HydrophobicContact CG2-CE2 4.21Å; Y622-Q637 WeakPolarHBondContact CD2-O 3.46Å; Y622-Q637 PolarHBondContact N-O 3.3Å; Y622-Q637 WeakPolarHBondContact O-CG 3.44Å; Y622-I661 CarbonylContact C-O 3.46Å; Y622-I661 WeakPolarHBondContact CA-O 3.49Å; Y622-A662 HydrophobicContact CD1-CB 3.97Å; Y622-A662 HydrophobicContact CE1-CB 3.91Å
623	Y	93.7	Very high	90.7	Very high	83 Å²	83	55.4 Å²	55.4	33%	0.325	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	146.1	177.5	-51.4	-85.6	0	0	0	113	I621 V660 I661 K663	I621-Y623 HydrophobicContact CB-CE2 3.81Å; I621-Y623 WeakPolarHBondContact CB-OH 3.35Å; I621-Y623 HydrophobicContact CG2-CD1 4.36Å; I621-Y623 HydrophobicContact CG2-CD2 4.33Å; I621-Y623 HydrophobicContact CG2-CE1 3.59Å; I621-Y623 HydrophobicContact CG2-CE2 3.56Å; I621-Y623 WeakPolarHBondContact CG2-OH 3.43Å; Y623-V660 CarbonylContact O-C 3.57Å; Y623-V660 WeakPolarHBondContact O-CA 3.44Å; Y623-I661 PolarHBondContact N-O 2.88Å; Y623-I661 PolarHBondContact O-N 2.84Å; Y623-K663 HydrophobicContact CE2-CB 4.47Å
624	I	95.4	Very high	90.6	Very high	11 Å²	11	58.1 Å²	58.1	6%	0.056	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	129.2	167	-67.1	163.6	0	0	0	109.5	V629 R630 I633 I635 F658 T659 V660	I624-V629 HydrophobicContact CG2-CG2 3.9Å; I624-R630 PolarHBondContact O-NH2 3.02Å; I624-I633 HydrophobicContact CD1-CG2 4.07Å; I624-I635 HydrophobicContact CB-CG2 4.48Å; I624-I635 HydrophobicContact CD1-CB 3.86Å; I624-I635 HydrophobicContact CD1-CG2 3.96Å; I624-I635 HydrophobicContact CG1-CB 3.92Å; I624-I635 HydrophobicContact CG1-CG2 3.68Å; I624-F658 HydrophobicContact CD1-CD2 4.22Å; I624-F658 HydrophobicContact CD1-CE2 4.16Å; I624-F658 HydrophobicContact CG1-CD2 4.02Å; I624-F658 HydrophobicContact CG1-CE2 4.24Å; I624-F658 HydrophobicContact CG2-CB 4.04Å; I624-F658 HydrophobicContact CG2-CD2 3.9Å; I624-F658 HydrophobicContact CG2-CG 4.29Å; I624-T659 CarbonylContact C-O 3.46Å; I624-T659 VanDerWaalsContact CA-O 3.31Å; I624-T659 WeakPolarHBondContact CA-O 3.34Å; I624-V660 HydrophobicContact CG1-CG2 4.25Å
625	A	93.1	Very high	91	Very high	47 Å²	47	56.9 Å²	56.9	39%	0.388	30%	0.299	S	S	.	.	S	Bend	trans	-70.7	-47	-176.4	0	0	0	0	0	112.6	R630 T659	A625-R630 PolarHBondContact O-NH2 3.43Å; A625-R630 VanDerWaalsContact O-NH2 3.12Å; A625-T659 PolarHBondContact N-O 3.49Å
626	E	93.1	Very high	91.2	Very high	59 Å²	59	57 Å²	57	28%	0.276	29%	0.288	S	S	.	.			trans	-80.5	129.2	-172	-62.8	78.4	179.6	0	0	112.1	V629 R630 F658 T659	E626-V629 HydrophobicContact CB-CG2 4.46Å; E626-R630 WeakPolarHBondContact O-CG 3.23Å; E626-R630 PolarHBondContact O-NE 2.77Å; E626-F658 HydrophobicContact CB-CB 4.42Å; E626-F658 VanDerWaalsContact OE2-CA 3.29Å; E626-F658 WeakPolarHBondContact OE2-CA 3.45Å; E626-F658 WeakPolarHBondContact OE2-CB 3.3Å; E626-T659 WeakPolarHBondContact OE1-CB 3.27Å; E626-T659 PolarHBondContact OE1-N 2.83Å; E626-T659 PolarHBondContact OE1-OG1 2.83Å; E626-T659 PolarHBondContact OE2-N 3.47Å
627	E	88.3	Confident	91.4	Very high	149 Å²	149	55.3 Å²	55.3	70%	0.696	28%	0.282	S	S	*	.	S	Bend	trans	-77.9	-28.4	-179.6	-74	-179.6	176.6	0	0	113.8	V629 R630	E627-V629 PolarHBondContact O-N 3.32Å; E627-V629 VanDerWaalsContact O-N 3.17Å; E627-R630 PolarHBondContact O-N 3.03Å
628	S	87	Confident	91.4	Very high	99 Å²	99	58.9 Å²	58.9	69%	0.692	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-23.2	-174.9	52.5	0	0	0	0	114.3
629	V	89.7	Confident	91.5	Very high	3 Å²	3	60.2 Å²	60.2	2%	0.018	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-11	-179.4	-59.9	0	0	0	0	113.3	I624 E626 E627 N631 I632 I633 L656 F658	I624-V629 HydrophobicContact CG2-CG2 3.9Å; E626-V629 HydrophobicContact CB-CG2 4.46Å; E627-V629 PolarHBondContact O-N 3.32Å; E627-V629 VanDerWaalsContact O-N 3.17Å; V629-N631 PolarHBondContact O-N 3.41Å; V629-N631 VanDerWaalsContact O-N 3.1Å; V629-I632 PolarHBondContact O-N 2.92Å; V629-I633 PolarHBondContact O-N 2.92Å; V629-L656 HydrophobicContact CG1-CD2 4.47Å; V629-F658 HydrophobicContact CG1-CB 4.45Å; V629-F658 HydrophobicContact CG2-CB 3.72Å; V629-F658 HydrophobicContact CG2-CD1 4.29Å; V629-F658 HydrophobicContact CG2-CG 4.02Å
630	R	82.4	Confident	91.6	Very high	118 Å²	118	55.8 Å²	55.8	45%	0.445	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-20.3	-171.7	-65.5	-174.3	-164.7	179.4	10.4	113.8	I624 A625 E626 E627 I633	I624-R630 PolarHBondContact O-NH2 3.02Å; A625-R630 PolarHBondContact O-NH2 3.43Å; A625-R630 VanDerWaalsContact O-NH2 3.12Å; E626-R630 WeakPolarHBondContact O-CG 3.23Å; E626-R630 PolarHBondContact O-NE 2.77Å; E627-R630 PolarHBondContact O-N 3.03Å; R630-I633 WeakPolarHBondContact CA-O 3.26Å
631	N	85.4	Confident	91.6	Very high	120 Å²	120	56.5 Å²	56.5	64%	0.642	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-21.8	175.1	-65.4	-7.4	0	0	0	112.8	V629 T645 Q647	V629-N631 PolarHBondContact O-N 3.41Å; V629-N631 VanDerWaalsContact O-N 3.1Å; N631-T645 PolarHBondContact O-OG1 3.33Å; N631-Q647 PolarHBondContact O-OE1 3.48Å
632	I	87.9	Confident	91.5	Very high	18 Å²	18	55.1 Å²	55.1	9%	0.092	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-29.9	-174.2	-51.3	167.2	0	0	0	111	V629 T644 T645 L648 L656	V629-I632 PolarHBondContact O-N 2.92Å; I632-T644 CarbonylContact O-C 3.54Å; I632-T644 VanDerWaalsContact O-CA 3.31Å; I632-T644 WeakPolarHBondContact O-CA 3.35Å; I632-T645 VanDerWaalsContact C-OG1 3.31Å; I632-T645 VanDerWaalsContact CA-OG1 3.25Å; I632-T645 WeakPolarHBondContact CA-OG1 3.5Å; I632-T645 PolarHBondContact O-N 2.98Å; I632-T645 PolarHBondContact O-OG1 2.78Å; I632-L648 HydrophobicContact CG2-CD1 3.61Å; I632-L656 HydrophobicContact CB-CD1 4.12Å; I632-L656 HydrophobicContact CD1-CD1 4.03Å; I632-L656 HydrophobicContact CD1-CD2 3.78Å; I632-L656 HydrophobicContact CG2-CD1 3.63Å
633	I	90.3	Very high	91.3	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.005	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	132.3	-175.1	-56.1	179.8	0	0	0	109.2	I624 V629 R630 I642 Q643 L656 F658 L678	I624-I633 HydrophobicContact CD1-CG2 4.07Å; V629-I633 PolarHBondContact O-N 2.92Å; R630-I633 WeakPolarHBondContact CA-O 3.26Å; I633-I642 HydrophobicContact CG2-CG2 3.33Å; I633-Q643 WeakPolarHBondContact CA-O 3.33Å; I633-L656 HydrophobicContact CD1-CB 4.48Å; I633-L656 HydrophobicContact CD1-CD1 3.99Å; I633-L656 HydrophobicContact CG1-CD1 4.32Å; I633-F658 HydrophobicContact CD1-CD1 3.93Å; I633-F658 HydrophobicContact CD1-CE1 3.31Å; I633-F658 HydrophobicContact CD1-CZ 3.92Å; I633-F658 HydrophobicContact CG2-CE1 4.34Å; I633-F658 HydrophobicContact CG2-CE2 4.34Å; I633-F658 HydrophobicContact CG2-CZ 3.93Å; I633-L678 HydrophobicContact CD1-CD2 3.82Å
634	Q	91.3	Very high	91	Very high	70 Å²	70	52.9 Å²	52.9	33%	0.327	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	148.3	172.5	62.5	-172.2	-14.1	0	0	110	N601 I642 Q643 T645	N601-Q634 PolarHBondContact OD1-NE2 2.96Å; Q634-I642 WeakPolarHBondContact O-CA 3.24Å; Q634-Q643 HydrophobicContact CG-CB 4.12Å; Q634-Q643 PolarHBondContact N-O 3.21Å; Q634-Q643 PolarHBondContact O-N 3.19Å; Q634-T645 HydrophobicContact CB-CG2 4.32Å; Q634-T645 HydrophobicContact CG-CG2 4.27Å
635	I	94.8	Very high	90.5	Very high	21 Å²	21	54.1 Å²	54.1	11%	0.108	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	132	166.9	-169.1	165.8	0	0	0	108.5	V607 I624 Q637 I641 I642 V660	V607-I635 HydrophobicContact CG2-CD1 3.99Å; I624-I635 HydrophobicContact CB-CG2 4.48Å; I624-I635 HydrophobicContact CD1-CB 3.86Å; I624-I635 HydrophobicContact CD1-CG2 3.96Å; I624-I635 HydrophobicContact CG1-CB 3.92Å; I624-I635 HydrophobicContact CG1-CG2 3.68Å; I635-Q637 PolarHBondContact O-N 3.45Å; I635-I641 CarbonylContact C-O 3.55Å; I635-I641 WeakPolarHBondContact CA-O 3.08Å; I635-I642 HydrophobicContact CB-CG1 4.31Å; I635-I642 HydrophobicContact CD1-CG1 3.99Å; I635-I642 HydrophobicContact CG1-CG1 3.99Å; I635-V660 HydrophobicContact CD1-CB 4.29Å; I635-V660 HydrophobicContact CD1-CG1 3.35Å; I635-V660 HydrophobicContact CD1-CG2 3.9Å
636	N	92.6	Very high	89.8	Confident	54 Å²	54	53.5 Å²	53.5	29%	0.289	28%	0.284	S	S	.	.			trans	-70.6	116.5	169.2	177	-45.9	0	0	0	108.5	T638 N639 G640 I641	N636-T638 PolarHBondContact O-N 2.73Å; N636-T638 VanDerWaalsContact O-N 3.14Å; N636-T638 PolarHBondContact OD1-N 2.96Å; N636-T638 PolarHBondContact OD1-OG1 3Å; N636-N639 WeakPolarHBondContact CB-OD1 3.39Å; N636-N639 PolarHBondContact ND2-ND2 2.88Å; N636-N639 PolarHBondContact OD1-N 2.86Å; N636-N639 VanDerWaalsContact OD1-N 3.11Å; N636-N639 PolarHBondContact OD1-OD1 2.84Å; N636-G640 WeakPolarHBondContact O-CA 3.06Å; N636-G640 PolarHBondContact O-N 2.93Å; N636-I641 HydrophobicContact CB-CB 4.4Å; N636-I641 PolarHBondContact N-O 3.17Å
637	Q	93.6	Very high	89.2	Confident	106 Å²	106	56.6 Å²	56.6	50%	0.495	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-20.4	-173.6	-76.2	-169.9	-14.4	0	0	113.9	I621 Y622 I635	I621-Q637 CarbonylContact C-O 3.39Å; I621-Q637 VanDerWaalsContact CA-O 3.29Å; I621-Q637 WeakPolarHBondContact CA-O 3.2Å; I621-Q637 HydrophobicContact CG2-CB 3.86Å; I621-Q637 HydrophobicContact CG2-CG 4.23Å; Y622-Q637 WeakPolarHBondContact CD2-O 3.46Å; Y622-Q637 PolarHBondContact N-O 3.3Å; Y622-Q637 WeakPolarHBondContact O-CG 3.44Å; I635-Q637 PolarHBondContact O-N 3.45Å
638	T	91.8	Very high	89.2	Confident	100 Å²	100	49.7 Å²	49.7	61%	0.613	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-29.8	-175.3	59.2	0	0	0	0	113.7	N636	N636-T638 PolarHBondContact O-N 2.73Å; N636-T638 VanDerWaalsContact O-N 3.14Å; N636-T638 PolarHBondContact OD1-N 2.96Å; N636-T638 PolarHBondContact OD1-OG1 3Å
639	N	93.1	Very high	89.3	Confident	54 Å²	54	47 Å²	47	29%	0.289	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.6	-2.8	-176.4	69.3	20.5	0	0	0	114.6	Q606 N636 I641	Q606-N639 WeakPolarHBondContact CG-O 3.22Å; Q606-N639 PolarHBondContact NE2-O 3.15Å; N636-N639 WeakPolarHBondContact CB-OD1 3.39Å; N636-N639 PolarHBondContact ND2-ND2 2.88Å; N636-N639 PolarHBondContact OD1-N 2.86Å; N636-N639 VanDerWaalsContact OD1-N 3.11Å; N636-N639 PolarHBondContact OD1-OD1 2.84Å; N639-I641 WeakPolarHBondContact ND2-CD1 3.09Å; N639-I641 PolarHBondContact O-N 3.03Å; N639-I641 VanDerWaalsContact OD1-CB 3.28Å; N639-I641 WeakPolarHBondContact OD1-CB 3.43Å; N639-I641 WeakPolarHBondContact OD1-CG1 3.5Å; N639-I641 PolarHBondContact OD1-N 2.87Å
640	G	93.8	Very high	89.4	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.251	C	S	.	.			trans	68.8	13.5	177.5	0	0	0	0	0	114.7	V607 N636 I642	V607-G640 WeakPolarHBondContact CG2-O 3.38Å; V607-G640 PolarHBondContact N-O 2.73Å; V607-G640 WeakPolarHBondContact O-CA 3.33Å; N636-G640 WeakPolarHBondContact O-CA 3.06Å; N636-G640 PolarHBondContact O-N 2.93Å; G640-I642 PolarHBondContact O-N 3Å
641	I	95.2	Very high	89.8	Confident	35 Å²	35	46.1 Å²	46.1	18%	0.179	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	127.8	175	-62.1	175.7	0	0	0	109.3	Y603 Q606 I635 N636 N639 Q643	Y603-I641 HydrophobicContact CD2-CG2 3.65Å; Y603-I641 HydrophobicContact CE2-CG2 3.98Å; Q606-I641 HydrophobicContact CB-CG1 4.16Å; Q606-I641 HydrophobicContact CG-CG1 3.84Å; I635-I641 CarbonylContact C-O 3.55Å; I635-I641 WeakPolarHBondContact CA-O 3.08Å; N636-I641 HydrophobicContact CB-CB 4.4Å; N636-I641 PolarHBondContact N-O 3.17Å; N639-I641 WeakPolarHBondContact ND2-CD1 3.09Å; N639-I641 PolarHBondContact O-N 3.03Å; N639-I641 VanDerWaalsContact OD1-CB 3.28Å; N639-I641 WeakPolarHBondContact OD1-CB 3.43Å; N639-I641 WeakPolarHBondContact OD1-CG1 3.5Å; N639-I641 PolarHBondContact OD1-N 2.87Å; I641-Q643 HydrophobicContact CG2-CG 3.63Å
642	I	93.7	Very high	90	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	124.9	175	-61.7	169.2	0	0	0	108.1	V604 M605 V607 I633 Q634 I635 G640 F658 V660 I676	V604-I642 HydrophobicContact CB-CG2 4.17Å; V604-I642 WeakPolarHBondContact CB-O 3.42Å; V604-I642 PolarHBondContact N-O 3.49Å; M605-I642 HydrophobicContact CG-CB 4.28Å; M605-I642 HydrophobicContact CG-CD1 3.89Å; M605-I642 PolarHBondContact N-O 2.7Å; M605-I642 PolarHBondContact O-N 3.49Å; M605-I642 HydrophobicContact SD-CD1 4.4Å; V607-I642 HydrophobicContact CG1-CD1 4.4Å; I633-I642 HydrophobicContact CG2-CG2 3.33Å; Q634-I642 WeakPolarHBondContact O-CA 3.24Å; I635-I642 HydrophobicContact CB-CG1 4.31Å; I635-I642 HydrophobicContact CD1-CG1 3.99Å; I635-I642 HydrophobicContact CG1-CG1 3.99Å; G640-I642 PolarHBondContact O-N 3Å; I642-F658 HydrophobicContact CD1-CE2 3.98Å; I642-F658 HydrophobicContact CD1-CZ 4.29Å; I642-F658 HydrophobicContact CG2-CE2 4.29Å; I642-F658 HydrophobicContact CG2-CZ 3.95Å; I642-V660 HydrophobicContact CD1-CG2 4.16Å; I642-I676 HydrophobicContact CD1-CD1 3.12Å
643	Q	91.2	Very high	89.9	Confident	46 Å²	46	50.3 Å²	50.3	22%	0.215	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	148.4	-176.5	-57.3	179.1	-74.2	0	0	110.1	N601 Y602 I633 Q634 I641	N601-Q643 HydrophobicContact CB-CB 4.09Å; N601-Q643 HydrophobicContact CB-CG 4.4Å; N601-Q643 PolarHBondContact O-NE2 3.11Å; Y602-Q643 WeakPolarHBondContact O-CA 3.35Å; I633-Q643 WeakPolarHBondContact CA-O 3.33Å; Q634-Q643 HydrophobicContact CG-CB 4.12Å; Q634-Q643 PolarHBondContact N-O 3.21Å; Q634-Q643 PolarHBondContact O-N 3.19Å; I641-Q643 HydrophobicContact CG2-CG 3.63Å
644	T	88.4	Confident	90	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	150.4	168	69.2	0	0	0	0	109.8	L589 R597 N601 Y602 V604 I632 G646	L589-T644 HydrophobicContact CD2-CG2 3.86Å; R597-T644 PolarHBondContact NH2-OG1 3.11Å; R597-T644 VanDerWaalsContact NH2-OG1 3.1Å; N601-T644 WeakPolarHBondContact CA-O 3.06Å; N601-T644 PolarHBondContact N-O 3.4Å; Y602-T644 PolarHBondContact O-N 3.3Å; Y602-T644 VanDerWaalsContact O-N 3.11Å; V604-T644 HydrophobicContact CG2-CG2 3.46Å; V604-T644 VanDerWaalsContact CG2-CG2 3.46Å; I632-T644 CarbonylContact O-C 3.54Å; I632-T644 VanDerWaalsContact O-CA 3.31Å; I632-T644 WeakPolarHBondContact O-CA 3.35Å; T644-G646 VanDerWaalsContact C-N 3.26Å; T644-G646 PolarHBondContact O-N 3.46Å
645	T	83.7	Confident	90	Very high	37 Å²	37	54.1 Å²	54.1	23%	0.227	29%	0.293	C	S	.	.			trans	-87	6.1	176.9	54.9	0	0	0	0	112.9	N631 I632 Q634	N631-T645 PolarHBondContact O-OG1 3.33Å; I632-T645 VanDerWaalsContact C-OG1 3.31Å; I632-T645 VanDerWaalsContact CA-OG1 3.25Å; I632-T645 WeakPolarHBondContact CA-OG1 3.5Å; I632-T645 PolarHBondContact O-N 2.98Å; I632-T645 PolarHBondContact O-OG1 2.78Å; Q634-T645 HydrophobicContact CB-CG2 4.32Å; Q634-T645 HydrophobicContact CG-CG2 4.27Å
646	G	79.1	Confident	89.9	Confident	34 Å²	34	54.1 Å²	54.1	35%	0.351	29%	0.293	S	S	.	.	S	Bend	trans	83.3	17.7	-177.5	0	0	0	0	0	115	D592 T644	D592-G646 WeakPolarHBondContact OD2-CA 3.36Å; T644-G646 VanDerWaalsContact C-N 3.26Å; T644-G646 PolarHBondContact O-N 3.46Å
647	Q	79.8	Confident	89.9	Confident	124 Å²	124	53.7 Å²	53.7	58%	0.579	30%	0.295	S	S	*	.			trans	-114.9	22.5	-179.5	-60.8	-172.3	-4.5	0	0	113.2	D592 N631 D649	D592-Q647 PolarHBondContact OD2-N 2.86Å; D592-Q647 VanDerWaalsContact OD2-N 3.16Å; N631-Q647 PolarHBondContact O-OE1 3.48Å; Q647-D649 PolarHBondContact O-N 3.47Å
648	L	87.7	Confident	89.9	Confident	4 Å²	4	48.7 Å²	48.7	2%	0.021	27%	0.271	C	S	.	.			trans	-82.5	104.2	174.8	-151.6	78	0	0	0	108.4	L589 E591 D592 I632 L656 I680	L589-L648 HydrophobicContact CD2-CD2 4.15Å; E591-L648 WeakPolarHBondContact CB-O 3.4Å; D592-L648 PolarHBondContact N-O 3.01Å; D592-L648 WeakPolarHBondContact OD2-CA 3.31Å; D592-L648 WeakPolarHBondContact OD2-CB 3.05Å; D592-L648 PolarHBondContact OD2-N 2.91Å; I632-L648 HydrophobicContact CG2-CD1 3.61Å; L648-L656 HydrophobicContact CD1-CD1 3.74Å; L648-I680 HydrophobicContact CD1-CD1 3.45Å; L648-I680 VanDerWaalsContact CD1-CD1 3.45Å; L648-I680 HydrophobicContact CD1-CG1 3.88Å; L648-I680 HydrophobicContact CD2-CB 4.42Å; L648-I680 HydrophobicContact CD2-CD1 4.29Å; L648-I680 HydrophobicContact CD2-CG1 3.88Å; L648-I680 HydrophobicContact CD2-CG2 3.95Å; L648-I680 HydrophobicContact CG-CD1 3.72Å; L648-I680 HydrophobicContact CG-CG1 3.88Å; L648-I680 HydrophobicContact CG-CG2 3.94Å
649	D	89.8	Confident	90.1	Very high	42 Å²	42	45.5 Å²	45.5	23%	0.225	25%	0.252	C	S	.	.			trans	-128.2	126.5	-178.7	165.2	-26.3	0	0	0	106.8	Q647 E651 M652 N653	Q647-D649 PolarHBondContact O-N 3.47Å; D649-E651 WeakPolarHBondContact OD1-CA 3.46Å; D649-E651 VanDerWaalsContact OD1-CB 3.27Å; D649-E651 WeakPolarHBondContact OD1-CB 3.28Å; D649-E651 PolarHBondContact OD1-N 3.43Å; D649-M652 HydrophobicContact CB-CB 4.28Å; D649-M652 HydrophobicContact CB-CG 4.28Å; D649-M652 PolarHBondContact O-N 3.25Å; D649-M652 PolarHBondContact OD1-N 3.22Å; D649-M652 WeakPolarHBondContact OD2-CG 3.2Å; D649-N653 PolarHBondContact O-N 3.05Å
650	R	92.5	Very high	90.3	Very high	46 Å²	46	43 Å²	43	17%	0.174	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-34.1	-175.1	-169.1	-144.2	63.3	71.8	-4.2	111.9	E591 M652 N653 I680 D682 I719	E591-R650 WeakPolarHBondContact OE2-CB 3.02Å; E591-R650 PolarHBondContact OE2-N 3.06Å; R650-M652 PolarHBondContact O-N 3.31Å; R650-N653 WeakPolarHBondContact CA-O 3.49Å; R650-I680 HydrophobicContact CB-CG2 4.14Å; R650-I680 HydrophobicContact CG-CG2 4.46Å; R650-D682 WeakPolarHBondContact CD-OD1 3.5Å; R650-D682 IonicContact CZ-OD1 3.83Å; R650-D682 IonicContact NE-OD1 2.84Å; R650-D682 PolarHBondContact NE-OD1 2.85Å; R650-D682 IonicContact NH2-OD1 3.78Å; R650-I719 VanDerWaalsContact NH2-CG2 3.35Å
651	E	90.9	Very high	90.3	Very high	56 Å²	56	46 Å²	46	26%	0.262	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-28.6	174.9	-69.8	54.6	-122.1	0	0	110.3	D649	D649-E651 WeakPolarHBondContact OD1-CA 3.46Å; D649-E651 VanDerWaalsContact OD1-CB 3.27Å; D649-E651 WeakPolarHBondContact OD1-CB 3.28Å; D649-E651 PolarHBondContact OD1-N 3.43Å
652	M	88.3	Confident	90.4	Very high	144 Å²	144	44.3 Å²	44.3	71%	0.709	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-52.1	172.4	-68.2	-161.3	-163.7	0	0	114.8	D649 R650	D649-M652 HydrophobicContact CB-CB 4.28Å; D649-M652 HydrophobicContact CB-CG 4.28Å; D649-M652 PolarHBondContact O-N 3.25Å; D649-M652 PolarHBondContact OD1-N 3.22Å; D649-M652 WeakPolarHBondContact OD2-CG 3.2Å; R650-M652 PolarHBondContact O-N 3.31Å
653	N	86.5	Confident	90.5	Very high	82 Å²	82	48.7 Å²	48.7	44%	0.439	26%	0.264	S	S	.	.			trans	-140.9	144.4	-175.1	-73.3	-50.8	0	0	0	112.2	D649 R650 I680	D649-N653 PolarHBondContact O-N 3.05Å; R650-N653 WeakPolarHBondContact CA-O 3.49Å; N653-I680 HydrophobicContact CB-CD1 4.19Å; N653-I680 WeakPolarHBondContact O-CD1 3.34Å
654	T	91.7	Very high	90.6	Very high	90 Å²	90	46.5 Å²	46.5	55%	0.552	25%	0.254	S	S	*	.	S	Bend	trans	-102.4	-18.3	-179	55.7	0	0	0	0	115.3	I680	T654-I680 PolarHBondContact O-N 2.75Å
655	S	92.4	Very high	90.7	Very high	62 Å²	62	49.2 Å²	49.2	43%	0.434	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	161.4	178.6	59.2	0	0	0	0	114.9	L678	S655-L678 CarbonylContact C-O 3.48Å; S655-L678 WeakPolarHBondContact CA-O 3.49Å; S655-L678 WeakPolarHBondContact CB-O 3.29Å
656	L	91.1	Very high	90.9	Very high	20 Å²	20	47.8 Å²	47.8	11%	0.105	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	155	-176.8	-60	172.3	0	0	0	113.7	V629 I632 I633 L648 L678	V629-L656 HydrophobicContact CG1-CD2 4.47Å; I632-L656 HydrophobicContact CB-CD1 4.12Å; I632-L656 HydrophobicContact CD1-CD1 4.03Å; I632-L656 HydrophobicContact CD1-CD2 3.78Å; I632-L656 HydrophobicContact CG2-CD1 3.63Å; I633-L656 HydrophobicContact CD1-CB 4.48Å; I633-L656 HydrophobicContact CD1-CD1 3.99Å; I633-L656 HydrophobicContact CG1-CD1 4.32Å; L648-L656 HydrophobicContact CD1-CD1 3.74Å; L656-L678 HydrophobicContact CB-CB 4.35Å; L656-L678 HydrophobicContact CB-CD2 4.44Å; L656-L678 HydrophobicContact CD1-CD2 4.1Å; L656-L678 PolarHBondContact N-O 3.01Å; L656-L678 PolarHBondContact O-N 3.46Å
657	S	93.1	Very high	91.1	Very high	46 Å²	46	55.8 Å²	55.8	32%	0.322	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	140.6	178	-57.9	0	0	0	0	114.1	I676 H677	S657-I676 WeakPolarHBondContact CA-O 3.17Å; S657-H677 PolarHBondContact OG-ND1 3.1Å
658	F	94.7	Very high	91.4	Very high	1 Å²	1	55.3 Å²	55.3	0%	0.004	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.5	172.8	-173.1	61.2	-81.8	0	0	0	116.3	I624 E626 V629 I633 I642 V660 I676	I624-F658 HydrophobicContact CD1-CD2 4.22Å; I624-F658 HydrophobicContact CD1-CE2 4.16Å; I624-F658 HydrophobicContact CG1-CD2 4.02Å; I624-F658 HydrophobicContact CG1-CE2 4.24Å; I624-F658 HydrophobicContact CG2-CB 4.04Å; I624-F658 HydrophobicContact CG2-CD2 3.9Å; I624-F658 HydrophobicContact CG2-CG 4.29Å; E626-F658 HydrophobicContact CB-CB 4.42Å; E626-F658 VanDerWaalsContact OE2-CA 3.29Å; E626-F658 WeakPolarHBondContact OE2-CA 3.45Å; E626-F658 WeakPolarHBondContact OE2-CB 3.3Å; V629-F658 HydrophobicContact CG1-CB 4.45Å; V629-F658 HydrophobicContact CG2-CB 3.72Å; V629-F658 HydrophobicContact CG2-CD1 4.29Å; V629-F658 HydrophobicContact CG2-CG 4.02Å; I633-F658 HydrophobicContact CD1-CD1 3.93Å; I633-F658 HydrophobicContact CD1-CE1 3.31Å; I633-F658 HydrophobicContact CD1-CZ 3.92Å; I633-F658 HydrophobicContact CG2-CE1 4.34Å; I633-F658 HydrophobicContact CG2-CE2 4.34Å; I633-F658 HydrophobicContact CG2-CZ 3.93Å; I642-F658 HydrophobicContact CD1-CE2 3.98Å; I642-F658 HydrophobicContact CD1-CZ 4.29Å; I642-F658 HydrophobicContact CG2-CE2 4.29Å; I642-F658 HydrophobicContact CG2-CZ 3.95Å; F658-V660 HydrophobicContact CD2-CG2 4.44Å; F658-V660 HydrophobicContact CE2-CG2 4.34Å; F658-I676 HydrophobicContact CD2-CB 4.35Å; F658-I676 HydrophobicContact CD2-CD1 4.42Å; F658-I676 HydrophobicContact CE1-CB 4.17Å; F658-I676 HydrophobicContact CE1-CG2 3.82Å; F658-I676 HydrophobicContact CE2-CB 4.03Å; F658-I676 HydrophobicContact CE2-CD1 3.66Å; F658-I676 HydrophobicContact CE2-CG1 4.31Å; F658-I676 HydrophobicContact CE2-CG2 4.21Å; F658-I676 HydrophobicContact CZ-CB 3.9Å; F658-I676 HydrophobicContact CZ-CD1 4Å; F658-I676 HydrophobicContact CZ-CG2 3.6Å; F658-I676 PolarHBondContact N-O 2.85Å; F658-I676 PolarHBondContact O-N 3.09Å
659	T	95.6	Very high	91.5	Very high	33 Å²	33	57.4 Å²	57.4	20%	0.202	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	144.3	-174.3	-49.3	0	0	0	0	112.4	I624 A625 E626 V674	I624-T659 CarbonylContact C-O 3.46Å; I624-T659 VanDerWaalsContact CA-O 3.31Å; I624-T659 WeakPolarHBondContact CA-O 3.34Å; A625-T659 PolarHBondContact N-O 3.49Å; E626-T659 WeakPolarHBondContact OE1-CB 3.27Å; E626-T659 PolarHBondContact OE1-N 2.83Å; E626-T659 PolarHBondContact OE1-OG1 2.83Å; E626-T659 PolarHBondContact OE2-N 3.47Å; T659-V674 CarbonylContact C-O 3.52Å; T659-V674 WeakPolarHBondContact CA-O 3.38Å; T659-V674 WeakPolarHBondContact CG2-O 3.48Å
660	V	96.1	Very high	91.6	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	142.1	-179.2	179.2	0	0	0	0	113.5	F580 V607 Y623 I624 I635 I642 F658 S673 V674 I676	F580-V660 HydrophobicContact CZ-CG1 4.47Å; V607-V660 HydrophobicContact CG2-CG1 3.86Å; Y623-V660 CarbonylContact O-C 3.57Å; Y623-V660 WeakPolarHBondContact O-CA 3.44Å; I624-V660 HydrophobicContact CG1-CG2 4.25Å; I635-V660 HydrophobicContact CD1-CB 4.29Å; I635-V660 HydrophobicContact CD1-CG1 3.35Å; I635-V660 HydrophobicContact CD1-CG2 3.9Å; I642-V660 HydrophobicContact CD1-CG2 4.16Å; F658-V660 HydrophobicContact CD2-CG2 4.44Å; F658-V660 HydrophobicContact CE2-CG2 4.34Å; V660-S673 CarbonylContact O-C 3.57Å; V660-S673 WeakPolarHBondContact O-CA 3.47Å; V660-S673 VanDerWaalsContact O-CB 3.29Å; V660-S673 WeakPolarHBondContact O-CB 3.38Å; V660-V674 HydrophobicContact CB-CG1 3.75Å; V660-V674 HydrophobicContact CG1-CG1 4.37Å; V660-V674 PolarHBondContact N-O 3Å; V660-V674 PolarHBondContact O-N 2.77Å; V660-I676 HydrophobicContact CG2-CD1 3.9Å
661	I	95.9	Very high	91.7	Very high	64 Å²	64	60.1 Å²	60.1	33%	0.328	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	140.6	-177	-57.8	172.7	0	0	0	111	Y622 Y623 S672	Y622-I661 CarbonylContact C-O 3.46Å; Y622-I661 WeakPolarHBondContact CA-O 3.49Å; Y623-I661 PolarHBondContact N-O 2.88Å; Y623-I661 PolarHBondContact O-N 2.84Å; I661-S672 CarbonylContact C-O 3.52Å; I661-S672 WeakPolarHBondContact CA-O 3.41Å; I661-S672 WeakPolarHBondContact CG2-O 3.16Å
662	A	96.5	Very high	91.9	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	135.8	172.9	0	0	0	0	0	112.3	F580 A609 I620 I621 Y622 S671 S672	F580-A662 HydrophobicContact CD2-CB 4.32Å; F580-A662 HydrophobicContact CE1-CB 4.33Å; F580-A662 HydrophobicContact CE2-CB 3.42Å; F580-A662 VanDerWaalsContact CE2-CB 3.42Å; F580-A662 HydrophobicContact CZ-CB 3.43Å; F580-A662 VanDerWaalsContact CZ-CB 3.43Å; A609-A662 HydrophobicContact CB-CB 3.94Å; I620-A662 HydrophobicContact CG2-CB 3.78Å; I621-A662 CarbonylContact O-C 3.58Å; I621-A662 WeakPolarHBondContact O-CA 3.17Å; Y622-A662 HydrophobicContact CD1-CB 3.97Å; Y622-A662 HydrophobicContact CE1-CB 3.91Å; A662-S671 CarbonylContact O-C 3.51Å; A662-S671 WeakPolarHBondContact O-CA 3.43Å; A662-S671 WeakPolarHBondContact O-CB 3.42Å; A662-S672 PolarHBondContact N-O 3.32Å; A662-S672 PolarHBondContact O-N 3.07Å
663	K	95.4	Very high	92.2	Very high	91 Å²	91	55.9 Å²	55.9	40%	0.396	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	134.4	-173.8	-179.3	-179.6	175.5	-175.1	0	112.5	I620 I621 Y623 S669 K670	I620-K663 CarbonylContact C-O 3.42Å; I620-K663 WeakPolarHBondContact CA-O 3.45Å; I621-K663 PolarHBondContact N-O 2.92Å; I621-K663 PolarHBondContact O-N 3.49Å; Y623-K663 HydrophobicContact CE2-CB 4.47Å; K663-S669 WeakPolarHBondContact CE-OG 3.48Å; K663-S669 VanDerWaalsContact CG-OG 3.23Å; K663-S669 WeakPolarHBondContact CG-OG 3.39Å; K663-K670 CarbonylContact C-O 3.59Å; K663-K670 WeakPolarHBondContact CA-O 3.44Å
664	D	94.4	Very high	92.7	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.303	C	S	.	.			trans	-74.2	171.7	175.1	67.6	31.6	0	0	0	112.1	P578 E619 G666 S669 K670	P578-D664 HydrophobicContact CG-CB 3.72Å; E619-D664 CarbonylContact O-C 3.44Å; E619-D664 WeakPolarHBondContact O-CA 3.43Å; D664-G666 PolarHBondContact OD1-N 3.41Å; D664-S669 PolarHBondContact O-OG 2.86Å; D664-S669 WeakPolarHBondContact OD1-CA 3.25Å; D664-S669 WeakPolarHBondContact OD1-CB 3.19Å; D664-S669 PolarHBondContact OD1-OG 2.9Å; D664-K670 PolarHBondContact N-O 2.93Å; D664-K670 PolarHBondContact OD1-N 2.73Å; D664-K670 WeakPolarHBondContact OD2-CA 3.48Å; D664-K670 WeakPolarHBondContact OD2-CB 3.38Å; D664-K670 WeakPolarHBondContact OD2-CG 3.35Å; D664-K670 PolarHBondContact OD2-N 2.86Å
665	L	90.7	Very high	92.9	Very high	57 Å²	57	52.5 Å²	52.5	30%	0.298	29%	0.294	S	S	.	.			trans	-111.5	17.8	178.6	-63.7	-177.7	0	0	0	114.3	K616 E619 I621	K616-L665 HydrophobicContact CB-CB 3.99Å; K616-L665 HydrophobicContact CG-CB 4.45Å; K616-L665 CarbonylContact O-C 3.34Å; K616-L665 WeakPolarHBondContact O-CA 3.4Å; K616-L665 VanDerWaalsContact O-CB 3.22Å; K616-L665 WeakPolarHBondContact O-CB 3.17Å; K616-L665 PolarHBondContact O-N 3.03Å; E619-L665 HydrophobicContact CB-CB 4.37Å; E619-L665 HydrophobicContact CB-CD1 4.03Å; E619-L665 HydrophobicContact CB-CG 4.3Å; E619-L665 HydrophobicContact CG-CD1 3.75Å; E619-L665 HydrophobicContact CG-CG 4.42Å; E619-L665 WeakPolarHBondContact O-CG 3.49Å; E619-L665 PolarHBondContact O-N 2.78Å; E619-L665 VanDerWaalsContact O-N 3.08Å; I621-L665 HydrophobicContact CD1-CD1 3.87Å; I621-L665 HydrophobicContact CD1-CD2 3.62Å; I621-L665 HydrophobicContact CD1-CG 4.11Å; I621-L665 HydrophobicContact CG1-CD1 4.13Å; I621-L665 HydrophobicContact CG1-CD2 3.96Å; I621-L665 HydrophobicContact CG1-CG 4.12Å
666	G	87.1	Confident	93.1	Very high	7 Å²	7	49.5 Å²	49.5	7%	0.072	27%	0.273	C	S	.	.	S	Bend	trans	-57.9	152.5	175.2	0	0	0	0	0	112.4	N574 K616 D664 V668 S669	N574-G666 WeakPolarHBondContact ND2-CA 3.29Å; K616-G666 PolarHBondContact O-N 2.81Å; D664-G666 PolarHBondContact OD1-N 3.41Å; G666-V668 CarbonylContact O-C 3.53Å; G666-V668 PolarHBondContact O-N 3Å; G666-V668 VanDerWaalsContact O-N 3.1Å; G666-S669 PolarHBondContact O-N 3.4Å
667	E	82.4	Confident	93.2	Very high	202 Å²	202	51.5 Å²	51.5	94%	0.944	28%	0.282	S	S	*	.	S	Bend	trans	-55.6	-31.5	178	-162.5	179.3	-170.6	0	0	111.4
668	V	87.6	Confident	93.2	Very high	115 Å²	115	49.3 Å²	49.3	70%	0.697	27%	0.266	S	S	*	.	S	Bend	trans	-114.2	100.3	163.3	-176.8	0	0	0	0	108.5	N574 G666	N574-V668 PolarHBondContact ND2-O 2.86Å; G666-V668 CarbonylContact O-C 3.53Å; G666-V668 PolarHBondContact O-N 3Å; G666-V668 VanDerWaalsContact O-N 3.1Å
669	S	88.8	Confident	93.2	Very high	47 Å²	47	51.7 Å²	51.7	33%	0.329	28%	0.281	S	S	.	.			trans	-87.3	149.9	-167.9	169.9	0	0	0	0	115.7	K663 D664 G666	K663-S669 WeakPolarHBondContact CE-OG 3.48Å; K663-S669 VanDerWaalsContact CG-OG 3.23Å; K663-S669 WeakPolarHBondContact CG-OG 3.39Å; D664-S669 PolarHBondContact O-OG 2.86Å; D664-S669 WeakPolarHBondContact OD1-CA 3.25Å; D664-S669 WeakPolarHBondContact OD1-CB 3.19Å; D664-S669 PolarHBondContact OD1-OG 2.9Å; G666-S669 PolarHBondContact O-N 3.4Å
670	K	91.4	Very high	93.1	Very high	65 Å²	65	50.8 Å²	50.8	28%	0.283	28%	0.275	S	S	.	.			trans	-125.8	156.2	-179	-45.9	173.9	-172.1	156.6	0	112.4	N576 E577 K663 D664	N576-K670 WeakPolarHBondContact O-CD 3.37Å; N576-K670 PolarHBondContact O-NZ 2.82Å; E577-K670 HydrophobicContact CB-CB 3.75Å; E577-K670 HydrophobicContact CB-CD 3.35Å; E577-K670 HydrophobicContact CB-CG 4.2Å; K663-K670 CarbonylContact C-O 3.59Å; K663-K670 WeakPolarHBondContact CA-O 3.44Å; D664-K670 PolarHBondContact N-O 2.93Å; D664-K670 PolarHBondContact OD1-N 2.73Å; D664-K670 WeakPolarHBondContact OD2-CA 3.48Å; D664-K670 WeakPolarHBondContact OD2-CB 3.38Å; D664-K670 WeakPolarHBondContact OD2-CG 3.35Å; D664-K670 PolarHBondContact OD2-N 2.86Å
671	S	94.6	Very high	92.9	Very high	80 Å²	80	55.4 Å²	55.4	56%	0.559	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-157.3	163.7	-168.1	65.4	0	0	0	0	119.2	A662	A662-S671 CarbonylContact O-C 3.51Å; A662-S671 WeakPolarHBondContact O-CA 3.43Å; A662-S671 WeakPolarHBondContact O-CB 3.42Å
672	S	95.3	Very high	92.7	Very high	35 Å²	35	53.9 Å²	53.9	25%	0.245	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	173.8	177.5	59.8	0	0	0	0	115.9	P578 I661 A662	P578-S672 PolarHBondContact O-OG 3.18Å; I661-S672 CarbonylContact C-O 3.52Å; I661-S672 WeakPolarHBondContact CA-O 3.41Å; I661-S672 WeakPolarHBondContact CG2-O 3.16Å; A662-S672 PolarHBondContact N-O 3.32Å; A662-S672 PolarHBondContact O-N 3.07Å
673	S	95.9	Very high	92.5	Very high	76 Å²	76	56 Å²	56	53%	0.531	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	166.7	-173.1	65.2	0	0	0	0	120.6	V660	V660-S673 CarbonylContact O-C 3.57Å; V660-S673 WeakPolarHBondContact O-CA 3.47Å; V660-S673 VanDerWaalsContact O-CB 3.29Å; V660-S673 WeakPolarHBondContact O-CB 3.38Å
674	V	96.2	Very high	92.3	Very high	11 Å²	11	51.7 Å²	51.7	7%	0.067	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	152.9	-177.1	66.3	0	0	0	0	116.2	F580 V607 T659 V660	F580-V674 HydrophobicContact CE1-CG1 4.4Å; F580-V674 HydrophobicContact CZ-CG1 4.37Å; V607-V674 HydrophobicContact CG1-CG1 4.11Å; T659-V674 CarbonylContact C-O 3.52Å; T659-V674 WeakPolarHBondContact CA-O 3.38Å; T659-V674 WeakPolarHBondContact CG2-O 3.48Å; V660-V674 HydrophobicContact CB-CG1 3.75Å; V660-V674 HydrophobicContact CG1-CG1 4.37Å; V660-V674 PolarHBondContact N-O 3Å; V660-V674 PolarHBondContact O-N 2.77Å
675	Y	96.4	Very high	92.2	Very high	90 Å²	90	53.1 Å²	53.1	35%	0.353	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	146.8	-175.3	-179.8	-97.5	0	0	0	117.6	T583 N584 E585	T583-Y675 PolarHBondContact O-N 2.9Å; N584-Y675 CarbonylContact C-O 3.41Å; N584-Y675 WeakPolarHBondContact CA-O 3.43Å; N584-Y675 WeakPolarHBondContact OD1-CB 2.93Å; E585-Y675 PolarHBondContact N-O 2.92Å
676	I	95.3	Very high	92.2	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	139.5	-168.5	-53.1	179.9	0	0	0	115.9	E585 M605 I642 S657 F658 V660	E585-I676 HydrophobicContact CB-CG1 4.4Å; E585-I676 WeakPolarHBondContact O-CA 3.39Å; M605-I676 HydrophobicContact SD-CD1 3.94Å; M605-I676 HydrophobicContact SD-CG1 4.4Å; M605-I676 HydrophobicContact SD-CG2 4.16Å; I642-I676 HydrophobicContact CD1-CD1 3.12Å; S657-I676 WeakPolarHBondContact CA-O 3.17Å; F658-I676 HydrophobicContact CD2-CB 4.35Å; F658-I676 HydrophobicContact CD2-CD1 4.42Å; F658-I676 HydrophobicContact CE1-CB 4.17Å; F658-I676 HydrophobicContact CE1-CG2 3.82Å; F658-I676 HydrophobicContact CE2-CB 4.03Å; F658-I676 HydrophobicContact CE2-CD1 3.66Å; F658-I676 HydrophobicContact CE2-CG1 4.31Å; F658-I676 HydrophobicContact CE2-CG2 4.21Å; F658-I676 HydrophobicContact CZ-CB 3.9Å; F658-I676 HydrophobicContact CZ-CD1 4Å; F658-I676 HydrophobicContact CZ-CG2 3.6Å; F658-I676 PolarHBondContact N-O 2.85Å; F658-I676 PolarHBondContact O-N 3.09Å; V660-I676 HydrophobicContact CG2-CD1 3.9Å
677	H	94.7	Very high	92.5	Very high	61 Å²	61	59.1 Å²	59.1	28%	0.282	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	132.2	176.8	-177.3	80	0	0	0	115.5	E585 Y586 I587 S657	E585-H677 PolarHBondContact O-N 2.87Å; E585-H677 VanDerWaalsContact O-N 3.14Å; Y586-H677 HydrophobicContact CD1-CB 3.78Å; Y586-H677 AromaticContact CD1-CD2 3.95Å; Y586-H677 HydrophobicContact CE1-CB 4.09Å; I587-H677 PolarHBondContact N-O 2.67Å; S657-H677 PolarHBondContact OG-ND1 3.1Å
678	L	93.4	Very high	93	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	132.3	-170.8	174.4	67.7	0	0	0	114.8	I587 L589 I633 S655 L656	I587-L678 HydrophobicContact CG2-CB 4.04Å; I587-L678 HydrophobicContact CG2-CD1 3.59Å; I587-L678 HydrophobicContact CG2-CG 4.41Å; I587-L678 WeakPolarHBondContact O-CA 3.48Å; L589-L678 HydrophobicContact CB-CD1 3.66Å; L589-L678 HydrophobicContact CD2-CD1 4.16Å; I633-L678 HydrophobicContact CD1-CD2 3.82Å; S655-L678 CarbonylContact C-O 3.48Å; S655-L678 WeakPolarHBondContact CA-O 3.49Å; S655-L678 WeakPolarHBondContact CB-O 3.29Å; L656-L678 HydrophobicContact CB-CB 4.35Å; L656-L678 HydrophobicContact CB-CD2 4.44Å; L656-L678 HydrophobicContact CD1-CD2 4.1Å; L656-L678 PolarHBondContact N-O 3.01Å; L656-L678 PolarHBondContact O-N 3.46Å
679	T	93.9	Very high	93.3	Very high	51 Å²	51	50 Å²	50	31%	0.313	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	140.2	176.6	-54.5	0	0	0	0	113.3	I587 L589	I587-T679 PolarHBondContact O-N 2.83Å; L589-T679 PolarHBondContact N-O 3.13Å
680	I	92.8	Very high	93.6	Very high	14 Å²	14	48.8 Å²	48.8	7%	0.072	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	137.7	-173.1	-47.6	173.6	0	0	0	112	L589 E591 L648 R650 N653 T654	L589-I680 CarbonylContact O-C 3.42Å; L589-I680 VanDerWaalsContact O-CA 3.29Å; L589-I680 WeakPolarHBondContact O-CA 3.27Å; E591-I680 HydrophobicContact CB-CG2 4.13Å; L648-I680 HydrophobicContact CD1-CD1 3.45Å; L648-I680 VanDerWaalsContact CD1-CD1 3.45Å; L648-I680 HydrophobicContact CD1-CG1 3.88Å; L648-I680 HydrophobicContact CD2-CB 4.42Å; L648-I680 HydrophobicContact CD2-CD1 4.29Å; L648-I680 HydrophobicContact CD2-CG1 3.88Å; L648-I680 HydrophobicContact CD2-CG2 3.95Å; L648-I680 HydrophobicContact CG-CD1 3.72Å; L648-I680 HydrophobicContact CG-CG1 3.88Å; L648-I680 HydrophobicContact CG-CG2 3.94Å; R650-I680 HydrophobicContact CB-CG2 4.14Å; R650-I680 HydrophobicContact CG-CG2 4.46Å; N653-I680 HydrophobicContact CB-CD1 4.19Å; N653-I680 WeakPolarHBondContact O-CD1 3.34Å; T654-I680 PolarHBondContact O-N 2.75Å
681	Q	91.8	Very high	93.6	Very high	96 Å²	96	49.8 Å²	49.8	45%	0.449	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	149.7	-180	-49.2	-177.4	-99.4	0	0	112.9	L589 M590 E591	L589-Q681 PolarHBondContact O-N 2.73Å; M590-Q681 HydrophobicContact CE-CB 4.14Å; M590-Q681 VanDerWaalsContact SD-C 3.6Å; M590-Q681 HydrophobicContact SD-CB 3.58Å; M590-Q681 VanDerWaalsContact SD-CB 3.58Å; M590-Q681 VanDerWaalsContact SD-O 3.38Å; E591-Q681 PolarHBondContact N-O 3.06Å
682	D	92.2	Very high	93.4	Very high	33 Å²	33	51.2 Å²	51.2	18%	0.176	25%	0.25	C	C	.	.			trans	-75.2	138.5	-176.6	-166.3	82.3	0	0	0	114.2	E591 R650 I719 N722	E591-D682 WeakPolarHBondContact OE1-CA 3.49Å; R650-D682 WeakPolarHBondContact CD-OD1 3.5Å; R650-D682 IonicContact CZ-OD1 3.83Å; R650-D682 IonicContact NE-OD1 2.84Å; R650-D682 PolarHBondContact NE-OD1 2.85Å; R650-D682 IonicContact NH2-OD1 3.78Å; D682-I719 HydrophobicContact CB-CD1 4.03Å; D682-I719 HydrophobicContact CB-CG1 4.11Å; D682-N722 PolarHBondContact OD2-ND2 2.96Å
683	Y	91.5	Very high	93.1	Very high	43 Å²	43	59 Å²	59	17%	0.169	28%	0.279	C	S	.	.			trans	-126.8	145.1	169.9	-173.8	-93.4	0	0	0	109.2	E591 S593 D594 P595 D685 P840	E591-Y683 PolarHBondContact OE1-N 2.84Å; S593-Y683 VanDerWaalsContact O-CD1 3.3Å; S593-Y683 WeakPolarHBondContact O-CD1 3.34Å; S593-Y683 VanDerWaalsContact O-CE1 3.25Å; S593-Y683 WeakPolarHBondContact O-CE1 2.99Å; D594-Y683 HydrophobicContact CB-CD2 3.75Å; D594-Y683 HydrophobicContact CB-CE2 4.21Å; D594-Y683 HydrophobicContact CB-CG 4.13Å; P595-Y683 WeakPolarHBondContact CD-OH 3.13Å; P595-Y683 WeakPolarHBondContact CG-OH 3.26Å; Y683-D685 VanDerWaalsContact C-N 3.3Å; Y683-D685 HydrophobicContact CD1-CB 4.07Å; Y683-D685 PolarHBondContact O-N 2.92Å; Y683-P840 WeakPolarHBondContact OH-CD 3.43Å
684	N	92.7	Very high	92.8	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.005	27%	0.273	C	S	.	.	S	Bend	trans	-70	84.6	-178.7	-165.4	46	0	0	0	110.5	D718 N722 D836 P840 R842	N684-D718 WeakPolarHBondContact CA-OD2 3.25Å; N684-D718 PolarHBondContact OD1-OD2 2.88Å; N684-N722 HydrophobicContact CB-CB 4.22Å; N684-N722 WeakPolarHBondContact OD1-CA 3.32Å; N684-N722 WeakPolarHBondContact OD1-CB 3.34Å; N684-N722 VanDerWaalsContact OD1-CG 3.31Å; N684-N722 PolarHBondContact OD1-O 2.81Å; N684-D836 PolarHBondContact ND2-OD2 3.22Å; N684-P840 PolarHBondContact ND2-O 2.91Å; N684-R842 PolarHBondContact O-NE 3.25Å; N684-R842 PolarHBondContact O-NH2 2.64Å; N684-R842 VanDerWaalsContact O-NH2 3.1Å
685	D	90.8	Very high	92.7	Very high	31 Å²	31	58.8 Å²	58.8	17%	0.166	27%	0.271	C	S	.	.			trans	-118.1	-4.2	-166.6	94.7	-35.4	0	0	0	116.4	S593 Y683 D718 R842	S593-D685 WeakPolarHBondContact CB-OD2 3.02Å; S593-D685 PolarHBondContact OG-OD2 3.3Å; Y683-D685 VanDerWaalsContact C-N 3.3Å; Y683-D685 HydrophobicContact CD1-CB 4.07Å; Y683-D685 PolarHBondContact O-N 2.92Å; D685-D718 PolarHBondContact N-OD2 2.05Å; D685-D718 VanDerWaalsContact N-OD2 3.09Å; D685-R842 VanDerWaalsContact CA-NH2 3.28Å; D685-R842 VanDerWaalsContact O-CZ 3.3Å; D685-R842 PolarHBondContact O-NH1 3.29Å; D685-R842 PolarHBondContact O-NH2 2.91Å
686	E	91.8	Very high	92.5	Very high	52 Å²	52	61 Å²	61	24%	0.243	28%	0.284	C	S	.	.			trans	-106.9	150	172.2	-68.4	-89.8	-178.9	0	0	111.3	K717 D718 R842	E686-K717 HydrophobicContact CB-CB 4.22Å; E686-K717 VanDerWaalsContact CD-NZ 3.29Å; E686-K717 HydrophobicContact CG-CB 3.97Å; E686-K717 HydrophobicContact CG-CD 4.31Å; E686-K717 IonicContact OE1-NZ 3.13Å; E686-K717 PolarHBondContact OE1-NZ 2.85Å; E686-K717 IonicContact OE2-NZ 3.33Å; E686-K717 PolarHBondContact OE2-NZ 3.12Å; E686-D718 VanDerWaalsContact CB-OD1 3.25Å; E686-D718 WeakPolarHBondContact CB-OD1 3.47Å; E686-D718 WeakPolarHBondContact CG-OD1 3.13Å; E686-D718 PolarHBondContact N-OD1 2.76Å; E686-D718 PolarHBondContact N-OD2 3.5Å; E686-D718 VanDerWaalsContact N-OD2 3.12Å; E686-R842 WeakPolarHBondContact O-CD 3.22Å
687	Y	93	Very high	92.4	Very high	137 Å²	137	61.7 Å²	61.7	54%	0.537	29%	0.287	S	S	.	.			trans	-100.9	151.7	176	-76.7	-98.9	0	0	0	109.5	E689 R842	Y687-E689 PolarHBondContact O-N 2.79Å; Y687-R842 HydrophobicContact CD1-CB 3.59Å; Y687-R842 HydrophobicContact CD1-CG 4.18Å; Y687-R842 HydrophobicContact CE1-CB 3.78Å; Y687-R842 HydrophobicContact CE1-CG 3.99Å; Y687-R842 HydrophobicContact CG-CB 4.2Å
688	P	93.6	Very high	92.2	Very high	4 Å²	4	62.4 Å²	62.4	3%	0.026	30%	0.299	C	S	.	.			trans	-57.5	126.8	166.7	-20.1	30.4	0	0	0	110.5	V714 I715 L725 A834 D836 A844	P688-V714 HydrophobicContact CB-CG1 4.16Å; P688-I715 CarbonylContact C-O 3.56Å; P688-I715 WeakPolarHBondContact CA-O 3.39Å; P688-L725 HydrophobicContact CB-CD1 4.11Å; P688-L725 HydrophobicContact CB-CD2 3.74Å; P688-L725 HydrophobicContact CG-CD2 3.45Å; P688-L725 VanDerWaalsContact CG-CD2 3.45Å; P688-A834 HydrophobicContact CB-CB 4.1Å; P688-D836 HydrophobicContact CG-CB 4.27Å; P688-A844 HydrophobicContact CB-CB 4.29Å; P688-A844 WeakPolarHBondContact O-CB 2.97Å
689	E	93.3	Very high	92.2	Very high	121 Å²	121	62.6 Å²	62.6	57%	0.565	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.8	122.6	-173.3	-172.5	179.2	-178.4	0	0	111.4	Y687 V714 I715	Y687-E689 PolarHBondContact O-N 2.79Å; E689-V714 CarbonylContact O-C 3.52Å; E689-V714 WeakPolarHBondContact O-CA 3.15Å; E689-I715 PolarHBondContact N-O 2.74Å; E689-I715 PolarHBondContact O-N 2.95Å
690	F	94.3	Very high	92	Very high	22 Å²	22	65.2 Å²	65.2	10%	0.096	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	143.9	170.2	-66.2	-89.5	0	0	0	111	K692 I712 N713 V714 L777 L832 A834 A844 V846	F690-K692 PolarHBondContact O-N 3.44Å; F690-K692 VanDerWaalsContact O-N 3.16Å; F690-I712 HydrophobicContact CD1-CG2 3.82Å; F690-I712 HydrophobicContact CE1-CG2 4.2Å; F690-N713 WeakPolarHBondContact CA-O 3.31Å; F690-V714 HydrophobicContact CD1-CG2 3.43Å; F690-V714 VanDerWaalsContact CD1-CG2 3.43Å; F690-V714 HydrophobicContact CE1-CG2 3.44Å; F690-V714 VanDerWaalsContact CE1-CG2 3.44Å; F690-V714 HydrophobicContact CG-CG2 4.23Å; F690-V714 HydrophobicContact CZ-CG2 4.27Å; F690-L777 HydrophobicContact CE1-CD1 4.47Å; F690-L832 HydrophobicContact CE1-CD2 3.75Å; F690-L832 HydrophobicContact CE1-CG 3.99Å; F690-L832 HydrophobicContact CZ-CD2 4.41Å; F690-L832 HydrophobicContact CZ-CG 4.15Å; F690-A834 HydrophobicContact CE2-CB 4.11Å; F690-A834 HydrophobicContact CZ-CB 3.76Å; F690-A844 HydrophobicContact CD2-CB 4.1Å; F690-A844 HydrophobicContact CE2-CB 3.79Å; F690-V846 HydrophobicContact CD1-CB 4.31Å; F690-V846 HydrophobicContact CD1-CG1 3.73Å; F690-V846 HydrophobicContact CD2-CB 3.97Å; F690-V846 HydrophobicContact CD2-CG1 4.18Å; F690-V846 HydrophobicContact CE1-CG1 3.69Å; F690-V846 HydrophobicContact CE2-CB 4.17Å; F690-V846 HydrophobicContact CE2-CG1 4.13Å; F690-V846 HydrophobicContact CG-CB 4.05Å; F690-V846 HydrophobicContact CG-CG1 4Å; F690-V846 HydrophobicContact CZ-CB 4.44Å; F690-V846 HydrophobicContact CZ-CG1 3.89Å
691	D	91.5	Very high	91.9	Very high	86 Å²	86	64.8 Å²	64.8	46%	0.46	31%	0.306	S	S	.	.	S	Bend	trans	-68	-14.1	-179.7	71.5	3.4	0	0	0	114.8	Y695 N713	D691-Y695 PolarHBondContact OD1-OH 2.63Å; D691-N713 HydrophobicContact CB-CB 4.33Å; D691-N713 PolarHBondContact N-O 2.8Å; D691-N713 VanDerWaalsContact N-O 3.16Å; D691-N713 WeakPolarHBondContact OD2-CB 3.38Å; D691-N713 PolarHBondContact OD2-ND2 2.78Å
692	K	91	Very high	91.7	Very high	111 Å²	111	63.9 Å²	63.9	48%	0.483	30%	0.304	S	S	.	.			trans	-136.9	150.6	173	-58.6	179.1	-168.3	167.7	0	111.3	F690 Y695 V846	F690-K692 PolarHBondContact O-N 3.44Å; F690-K692 VanDerWaalsContact O-N 3.16Å; K692-Y695 HydrophobicContact CB-CD1 4.38Å; K692-Y695 HydrophobicContact CB-CE1 3.86Å; K692-Y695 HydrophobicContact CB-CE2 4.13Å; K692-Y695 HydrophobicContact CD-CD1 3.91Å; K692-Y695 HydrophobicContact CD-CE1 3.65Å; K692-Y695 HydrophobicContact CG-CE1 3.95Å; K692-Y695 PolarHBondContact N-OH 2.99Å; K692-V846 WeakPolarHBondContact O-CG2 3.38Å
693	K	89	Confident	91.5	Very high	198 Å²	198	63.6 Å²	63.6	86%	0.861	31%	0.305	S	S	*	.	S	Bend	trans	-77.4	-28.5	177.4	-65.6	-172	178.1	-174.9	0	114.4	V846	K693-V846 VanDerWaalsContact O-CG2 3.27Å; K693-V846 WeakPolarHBondContact O-CG2 3.16Å
694	I	90.4	Very high	91.5	Very high	80 Å²	80	67.7 Å²	67.7	41%	0.41	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	138.1	177.7	-58.5	178.3	0	0	0	106.3	E696 Y849	I694-E696 HydrophobicContact CG2-CG 4.14Å; I694-Y849 HydrophobicContact CG2-CD2 3.54Å; I694-Y849 HydrophobicContact CG2-CE2 3.72Å
695	Y	92.9	Very high	91.3	Very high	3 Å²	3	74 Å²	74	1%	0.012	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	127.5	169.5	-64.5	-92.5	0	0	0	109.3	D691 K692 F697 I712 V846 L847 I848 Y849	D691-Y695 PolarHBondContact OD1-OH 2.63Å; K692-Y695 HydrophobicContact CB-CD1 4.38Å; K692-Y695 HydrophobicContact CB-CE1 3.86Å; K692-Y695 HydrophobicContact CB-CE2 4.13Å; K692-Y695 HydrophobicContact CD-CD1 3.91Å; K692-Y695 HydrophobicContact CD-CE1 3.65Å; K692-Y695 HydrophobicContact CG-CE1 3.95Å; K692-Y695 PolarHBondContact N-OH 2.99Å; Y695-F697 HydrophobicContact CD1-CE1 4.49Å; Y695-F697 AromaticContact CD1-CZ 3.83Å; Y695-F697 HydrophobicContact CD1-CZ 3.83Å; Y695-F697 HydrophobicContact CG-CE2 4.44Å; Y695-F697 HydrophobicContact CG-CZ 4.1Å; Y695-I712 HydrophobicContact CD1-CD1 4.38Å; Y695-I712 HydrophobicContact CD1-CG1 3.86Å; Y695-I712 HydrophobicContact CD2-CD1 4.12Å; Y695-I712 HydrophobicContact CD2-CG1 4.29Å; Y695-I712 HydrophobicContact CE1-CB 4.28Å; Y695-I712 HydrophobicContact CE1-CG1 3.71Å; Y695-I712 HydrophobicContact CE1-CG2 4.31Å; Y695-I712 HydrophobicContact CE2-CD1 4.27Å; Y695-I712 HydrophobicContact CE2-CG1 4.14Å; Y695-I712 HydrophobicContact CE2-CG2 3.89Å; Y695-I712 HydrophobicContact CG-CD1 4.19Å; Y695-I712 HydrophobicContact CG-CG1 4.17Å; Y695-V846 HydrophobicContact CD2-CG1 4.11Å; Y695-V846 HydrophobicContact CD2-CG2 3.74Å; Y695-V846 HydrophobicContact CE2-CB 4.44Å; Y695-V846 HydrophobicContact CE2-CG1 3.97Å; Y695-V846 HydrophobicContact CE2-CG2 3.72Å; Y695-L847 PolarHBondContact N-O 3.17Å; Y695-I848 HydrophobicContact CD2-CG1 4.49Å; Y695-I848 CarbonylContact O-C 3.53Å; Y695-I848 WeakPolarHBondContact O-CA 3.3Å; Y695-Y849 PolarHBondContact O-N 2.8Å
696	E	92.2	Very high	91.3	Very high	137 Å²	137	74.4 Å²	74.4	64%	0.64	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.9	121.6	175.3	-63.8	-177.9	-179.9	0	0	108.5	I694 Y849	I694-E696 HydrophobicContact CG2-CG 4.14Å; E696-Y849 WeakPolarHBondContact CA-O 3.09Å; E696-Y849 HydrophobicContact CG-CD2 4.42Å
697	F	93.6	Very high	91.3	Very high	14 Å²	14	77.7 Å²	77.7	6%	0.061	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	155.7	177.9	-54.3	-54.9	0	0	0	109.5	Y695 I709 D710 L779 I848 Y849 I850 N851	Y695-F697 HydrophobicContact CD1-CE1 4.49Å; Y695-F697 AromaticContact CD1-CZ 3.83Å; Y695-F697 HydrophobicContact CD1-CZ 3.83Å; Y695-F697 HydrophobicContact CG-CE2 4.44Å; Y695-F697 HydrophobicContact CG-CZ 4.1Å; F697-I709 HydrophobicContact CB-CG2 3.54Å; F697-I709 HydrophobicContact CD1-CG2 4.26Å; F697-I709 HydrophobicContact CD2-CG2 3.89Å; F697-I709 HydrophobicContact CG-CG2 3.64Å; F697-D710 HydrophobicContact CD1-CB 3.81Å; F697-D710 HydrophobicContact CE1-CB 3.27Å; F697-D710 WeakPolarHBondContact CE1-OD2 3.38Å; F697-D710 HydrophobicContact CE2-CB 4.44Å; F697-D710 HydrophobicContact CZ-CB 3.63Å; F697-L779 HydrophobicContact CD2-CD2 3.78Å; F697-L779 HydrophobicContact CE2-CD2 3.76Å; F697-I848 HydrophobicContact CD2-CG2 3.7Å; F697-I848 HydrophobicContact CE2-CG2 3.76Å; F697-Y849 PolarHBondContact N-O 3.25Å; F697-I850 CarbonylContact O-C 3.59Å; F697-I850 WeakPolarHBondContact O-CA 3.25Å; F697-N851 PolarHBondContact O-N 3.45Å
698	S	90.5	Very high	91.4	Very high	75 Å²	75	75.8 Å²	75.8	52%	0.524	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	141.1	176.3	-61.2	0	0	0	0	110.5	N851	S698-N851 WeakPolarHBondContact CA-O 3.44Å
699	I	93	Very high	91.4	Very high	5 Å²	5	76.7 Å²	76.7	3%	0.026	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	140.5	178.2	-166.9	167.9	0	0	0	109.5	S703 Y707 T781 I785 I850 N851 V852 I853	I699-S703 VanDerWaalsContact CG1-OG 3.25Å; I699-S703 WeakPolarHBondContact CG1-OG 3.27Å; I699-Y707 HydrophobicContact CD1-CD1 4.01Å; I699-T781 HydrophobicContact CD1-CG2 3.33Å; I699-I785 HydrophobicContact CG2-CG2 4.46Å; I699-I850 HydrophobicContact CB-CG2 4.45Å; I699-I850 HydrophobicContact CG2-CG2 3.72Å; I699-N851 PolarHBondContact N-O 2.84Å; I699-V852 HydrophobicContact CG2-CG2 4.44Å; I699-V852 CarbonylContact O-C 3.54Å; I699-V852 WeakPolarHBondContact O-CA 3.18Å; I699-I853 PolarHBondContact O-N 2.87Å
700	H	89.9	Confident	91.4	Very high	107 Å²	107	74 Å²	74	50%	0.495	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	143	170.9	-70.1	-83.8	0	0	0	109.9	S703	H700-S703 WeakPolarHBondContact O-CB 3.31Å; H700-S703 PolarHBondContact O-N 2.73Å; H700-S703 PolarHBondContact O-OG 2.69Å
701	E	90.4	Very high	91.3	Very high	5 Å²	5	74.8 Å²	74.8	2%	0.023	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	162.2	166.6	75.7	-173.1	131.2	0	0	111.6	S703 R787 V852 I853 D854 V855	E701-S703 PolarHBondContact O-N 2.68Å; E701-S703 VanDerWaalsContact O-N 3.1Å; E701-R787 HydrophobicContact CB-CB 4.3Å; E701-R787 WeakPolarHBondContact OE2-CB 3.41Å; E701-R787 PolarHBondContact OE2-N 2.81Å; E701-V852 HydrophobicContact CB-CG1 3.71Å; E701-I853 PolarHBondContact N-O 3.24Å; E701-D854 WeakPolarHBondContact OE1-CA 3.46Å; E701-V855 HydrophobicContact CG-CB 3.89Å; E701-V855 HydrophobicContact CG-CG2 3.85Å; E701-V855 PolarHBondContact OE1-N 3.16Å
702	N	87.9	Confident	91.4	Very high	77 Å²	77	70.8 Å²	70.8	41%	0.412	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	15.7	-174.3	-60.5	-45	0	0	0	114.7	I785 D857	N702-I785 PolarHBondContact N-O 2.88Å; N702-D857 PolarHBondContact ND2-OD2 2.72Å
703	S	89	Confident	91.5	Very high	27 Å²	27	68 Å²	68	19%	0.189	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-61.3	143.6	172.1	-73.5	0	0	0	0	113.1	I699 H700 E701	I699-S703 VanDerWaalsContact CG1-OG 3.25Å; I699-S703 WeakPolarHBondContact CG1-OG 3.27Å; H700-S703 WeakPolarHBondContact O-CB 3.31Å; H700-S703 PolarHBondContact O-N 2.73Å; H700-S703 PolarHBondContact O-OG 2.69Å; E701-S703 PolarHBondContact O-N 2.68Å; E701-S703 VanDerWaalsContact O-N 3.1Å
704	I	90.7	Very high	91.7	Very high	128 Å²	128	58.6 Å²	58.6	66%	0.656	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-67.4	150.7	-178.2	63	171.2	0	0	0	112.7	Y707 T781	I704-Y707 WeakPolarHBondContact O-CB 3.47Å; I704-Y707 PolarHBondContact O-N 2.85Å; I704-T781 PolarHBondContact O-OG1 3.41Å
705	Q	89.3	Confident	91.8	Very high	135 Å²	135	58.3 Å²	58.3	63%	0.631	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	135.1	172.6	-174.8	-179.7	6.4	0	0	110.8	N782	Q705-N782 PolarHBondContact NE2-O 3.38Å
706	G	90.1	Very high	91.9	Very high	39 Å²	39	58.2 Å²	58.2	40%	0.402	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.3	6.4	-177.8	0	0	0	0	0	114.5	Y708 T781	G706-Y708 PolarHBondContact O-N 3.47Å; G706-T781 WeakPolarHBondContact CA-O 3.45Å; G706-T781 PolarHBondContact N-O 2.85Å; G706-T781 PolarHBondContact N-OG1 2.88Å
707	Y	92.6	Very high	91.8	Very high	120 Å²	120	56.2 Å²	56.2	47%	0.471	29%	0.289	S	S	.	.			trans	-61.7	131	172.8	-176.4	-95.8	0	0	0	110.6	I699 I704 I709 Y780 T781	I699-Y707 HydrophobicContact CD1-CD1 4.01Å; I704-Y707 WeakPolarHBondContact O-CB 3.47Å; I704-Y707 PolarHBondContact O-N 2.85Å; Y707-I709 HydrophobicContact CD1-CG1 4.4Å; Y707-Y780 CarbonylContact O-C 3.59Å; Y707-Y780 VanDerWaalsContact O-CA 3.24Å; Y707-Y780 WeakPolarHBondContact O-CA 3.35Å; Y707-T781 PolarHBondContact N-OG1 3.24Å; Y707-T781 PolarHBondContact O-N 3.31Å
708	Y	94.7	Very high	91.8	Very high	97 Å²	97	55.5 Å²	55.5	38%	0.38	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	128	176.9	169.6	-97.4	0	0	0	110.1	G706 D710 T711 N778 Y780	G706-Y708 PolarHBondContact O-N 3.47Å; Y708-D710 WeakPolarHBondContact OH-CA 2.94Å; Y708-T711 PolarHBondContact OH-N 2.94Å; Y708-T711 PolarHBondContact OH-OG1 3.1Å; Y708-N778 HydrophobicContact CE2-CB 4.41Å; Y708-Y780 HydrophobicContact CD2-CD1 4.23Å; Y708-Y780 AromaticContact CD2-CE1 3.61Å; Y708-Y780 HydrophobicContact CD2-CE1 3.61Å; Y708-Y780 AromaticContact CD2-CZ 3.78Å; Y708-Y780 HydrophobicContact CG-CE1 4.16Å
709	I	93.2	Very high	91.7	Very high	24 Å²	24	54.4 Å²	54.4	12%	0.123	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-68	-179.7	-56.4	-178.8	0	0	0	109.9	F697 Y707 F762 L779 T781 I850	F697-I709 HydrophobicContact CB-CG2 3.54Å; F697-I709 HydrophobicContact CD1-CG2 4.26Å; F697-I709 HydrophobicContact CD2-CG2 3.89Å; F697-I709 HydrophobicContact CG-CG2 3.64Å; Y707-I709 HydrophobicContact CD1-CG1 4.4Å; I709-F762 HydrophobicContact CD1-CD1 3.63Å; I709-F762 HydrophobicContact CD1-CE1 3.69Å; I709-L779 HydrophobicContact CB-CB 4.43Å; I709-L779 HydrophobicContact CB-CD2 4.17Å; I709-L779 HydrophobicContact CB-CG 4.23Å; I709-L779 HydrophobicContact CD1-CD2 4.16Å; I709-L779 HydrophobicContact CD1-CG 4.17Å; I709-L779 HydrophobicContact CG2-CD2 4.15Å; I709-L779 PolarHBondContact N-O 3.3Å; I709-T781 HydrophobicContact CD1-CG2 4.24Å; I709-T781 HydrophobicContact CG1-CG2 4.5Å; I709-I850 HydrophobicContact CD1-CD1 4.21Å
710	D	93.3	Very high	91.5	Very high	65 Å²	65	59.5 Å²	59.5	35%	0.348	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.6	-178.6	179.3	-142.8	-22.7	0	0	0	113.5	F697 Y708 L779	F697-D710 HydrophobicContact CD1-CB 3.81Å; F697-D710 HydrophobicContact CE1-CB 3.27Å; F697-D710 WeakPolarHBondContact CE1-OD2 3.38Å; F697-D710 HydrophobicContact CE2-CB 4.44Å; F697-D710 HydrophobicContact CZ-CB 3.63Å; Y708-D710 WeakPolarHBondContact OH-CA 2.94Å; D710-L779 PolarHBondContact O-N 2.78Å
711	T	92.3	Very high	91.5	Very high	38 Å²	38	59 Å²	59	23%	0.233	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	147.8	178	-56.8	0	0	0	0	113.1	Y708 E776 L777 N778	Y708-T711 PolarHBondContact OH-N 2.94Å; Y708-T711 PolarHBondContact OH-OG1 3.1Å; T711-E776 HydrophobicContact CG2-CG 3.5Å; T711-L777 CarbonylContact C-O 3.47Å; T711-L777 VanDerWaalsContact CA-O 3.29Å; T711-L777 WeakPolarHBondContact CA-O 3.19Å; T711-N778 WeakPolarHBondContact CB-OD1 3.39Å; T711-N778 WeakPolarHBondContact CG2-OD1 3.22Å; T711-N778 PolarHBondContact OG1-OD1 3.4Å
712	I	94.4	Very high	91.5	Very high	2 Å²	2	59.7 Å²	59.7	1%	0.01	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	135.5	-179.6	-65.2	172.7	0	0	0	109.7	F690 Y695 L777 L832 I848	F690-I712 HydrophobicContact CD1-CG2 3.82Å; F690-I712 HydrophobicContact CE1-CG2 4.2Å; Y695-I712 HydrophobicContact CD1-CD1 4.38Å; Y695-I712 HydrophobicContact CD1-CG1 3.86Å; Y695-I712 HydrophobicContact CD2-CD1 4.12Å; Y695-I712 HydrophobicContact CD2-CG1 4.29Å; Y695-I712 HydrophobicContact CE1-CB 4.28Å; Y695-I712 HydrophobicContact CE1-CG1 3.71Å; Y695-I712 HydrophobicContact CE1-CG2 4.31Å; Y695-I712 HydrophobicContact CE2-CD1 4.27Å; Y695-I712 HydrophobicContact CE2-CG1 4.14Å; Y695-I712 HydrophobicContact CE2-CG2 3.89Å; Y695-I712 HydrophobicContact CG-CD1 4.19Å; Y695-I712 HydrophobicContact CG-CG1 4.17Å; I712-L777 HydrophobicContact CB-CB 4.07Å; I712-L777 HydrophobicContact CB-CD1 4.5Å; I712-L777 HydrophobicContact CG2-CB 4.49Å; I712-L777 HydrophobicContact CG2-CD1 4.04Å; I712-L777 PolarHBondContact N-O 2.92Å; I712-L777 WeakPolarHBondContact O-CB 3.47Å; I712-L777 PolarHBondContact O-N 2.78Å; I712-L832 HydrophobicContact CD1-CD2 3.79Å; I712-L832 HydrophobicContact CG2-CD2 4.1Å; I712-I848 HydrophobicContact CD1-CD1 3.66Å; I712-I848 HydrophobicContact CD1-CG1 4.37Å
713	N	93	Very high	91.7	Very high	53 Å²	53	56 Å²	56	28%	0.283	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	146.2	179.6	-57.3	-60.6	0	0	0	113	F690 D691 Y775	F690-N713 WeakPolarHBondContact CA-O 3.31Å; D691-N713 HydrophobicContact CB-CB 4.33Å; D691-N713 PolarHBondContact N-O 2.8Å; D691-N713 VanDerWaalsContact N-O 3.16Å; D691-N713 WeakPolarHBondContact OD2-CB 3.38Å; D691-N713 PolarHBondContact OD2-ND2 2.78Å; N713-Y775 CarbonylContact C-O 3.54Å; N713-Y775 WeakPolarHBondContact CA-O 3.32Å
714	V	93.2	Very high	91.8	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	135.6	-178.3	-166.9	0	0	0	0	112.7	P688 E689 F690 L725 F727 N774 Y775 L777 A834	P688-V714 HydrophobicContact CB-CG1 4.16Å; E689-V714 CarbonylContact O-C 3.52Å; E689-V714 WeakPolarHBondContact O-CA 3.15Å; F690-V714 HydrophobicContact CD1-CG2 3.43Å; F690-V714 VanDerWaalsContact CD1-CG2 3.43Å; F690-V714 HydrophobicContact CE1-CG2 3.44Å; F690-V714 VanDerWaalsContact CE1-CG2 3.44Å; F690-V714 HydrophobicContact CG-CG2 4.23Å; F690-V714 HydrophobicContact CZ-CG2 4.27Å; V714-L725 HydrophobicContact CB-CD1 4.34Å; V714-L725 HydrophobicContact CG1-CD1 3.7Å; V714-F727 HydrophobicContact CB-CE1 4.18Å; V714-F727 HydrophobicContact CB-CZ 4.46Å; V714-F727 HydrophobicContact CG1-CE1 4.33Å; V714-F727 HydrophobicContact CG2-CE1 3.88Å; V714-F727 HydrophobicContact CG2-CZ 4.48Å; V714-N774 CarbonylContact O-C 3.43Å; V714-N774 PolarHBondContact O-OD1 3.33Å; V714-Y775 PolarHBondContact N-O 3.37Å; V714-Y775 PolarHBondContact O-N 2.84Å; V714-L777 HydrophobicContact CG2-CD1 3.95Å; V714-A834 HydrophobicContact CG1-CB 4.15Å
715	I	92.5	Very high	91.9	Very high	73 Å²	73	54 Å²	54	37%	0.374	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	147.4	-177.5	-62	171.3	0	0	0	112.5	P688 E689 H773 N774	P688-I715 CarbonylContact C-O 3.56Å; P688-I715 WeakPolarHBondContact CA-O 3.39Å; E689-I715 PolarHBondContact N-O 2.74Å; E689-I715 PolarHBondContact O-N 2.95Å; I715-H773 CarbonylContact C-O 3.29Å; I715-H773 WeakPolarHBondContact CA-O 3.21Å; I715-H773 HydrophobicContact CG2-CB 4.36Å; I715-N774 HydrophobicContact CG1-CB 4.16Å; I715-N774 WeakPolarHBondContact CG1-OD1 3.5Å
716	D	93.6	Very high	92.1	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.005	26%	0.258	C	S	.	.			trans	-140.5	124.5	171.8	-168	-36.9	0	0	0	110.7	D718 L725 H773	D716-D718 PolarHBondContact OD1-N 2.98Å; D716-L725 HydrophobicContact CB-CD1 4.48Å; D716-L725 HydrophobicContact CB-CD2 4.17Å; D716-H773 PolarHBondContact N-O 2.92Å; D716-H773 WeakPolarHBondContact O-CA 3.43Å; D716-H773 WeakPolarHBondContact O-CB 3.27Å; D716-H773 VanDerWaalsContact O-CG 3.29Å; D716-H773 PolarHBondContact O-ND1 2.81Å
717	K	91	Very high	92.3	Very high	95 Å²	95	50.5 Å²	50.5	41%	0.413	25%	0.247	S	C	.	.			trans	-90.4	-14.2	-166.6	-67.3	179.6	-156.2	137	0	115.1	E686 H773	E686-K717 HydrophobicContact CB-CB 4.22Å; E686-K717 VanDerWaalsContact CD-NZ 3.29Å; E686-K717 HydrophobicContact CG-CB 3.97Å; E686-K717 HydrophobicContact CG-CD 4.31Å; E686-K717 IonicContact OE1-NZ 3.13Å; E686-K717 PolarHBondContact OE1-NZ 2.85Å; E686-K717 IonicContact OE2-NZ 3.33Å; E686-K717 PolarHBondContact OE2-NZ 3.12Å; K717-H773 PolarHBondContact O-CE1 2.93Å
718	D	92.7	Very high	92.2	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.244	C	C	.	.	S	Bend	trans	-70.6	175	-178.7	-62.5	-15.7	0	0	0	111.1	N684 D685 E686 D716 N722 S723 H773	N684-D718 WeakPolarHBondContact CA-OD2 3.25Å; N684-D718 PolarHBondContact OD1-OD2 2.88Å; D685-D718 PolarHBondContact N-OD2 2.05Å; D685-D718 VanDerWaalsContact N-OD2 3.09Å; E686-D718 VanDerWaalsContact CB-OD1 3.25Å; E686-D718 WeakPolarHBondContact CB-OD1 3.47Å; E686-D718 WeakPolarHBondContact CG-OD1 3.13Å; E686-D718 PolarHBondContact N-OD1 2.76Å; E686-D718 PolarHBondContact N-OD2 3.5Å; E686-D718 VanDerWaalsContact N-OD2 3.12Å; D716-D718 PolarHBondContact OD1-N 2.98Å; D718-N722 HydrophobicContact CB-CB 3.36Å; D718-S723 WeakPolarHBondContact O-CB 3.4Å; D718-S723 PolarHBondContact O-OG 3.27Å; D718-H773 PolarHBondContact O-CE1 3.45Å; D718-H773 PolarHBondContact O-ND1 2.95Å
719	I	89.2	Confident	92.1	Very high	52 Å²	52	46.8 Å²	46.8	27%	0.267	24%	0.235	S	C	.	.			trans	-104.2	158.8	-178.3	66.7	174.8	0	0	0	113.8	R650 D682 I721 N722	R650-I719 VanDerWaalsContact NH2-CG2 3.35Å; D682-I719 HydrophobicContact CB-CD1 4.03Å; D682-I719 HydrophobicContact CB-CG1 4.11Å; I719-I721 PolarHBondContact O-N 2.9Å; I719-I721 VanDerWaalsContact O-N 3.14Å; I719-N722 WeakPolarHBondContact O-CB 3.26Å; I719-N722 PolarHBondContact O-N 2.84Å
720	D	87.9	Confident	91.8	Very high	111 Å²	111	49.9 Å²	49.9	59%	0.594	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	-112.6	173	-63.1	-31.3	0	0	0	114.8	N722	D720-N722 VanDerWaalsContact C-N 3.35Å
721	I	90.7	Very high	91.3	Very high	97 Å²	97	50.4 Å²	50.4	50%	0.497	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-23.8	-177.2	-161.9	173.6	0	0	0	111.8	I719 S723 S837 G838	I719-I721 PolarHBondContact O-N 2.9Å; I719-I721 VanDerWaalsContact O-N 3.14Å; I721-S723 VanDerWaalsContact C-N 3.27Å; I721-S723 PolarHBondContact O-N 2.78Å; I721-S837 WeakPolarHBondContact CD1-O 3.48Å; I721-S837 WeakPolarHBondContact CG1-O 3.16Å; I721-S837 CarbonylContact O-C 3.41Å; I721-S837 WeakPolarHBondContact O-CA 3.46Å; I721-S837 VanDerWaalsContact O-CB 3.3Å; I721-S837 WeakPolarHBondContact O-CB 3.5Å; I721-S837 PolarHBondContact O-N 2.81Å; I721-G838 PolarHBondContact O-N 2.95Å
722	N	91.2	Very high	90.5	Very high	20 Å²	20	50.7 Å²	50.7	11%	0.107	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-25.6	179.9	-70.2	-12.2	0	0	0	111.3	D682 N684 D718 I719 D720 D836 G838	D682-N722 PolarHBondContact OD2-ND2 2.96Å; N684-N722 HydrophobicContact CB-CB 4.22Å; N684-N722 WeakPolarHBondContact OD1-CA 3.32Å; N684-N722 WeakPolarHBondContact OD1-CB 3.34Å; N684-N722 VanDerWaalsContact OD1-CG 3.31Å; N684-N722 PolarHBondContact OD1-O 2.81Å; D718-N722 HydrophobicContact CB-CB 3.36Å; I719-N722 WeakPolarHBondContact O-CB 3.26Å; I719-N722 PolarHBondContact O-N 2.84Å; D720-N722 VanDerWaalsContact C-N 3.35Å; N722-D836 WeakPolarHBondContact O-CB 3.43Å; N722-G838 WeakPolarHBondContact OD1-CA 3.23Å
723	S	90.8	Very high	89	Confident	0 Å²	0	59 Å²	59	0%	0	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	23.3	177	55.3	0	0	0	0	117.3	D718 I721	D718-S723 WeakPolarHBondContact O-CB 3.4Å; D718-S723 PolarHBondContact O-OG 3.27Å; I721-S723 VanDerWaalsContact C-N 3.27Å; I721-S723 PolarHBondContact O-N 2.78Å
724	Q	91.4	Very high	87.1	Confident	100 Å²	100	60 Å²	60	47%	0.467	29%	0.289	S	S	.	.			trans	-100.5	110.5	-179.6	-178.2	174.9	-13.3	0	0	113.3	D836 S837	Q724-D836 CarbonylContact O-C 3.53Å; Q724-D836 WeakPolarHBondContact O-CA 3.36Å; Q724-S837 PolarHBondContact O-N 3.19Å; Q724-S837 VanDerWaalsContact O-N 3.17Å; Q724-S837 PolarHBondContact O-OG 3.2Å
725	L	92.7	Very high	84.6	Confident	12 Å²	12	68.7 Å²	68.7	6%	0.063	33%	0.33	C	S	.	.			trans	-99	145.7	-169.3	-53.5	-175	0	0	0	117.1	P688 V714 D716 F727 Y775 E835 D836	P688-L725 HydrophobicContact CB-CD1 4.11Å; P688-L725 HydrophobicContact CB-CD2 3.74Å; P688-L725 HydrophobicContact CG-CD2 3.45Å; P688-L725 VanDerWaalsContact CG-CD2 3.45Å; V714-L725 HydrophobicContact CB-CD1 4.34Å; V714-L725 HydrophobicContact CG1-CD1 3.7Å; D716-L725 HydrophobicContact CB-CD1 4.48Å; D716-L725 HydrophobicContact CB-CD2 4.17Å; L725-F727 HydrophobicContact CB-CE2 4.37Å; L725-F727 HydrophobicContact CB-CZ 3.98Å; L725-F727 HydrophobicContact CD1-CZ 4.21Å; L725-Y775 HydrophobicContact CB-CD2 4.29Å; L725-Y775 HydrophobicContact CB-CE1 4.33Å; L725-Y775 HydrophobicContact CB-CE2 3.93Å; L725-Y775 HydrophobicContact CD1-CD2 3.71Å; L725-Y775 HydrophobicContact CD1-CE2 3.97Å; L725-Y775 HydrophobicContact CD1-CG 4.34Å; L725-Y775 HydrophobicContact CG-CD2 4.11Å; L725-Y775 HydrophobicContact CG-CE2 3.82Å; L725-Y775 PolarHBondContact N-OH 2.81Å; L725-E835 CarbonylContact C-O 3.5Å; L725-E835 VanDerWaalsContact CA-O 3.28Å; L725-E835 WeakPolarHBondContact CA-O 3.23Å; L725-D836 HydrophobicContact CD2-CB 4.05Å
726	T	93.2	Very high	81.7	Confident	63 Å²	63	72.5 Å²	72.5	39%	0.387	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	144.5	170	-54.2	0	0	0	0	111.6	Y728 A834 E835	T726-Y728 HydrophobicContact CG2-CE1 4.25Å; T726-Y728 HydrophobicContact CG2-CE2 4.07Å; T726-A834 CarbonylContact O-C 3.41Å; T726-A834 WeakPolarHBondContact O-CA 3.4Å; T726-E835 PolarHBondContact N-O 2.9Å; T726-E835 PolarHBondContact O-N 2.88Å
727	F	94.1	Very high	78.7	Confident	37 Å²	37	78.8 Å²	78.8	16%	0.162	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	144.1	-172.7	-53.8	-80.2	0	0	0	115.2	V714 L725 Y775 L777 T833 A834	V714-F727 HydrophobicContact CB-CE1 4.18Å; V714-F727 HydrophobicContact CB-CZ 4.46Å; V714-F727 HydrophobicContact CG1-CE1 4.33Å; V714-F727 HydrophobicContact CG2-CE1 3.88Å; V714-F727 HydrophobicContact CG2-CZ 4.48Å; L725-F727 HydrophobicContact CB-CE2 4.37Å; L725-F727 HydrophobicContact CB-CZ 3.98Å; L725-F727 HydrophobicContact CD1-CZ 4.21Å; F727-Y775 AromaticContact CE2-CD1 3.69Å; F727-Y775 HydrophobicContact CE2-CD1 3.69Å; F727-Y775 HydrophobicContact CE2-CE1 4.23Å; F727-Y775 HydrophobicContact CE2-CG 4.23Å; F727-Y775 AromaticContact CZ-CD1 3.89Å; F727-Y775 HydrophobicContact CZ-CD1 3.89Å; F727-Y775 AromaticContact CZ-CG 3.94Å; F727-Y775 HydrophobicContact CZ-CG 3.94Å; F727-L777 HydrophobicContact CD1-CD1 3.72Å; F727-L777 HydrophobicContact CD1-CD2 4.05Å; F727-L777 HydrophobicContact CD1-CG 4.48Å; F727-L777 HydrophobicContact CD2-CD2 3.67Å; F727-L777 HydrophobicContact CE1-CD1 3.82Å; F727-L777 HydrophobicContact CE1-CD2 4.1Å; F727-L777 HydrophobicContact CE1-CG 4.38Å; F727-L777 HydrophobicContact CE2-CD2 3.73Å; F727-L777 HydrophobicContact CG-CD1 4.24Å; F727-L777 HydrophobicContact CG-CD2 3.83Å; F727-L777 HydrophobicContact CZ-CD1 4.41Å; F727-L777 HydrophobicContact CZ-CD2 3.94Å; F727-L777 HydrophobicContact CZ-CG 4.49Å; F727-T833 CarbonylContact C-O 3.49Å; F727-T833 VanDerWaalsContact CA-O 3.22Å; F727-T833 WeakPolarHBondContact CA-O 3.45Å; F727-A834 HydrophobicContact CD1-CB 3.82Å; F727-A834 HydrophobicContact CE1-CB 3.68Å
728	Y	92.1	Very high	75.8	Confident	105 Å²	105	80.5 Å²	80.5	41%	0.412	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	135.1	179	-48.3	-85.6	0	0	0	112.4	T726 L832 T833 E835	T726-Y728 HydrophobicContact CG2-CE1 4.25Å; T726-Y728 HydrophobicContact CG2-CE2 4.07Å; Y728-L832 WeakPolarHBondContact O-CA 3.36Å; Y728-T833 HydrophobicContact CD2-CG2 4.41Å; Y728-T833 PolarHBondContact N-O 3.27Å; Y728-T833 PolarHBondContact O-N 2.9Å; Y728-E835 HydrophobicContact CE2-CB 4.34Å; Y728-E835 WeakPolarHBondContact CE2-OE2 3.45Å; Y728-E835 PolarHBondContact OH-OE2 2.73Å
729	L	91.4	Very high	72.9	Confident	35 Å²	35	91.7 Å²	91.7	18%	0.183	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	121.4	175.7	-175.5	67.8	0	0	0	110.9	I760 F762 I764 L779 L830 L832 I848	L729-I760 HydrophobicContact CD2-CG2 4.43Å; L729-F762 HydrophobicContact CD2-CB 4.4Å; L729-I764 HydrophobicContact CB-CD1 4.08Å; L729-I764 HydrophobicContact CD1-CD1 3.85Å; L729-I764 HydrophobicContact CD2-CD1 3.87Å; L729-I764 HydrophobicContact CD2-CG1 4.05Å; L729-I764 HydrophobicContact CG-CD1 4.14Å; L729-L779 HydrophobicContact CD2-CD1 4.42Å; L729-L830 HydrophobicContact CD1-CB 3.97Å; L729-L830 HydrophobicContact CD1-CD1 4.29Å; L729-L830 HydrophobicContact CD2-CD1 4.46Å; L729-L832 HydrophobicContact CD1-CB 4.37Å; L729-I848 HydrophobicContact CD1-CD1 4.33Å
730	N	86.6	Confident	70.2	Confident	89 Å²	89	96.7 Å²	96.7	48%	0.476	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	159.7	-179.9	-70.4	-61.4	0	0	0	111.8	L830 L831	N730-L830 CarbonylContact O-C 3.53Å; N730-L830 WeakPolarHBondContact O-CA 3.45Å; N730-L831 PolarHBondContact N-O 3.21Å; N730-L831 PolarHBondContact O-N 2.83Å
731	Y	82.9	Confident	67.4	Low	76 Å²	76	98.3 Å²	98.3	30%	0.298	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	140.5	160.2	-76.9	-65.6	0	0	0	108.8	K733 I760 P761 Y828 L830	Y731-K733 PolarHBondContact O-N 2.87Å; Y731-K733 VanDerWaalsContact O-N 3.11Å; Y731-I760 HydrophobicContact CD2-CD1 4.18Å; Y731-I760 HydrophobicContact CD2-CG1 3.49Å; Y731-I760 VanDerWaalsContact CD2-CG1 3.49Å; Y731-I760 HydrophobicContact CE1-CG1 4.4Å; Y731-I760 HydrophobicContact CE2-CB 4.2Å; Y731-I760 HydrophobicContact CE2-CD1 4.46Å; Y731-I760 HydrophobicContact CE2-CG1 3.32Å; Y731-I760 HydrophobicContact CG-CG1 4.13Å; Y731-P761 WeakPolarHBondContact OH-CD 3.38Å; Y731-Y828 AromaticContact CE1-CD1 3.99Å; Y731-Y828 HydrophobicContact CE1-CD1 3.99Å; Y731-L830 HydrophobicContact CD1-CD2 3.69Å; Y731-L830 HydrophobicContact CE1-CD2 3.85Å; Y731-L830 HydrophobicContact CG-CD2 4.48Å
732	E	76.8	Confident	64.6	Low	44 Å²	44	102 Å²	102	21%	0.206	49%	0.494	C	S	.	.	P	Polyproline II helix	trans	-62.1	119	168.8	-168.7	178.1	154.5	0	0	109	K829 L847	E732-K829 HydrophobicContact CB-CD 4.4Å; E732-K829 HydrophobicContact CB-CG 4.28Å; E732-K829 PolarHBondContact N-O 3.18Å; E732-K829 VanDerWaalsContact N-O 3.15Å; E732-K829 IonicContact OE1-NZ 3.03Å; E732-K829 PolarHBondContact OE1-NZ 3.29Å; E732-K829 WeakPolarHBondContact OE2-CD 3.46Å; E732-K829 WeakPolarHBondContact OE2-CE 3.23Å; E732-K829 WeakPolarHBondContact OE2-CG 3.25Å; E732-K829 IonicContact OE2-NZ 2.72Å; E732-K829 PolarHBondContact OE2-NZ 3.45Å; E732-L847 HydrophobicContact CG-CD2 4.49Å; E732-L847 WeakPolarHBondContact OE2-CD2 3.3Å
733	K	62.4	Low	62	Low	175 Å²	175	107.4 Å²	107.4	76%	0.761	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-79.4	123	170.1	-71.4	179.7	-177.8	171.9	0	106.5	Y731 E735	Y731-K733 PolarHBondContact O-N 2.87Å; Y731-K733 VanDerWaalsContact O-N 3.11Å; K733-E735 PolarHBondContact O-N 2.75Å
734	D	53.2	Low	59.4	Low	74 Å²	74	119.1 Å²	119.1	40%	0.396	57%	0.569	S	S	.	*			trans	-64.9	103.9	165.5	-64.5	-50.9	0	0	0	107	N736 K797	D734-N736 PolarHBondContact O-N 3.12Å; D734-K797 VanDerWaalsContact OD2-CE 3.29Å; D734-K797 WeakPolarHBondContact OD2-CE 3.5Å; D734-K797 IonicContact OD2-NZ 2.73Å; D734-K797 PolarHBondContact OD2-NZ 3.46Å
735	E	40.8	Very low	56.5	Low	183 Å²	183	119.6 Å²	119.6	86%	0.855	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	20.6	-177.8	-71.2	-160.6	147.1	0	0	114.2	K733	K733-E735 PolarHBondContact O-N 2.75Å
736	N	31.2	Very low	53.6	Low	153 Å²	153	129.1 Å²	129.1	82%	0.818	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	16.5	177.2	-86.7	-19.1	0	0	0	115.5	D734	D734-N736 PolarHBondContact O-N 3.12Å
737	V	31.5	Very low	51	Low	134 Å²	134	136.5 Å²	136.5	81%	0.812	64%	0.642	S	S	*	*			trans	-110.5	62.2	171.2	-163.2	0	0	0	0	110.8
738	N	28.2	Very low	47.8	Very low	130 Å²	130	140.1 Å²	140.1	70%	0.695	67%	0.672	S	S	*	*			trans	-145.9	65.3	167	-106	-13.8	0	0	0	111.3
739	Y	33.4	Very low	45	Very low	235 Å²	235	142 Å²	142	92%	0.922	69%	0.69	S	S	*	*			trans	-125.2	81.6	148	-77.4	-78	0	0	0	108.8	N741	Y739-N741 PolarHBondContact O-N 3.01Å
740	L	30.8	Very low	41.9	Very low	158 Å²	158	149.9 Å²	149.9	83%	0.827	72%	0.722	S	S	*	*			trans	-60	108.6	151.2	-95.3	148.7	0	0	0	107.8
741	N	30.7	Very low	39.2	Very low	145 Å²	145	153 Å²	153	78%	0.775	74%	0.738	S	S	*	*			trans	-143.7	106.9	136.5	-126.8	-5.5	0	0	0	110.4	Y739	Y739-N741 PolarHBondContact O-N 3.01Å
742	K	31.8	Very low	36.4	Very low	174 Å²	174	160.4 Å²	160.4	76%	0.757	77%	0.766	S	S	*	*			trans	25.5	134.1	145.5	-69.6	172.5	175.3	175.3	0	118.6
743	D	35.4	Very low	34.1	Very low	134 Å²	134	166.1 Å²	166.1	72%	0.717	79%	0.79	S	S	*	*			trans	98.6	46.1	156.8	-53.8	-21.4	0	0	0	118.6
744	Y	38	Very low	32.4	Very low	246 Å²	246	162.1 Å²	162.1	97%	0.965	78%	0.784	S	S	*	*			trans	-144.8	85.9	149.4	-81.5	-73.4	0	0	0	111.8
745	S	28.6	Very low	31.2	Very low	110 Å²	110	164.3 Å²	164.3	77%	0.769	81%	0.805	S	S	*	*			trans	-119.1	85.5	166.5	60.4	0	0	0	0	109.5
746	Y	33.1	Very low	30.9	Very low	211 Å²	211	162.3 Å²	162.3	83%	0.827	80%	0.8	S	S	*	*			trans	-170.4	95.3	155.4	-134	-99.8	0	0	0	108.7
747	Y	37.7	Very low	31.4	Very low	219 Å²	219	164.6 Å²	164.6	86%	0.859	80%	0.802	S	S	*	*			trans	173	75	145.1	-91	-65	0	0	0	107	N749	Y747-N749 PolarHBondContact O-N 3.08Å
748	S	28.4	Very low	32.6	Very low	113 Å²	113	162.7 Å²	162.7	79%	0.79	78%	0.783	S	S	*	*			trans	-69.1	106.7	162	61.3	0	0	0	0	108.5
749	N	31.7	Very low	34.5	Very low	145 Å²	145	163.1 Å²	163.1	78%	0.775	78%	0.784	S	S	*	*			trans	-121	103	149.7	-91.9	-23.8	0	0	0	107.5	Y747 L751	Y747-N749 PolarHBondContact O-N 3.08Å; N749-L751 PolarHBondContact O-N 3.12Å
750	K	27.8	Very low	36.8	Very low	200 Å²	200	153.4 Å²	153.4	87%	0.87	75%	0.747	S	S	*	*			trans	-18.9	94.4	165.9	-87.7	168.3	167.1	168.8	0	113.4
751	L	29.7	Very low	39.6	Very low	154 Å²	154	146.3 Å²	146.3	81%	0.806	71%	0.711	S	S	*	*			trans	-94.9	103.2	149.6	-86.6	155.4	0	0	0	106.5	N749 F753	N749-L751 PolarHBondContact O-N 3.12Å; L751-F753 VanDerWaalsContact C-N 3.31Å; L751-F753 PolarHBondContact O-N 3.2Å
752	R	23	Very low	42.5	Very low	232 Å²	232	139.8 Å²	139.8	88%	0.875	68%	0.676	S	S	*	*			trans	-67.3	91.8	167.4	-79.6	179.5	170	172	-3.3	108
753	F	29.6	Very low	45.4	Very low	163 Å²	163	136 Å²	136	72%	0.715	66%	0.659	S	S	*	*			trans	-109.4	97.8	147.4	-84.3	-81.7	0	0	0	106.7	L751 S755	L751-F753 VanDerWaalsContact C-N 3.31Å; L751-F753 PolarHBondContact O-N 3.2Å; F753-S755 PolarHBondContact O-N 2.87Å
754	S	26.8	Very low	48.2	Very low	92 Å²	92	131.6 Å²	131.6	64%	0.643	64%	0.636	S	S	*	*			trans	-49.5	126	165.7	47	0	0	0	0	108.6	L756	S754-L756 VanDerWaalsContact C-N 3.26Å; S754-L756 PolarHBondContact O-N 3.37Å
755	S	27.2	Very low	50.8	Low	119 Å²	119	123.2 Å²	123.2	83%	0.832	61%	0.61	S	S	*	*			trans	-40	81.9	163.7	48.8	0	0	0	0	112.8	F753 K757	F753-S755 PolarHBondContact O-N 2.87Å; S755-K757 PolarHBondContact O-N 2.67Å
756	L	33.9	Very low	53.8	Low	142 Å²	142	121.6 Å²	121.6	74%	0.743	60%	0.599	S	S	*	*			trans	-83.8	90.1	159.3	-81	157	0	0	0	105.4	S754 K758	S754-L756 VanDerWaalsContact C-N 3.26Å; S754-L756 PolarHBondContact O-N 3.37Å; L756-K758 PolarHBondContact O-N 3.03Å
757	K	42.5	Very low	56.5	Low	201 Å²	201	117.6 Å²	117.6	87%	0.874	59%	0.585	S	S	*	*			trans	-58.4	85.5	150.5	-91.1	-176.6	172.7	-178.3	0	105	S755 I759	S755-K757 PolarHBondContact O-N 2.67Å; K757-I759 PolarHBondContact O-N 3.06Å; K757-I759 VanDerWaalsContact O-N 3.11Å
758	K	55.6	Low	58.9	Low	93 Å²	93	112.2 Å²	112.2	40%	0.404	56%	0.564	S	S	.	*	P	Polyproline II helix	trans	-62.4	117.8	173.8	-106.9	-169.9	176.3	-169.9	0	105.7	L756 I760 E789	L756-K758 PolarHBondContact O-N 3.03Å; K758-I760 PolarHBondContact O-N 3.14Å; K758-E789 IonicContact NZ-OE1 2.9Å; K758-E789 PolarHBondContact NZ-OE1 2.72Å; K758-E789 IonicContact NZ-OE2 2.83Å; K758-E789 PolarHBondContact NZ-OE2 2.95Å; K758-E789 VanDerWaalsContact NZ-OE2 3.13Å
759	I	68.9	Low	61.4	Low	140 Å²	140	109.2 Å²	109.2	72%	0.718	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-62.3	130.4	176.5	-62.5	168.4	0	0	0	106.1	K757 P761	K757-I759 PolarHBondContact O-N 3.06Å; K757-I759 VanDerWaalsContact O-N 3.11Å; I759-P761 WeakPolarHBondContact O-CD 3.11Å; I759-P761 VanDerWaalsContact O-N 3.15Å
760	I	81.6	Confident	62.8	Low	30 Å²	30	109.7 Å²	109.7	15%	0.154	54%	0.541	C	S	.	.	P	Polyproline II helix	trans	-52.3	122.8	173.7	-64.2	165.6	0	0	0	107	L729 Y731 K758 F762 L830	L729-I760 HydrophobicContact CD2-CG2 4.43Å; Y731-I760 HydrophobicContact CD2-CD1 4.18Å; Y731-I760 HydrophobicContact CD2-CG1 3.49Å; Y731-I760 VanDerWaalsContact CD2-CG1 3.49Å; Y731-I760 HydrophobicContact CE1-CG1 4.4Å; Y731-I760 HydrophobicContact CE2-CB 4.2Å; Y731-I760 HydrophobicContact CE2-CD1 4.46Å; Y731-I760 HydrophobicContact CE2-CG1 3.32Å; Y731-I760 HydrophobicContact CG-CG1 4.13Å; K758-I760 PolarHBondContact O-N 3.14Å; I760-F762 HydrophobicContact CG2-CB 4.02Å; I760-F762 HydrophobicContact CG2-CD2 3.89Å; I760-F762 HydrophobicContact CG2-CG 4.46Å; I760-F762 PolarHBondContact O-N 3.45Å; I760-L830 HydrophobicContact CG2-CD1 4.4Å; I760-L830 HydrophobicContact CG2-CD2 3.93Å
761	P	88.8	Confident	64.4	Low	10 Å²	10	107.1 Å²	107.1	7%	0.065	54%	0.537	C	S	.	.	S	Bend	trans	-76.7	27.7	-175.6	32.1	-34.6	0	0	0	112	Y731 I759 T781 N782 I785 Y828	Y731-P761 WeakPolarHBondContact OH-CD 3.38Å; I759-P761 WeakPolarHBondContact O-CD 3.11Å; I759-P761 VanDerWaalsContact O-N 3.15Å; P761-T781 CarbonylContact O-C 3.52Å; P761-T781 WeakPolarHBondContact O-CA 3.4Å; P761-N782 PolarHBondContact O-N 3.3Å; P761-I785 HydrophobicContact CB-CD1 3.83Å; P761-I785 HydrophobicContact CG-CD1 3.9Å; P761-Y828 HydrophobicContact CG-CE1 4Å; P761-Y828 HydrophobicContact CG-CE2 4.4Å
762	F	93	Very high	66.1	Low	8 Å²	8	104.2 Å²	104.2	4%	0.035	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	156.9	-178.3	-51.5	-76.6	0	0	0	111.3	I709 L729 I760 L779 Y780 T781 I785 Y828 L830 I850	I709-F762 HydrophobicContact CD1-CD1 3.63Å; I709-F762 HydrophobicContact CD1-CE1 3.69Å; L729-F762 HydrophobicContact CD2-CB 4.4Å; I760-F762 HydrophobicContact CG2-CB 4.02Å; I760-F762 HydrophobicContact CG2-CD2 3.89Å; I760-F762 HydrophobicContact CG2-CG 4.46Å; I760-F762 PolarHBondContact O-N 3.45Å; F762-L779 HydrophobicContact CB-CD1 4.14Å; F762-Y780 CarbonylContact C-O 3.57Å; F762-Y780 WeakPolarHBondContact CA-O 3.44Å; F762-T781 HydrophobicContact CE1-CG2 4.39Å; F762-I785 HydrophobicContact CE1-CD1 4.25Å; F762-I785 HydrophobicContact CZ-CD1 3.98Å; F762-Y828 HydrophobicContact CE2-CD1 4.23Å; F762-Y828 AromaticContact CE2-CD2 3.6Å; F762-Y828 HydrophobicContact CE2-CD2 3.6Å; F762-Y828 HydrophobicContact CE2-CE2 4.1Å; F762-Y828 AromaticContact CE2-CG 3.67Å; F762-Y828 HydrophobicContact CE2-CG 3.67Å; F762-Y828 AromaticContact CZ-CD2 3.62Å; F762-Y828 HydrophobicContact CZ-CD2 3.62Å; F762-Y828 HydrophobicContact CZ-CE2 4Å; F762-Y828 HydrophobicContact CZ-CG 4.17Å; F762-L830 HydrophobicContact CB-CD1 4.35Å; F762-L830 HydrophobicContact CD2-CD1 3.61Å; F762-L830 HydrophobicContact CE2-CD1 4.21Å; F762-L830 HydrophobicContact CG-CD1 4.17Å; F762-I850 HydrophobicContact CD1-CD1 3.68Å; F762-I850 HydrophobicContact CD2-CD1 3.87Å; F762-I850 HydrophobicContact CE1-CD1 3.51Å; F762-I850 HydrophobicContact CE1-CG2 4.06Å; F762-I850 HydrophobicContact CE2-CD1 3.69Å; F762-I850 HydrophobicContact CG-CD1 3.85Å; F762-I850 HydrophobicContact CZ-CB 4.19Å; F762-I850 HydrophobicContact CZ-CD1 3.52Å; F762-I850 HydrophobicContact CZ-CG1 4.44Å; F762-I850 HydrophobicContact CZ-CG2 3.88Å
763	K	92.4	Very high	68.9	Low	93 Å²	93	96 Å²	96	40%	0.404	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	154.3	177.5	65.4	177.8	-177.1	179	0	111.7	Y780 N782	K763-Y780 PolarHBondContact N-O 3.46Å; K763-Y780 PolarHBondContact O-N 3.26Å; K763-N782 HydrophobicContact CB-CB 4.48Å; K763-N782 HydrophobicContact CG-CB 4.44Å
764	I	93.4	Very high	71.7	Confident	43 Å²	43	90.7 Å²	90.7	22%	0.221	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	149.5	178.8	-65.3	172.2	0	0	0	111.5	L729 L777 N778 L779 L832	L729-I764 HydrophobicContact CB-CD1 4.08Å; L729-I764 HydrophobicContact CD1-CD1 3.85Å; L729-I764 HydrophobicContact CD2-CD1 3.87Å; L729-I764 HydrophobicContact CD2-CG1 4.05Å; L729-I764 HydrophobicContact CG-CD1 4.14Å; I764-L777 HydrophobicContact CG2-CB 3.98Å; I764-L777 HydrophobicContact CG2-CD2 4.28Å; I764-N778 VanDerWaalsContact CA-O 3.27Å; I764-N778 WeakPolarHBondContact CA-O 3.28Å; I764-L779 HydrophobicContact CD1-CD1 4.17Å; I764-L779 HydrophobicContact CG1-CD1 3.63Å; I764-L832 HydrophobicContact CD1-CD1 3.76Å; I764-L832 HydrophobicContact CD1-CD2 4.21Å
765	T	93	Very high	74.8	Confident	70 Å²	70	87.2 Å²	87.2	43%	0.429	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	141.8	170.4	58.8	0	0	0	0	111	L777 N778	T765-L777 CarbonylContact O-C 3.54Å; T765-L777 VanDerWaalsContact O-CA 3.27Å; T765-L777 WeakPolarHBondContact O-CA 3.18Å; T765-N778 PolarHBondContact N-O 3.41Å; T765-N778 VanDerWaalsContact N-O 3.11Å; T765-N778 PolarHBondContact O-N 3.03Å
766	S	91.5	Very high	77.9	Confident	76 Å²	76	84 Å²	84	53%	0.531	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	153.6	-176.2	66.8	0	0	0	0	115.3	E776	S766-E776 CarbonylContact C-O 3.57Å; S766-E776 VanDerWaalsContact CA-O 3.3Å; S766-E776 WeakPolarHBondContact CA-O 3.46Å
767	K	89.4	Confident	80.8	Confident	126 Å²	126	77.4 Å²	77.4	55%	0.548	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	129	176.8	-179.6	-174.5	173.2	-165.2	0	111.8	Y775 E776	K767-Y775 CarbonylContact O-C 3.59Å; K767-Y775 WeakPolarHBondContact O-CA 3.12Å; K767-E776 PolarHBondContact N-O 3.06Å; K767-E776 PolarHBondContact O-N 3.23Å
768	R	88.7	Confident	83.3	Confident	107 Å²	107	69.2 Å²	69.2	40%	0.404	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	133	174.4	-163.6	178.3	-170.5	177	7.1	110.9	Q772 N774 Y775	R768-Q772 PolarHBondContact NE-O 3.17Å; R768-Q772 PolarHBondContact NH2-O 3.02Å; R768-N774 CarbonylContact C-O 3.48Å; R768-N774 WeakPolarHBondContact CA-O 3.2Å; R768-Y775 HydrophobicContact CB-CD1 4.06Å; R768-Y775 HydrophobicContact CB-CE1 3.85Å; R768-Y775 HydrophobicContact CG-CD1 4.36Å; R768-Y775 HydrophobicContact CG-CD2 4.19Å; R768-Y775 HydrophobicContact CG-CE1 4.03Å; R768-Y775 HydrophobicContact CG-CE2 3.81Å; R768-Y775 HydrophobicContact CG-CG 4.45Å
769	L	80.1	Confident	85.1	Confident	49 Å²	49	64.9 Å²	64.9	26%	0.257	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	139.6	179.1	-61.9	168	0	0	0	109.5	N774 E776	L769-N774 HydrophobicContact CB-CB 4.26Å; L769-N774 PolarHBondContact N-O 2.94Å; L769-E776 HydrophobicContact CD1-CB 4.18Å
770	N	62.9	Low	86.4	Confident	155 Å²	155	61.2 Å²	61.2	83%	0.829	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-7.3	140.8	175.7	-57.5	-18.8	0	0	0	119.8
771	N	59.5	Low	86.9	Confident	147 Å²	147	59.8 Å²	59.8	79%	0.786	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	45	78	177.5	-75.4	7.7	0	0	0	114.6	H773	N771-H773 PolarHBondContact O-CD2 3.01Å; N771-H773 PolarHBondContact O-N 3.19Å
772	Q	66.6	Low	87	Confident	93 Å²	93	62 Å²	62	44%	0.435	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.6	-18.4	162.3	-69.4	178.9	-47.4	0	0	120.2	R768	R768-Q772 PolarHBondContact NE-O 3.17Å; R768-Q772 PolarHBondContact NH2-O 3.02Å
773	H	81.8	Confident	86.7	Confident	60 Å²	60	62.8 Å²	62.8	28%	0.278	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116	-14.3	-163.2	-55.3	-67.8	0	0	0	117.7	I715 D716 K717 D718 N771	I715-H773 CarbonylContact C-O 3.29Å; I715-H773 WeakPolarHBondContact CA-O 3.21Å; I715-H773 HydrophobicContact CG2-CB 4.36Å; D716-H773 PolarHBondContact N-O 2.92Å; D716-H773 WeakPolarHBondContact O-CA 3.43Å; D716-H773 WeakPolarHBondContact O-CB 3.27Å; D716-H773 VanDerWaalsContact O-CG 3.29Å; D716-H773 PolarHBondContact O-ND1 2.81Å; K717-H773 PolarHBondContact O-CE1 2.93Å; D718-H773 PolarHBondContact O-CE1 3.45Å; D718-H773 PolarHBondContact O-ND1 2.95Å; N771-H773 PolarHBondContact O-CD2 3.01Å; N771-H773 PolarHBondContact O-N 3.19Å
774	N	87.3	Confident	86.4	Confident	50 Å²	50	65 Å²	65	27%	0.267	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	143.9	-166.6	-163.9	-2.3	0	0	0	115.1	V714 I715 R768 L769	V714-N774 CarbonylContact O-C 3.43Å; V714-N774 PolarHBondContact O-OD1 3.33Å; I715-N774 HydrophobicContact CG1-CB 4.16Å; I715-N774 WeakPolarHBondContact CG1-OD1 3.5Å; R768-N774 CarbonylContact C-O 3.48Å; R768-N774 WeakPolarHBondContact CA-O 3.2Å; L769-N774 HydrophobicContact CB-CB 4.26Å; L769-N774 PolarHBondContact N-O 2.94Å
775	Y	92.8	Very high	86.2	Confident	19 Å²	19	63 Å²	63	8%	0.075	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	140.8	-177.7	-74.4	-104.5	0	0	0	113.4	N713 V714 L725 F727 K767 R768	N713-Y775 CarbonylContact C-O 3.54Å; N713-Y775 WeakPolarHBondContact CA-O 3.32Å; V714-Y775 PolarHBondContact N-O 3.37Å; V714-Y775 PolarHBondContact O-N 2.84Å; L725-Y775 HydrophobicContact CB-CD2 4.29Å; L725-Y775 HydrophobicContact CB-CE1 4.33Å; L725-Y775 HydrophobicContact CB-CE2 3.93Å; L725-Y775 HydrophobicContact CD1-CD2 3.71Å; L725-Y775 HydrophobicContact CD1-CE2 3.97Å; L725-Y775 HydrophobicContact CD1-CG 4.34Å; L725-Y775 HydrophobicContact CG-CD2 4.11Å; L725-Y775 HydrophobicContact CG-CE2 3.82Å; L725-Y775 PolarHBondContact N-OH 2.81Å; F727-Y775 AromaticContact CE2-CD1 3.69Å; F727-Y775 HydrophobicContact CE2-CD1 3.69Å; F727-Y775 HydrophobicContact CE2-CE1 4.23Å; F727-Y775 HydrophobicContact CE2-CG 4.23Å; F727-Y775 AromaticContact CZ-CD1 3.89Å; F727-Y775 HydrophobicContact CZ-CD1 3.89Å; F727-Y775 AromaticContact CZ-CG 3.94Å; F727-Y775 HydrophobicContact CZ-CG 3.94Å; K767-Y775 CarbonylContact O-C 3.59Å; K767-Y775 WeakPolarHBondContact O-CA 3.12Å; R768-Y775 HydrophobicContact CB-CD1 4.06Å; R768-Y775 HydrophobicContact CB-CE1 3.85Å; R768-Y775 HydrophobicContact CG-CD1 4.36Å; R768-Y775 HydrophobicContact CG-CD2 4.19Å; R768-Y775 HydrophobicContact CG-CE1 4.03Å; R768-Y775 HydrophobicContact CG-CE2 3.81Å; R768-Y775 HydrophobicContact CG-CG 4.45Å
776	E	92.5	Very high	86	Confident	53 Å²	53	61.2 Å²	61.2	25%	0.248	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	133.5	177.9	-173.3	-169.8	119.4	0	0	111.4	T711 S766 K767 L769	T711-E776 HydrophobicContact CG2-CG 3.5Å; S766-E776 CarbonylContact C-O 3.57Å; S766-E776 VanDerWaalsContact CA-O 3.3Å; S766-E776 WeakPolarHBondContact CA-O 3.46Å; K767-E776 PolarHBondContact N-O 3.06Å; K767-E776 PolarHBondContact O-N 3.23Å; L769-E776 HydrophobicContact CD1-CB 4.18Å
777	L	94.3	Very high	85.9	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	124.6	-175.4	-54.8	176.6	0	0	0	112.5	F690 T711 I712 V714 F727 I764 T765 L832	F690-L777 HydrophobicContact CE1-CD1 4.47Å; T711-L777 CarbonylContact C-O 3.47Å; T711-L777 VanDerWaalsContact CA-O 3.29Å; T711-L777 WeakPolarHBondContact CA-O 3.19Å; I712-L777 HydrophobicContact CB-CB 4.07Å; I712-L777 HydrophobicContact CB-CD1 4.5Å; I712-L777 HydrophobicContact CG2-CB 4.49Å; I712-L777 HydrophobicContact CG2-CD1 4.04Å; I712-L777 PolarHBondContact N-O 2.92Å; I712-L777 WeakPolarHBondContact O-CB 3.47Å; I712-L777 PolarHBondContact O-N 2.78Å; V714-L777 HydrophobicContact CG2-CD1 3.95Å; F727-L777 HydrophobicContact CD1-CD1 3.72Å; F727-L777 HydrophobicContact CD1-CD2 4.05Å; F727-L777 HydrophobicContact CD1-CG 4.48Å; F727-L777 HydrophobicContact CD2-CD2 3.67Å; F727-L777 HydrophobicContact CE1-CD1 3.82Å; F727-L777 HydrophobicContact CE1-CD2 4.1Å; F727-L777 HydrophobicContact CE1-CG 4.38Å; F727-L777 HydrophobicContact CE2-CD2 3.73Å; F727-L777 HydrophobicContact CG-CD1 4.24Å; F727-L777 HydrophobicContact CG-CD2 3.83Å; F727-L777 HydrophobicContact CZ-CD1 4.41Å; F727-L777 HydrophobicContact CZ-CD2 3.94Å; F727-L777 HydrophobicContact CZ-CG 4.49Å; I764-L777 HydrophobicContact CG2-CB 3.98Å; I764-L777 HydrophobicContact CG2-CD2 4.28Å; T765-L777 CarbonylContact O-C 3.54Å; T765-L777 VanDerWaalsContact O-CA 3.27Å; T765-L777 WeakPolarHBondContact O-CA 3.18Å; L777-L832 HydrophobicContact CD1-CD1 4.46Å; L777-L832 HydrophobicContact CD1-CD2 3.81Å
778	N	94.5	Very high	85.8	Confident	30 Å²	30	52.5 Å²	52.5	16%	0.16	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	131.7	-179.2	-64.6	-41	0	0	0	113.2	Y708 T711 I764 T765 Y780	Y708-N778 HydrophobicContact CE2-CB 4.41Å; T711-N778 WeakPolarHBondContact CB-OD1 3.39Å; T711-N778 WeakPolarHBondContact CG2-OD1 3.22Å; T711-N778 PolarHBondContact OG1-OD1 3.4Å; I764-N778 VanDerWaalsContact CA-O 3.27Å; I764-N778 WeakPolarHBondContact CA-O 3.28Å; T765-N778 PolarHBondContact N-O 3.41Å; T765-N778 VanDerWaalsContact N-O 3.11Å; T765-N778 PolarHBondContact O-N 3.03Å; N778-Y780 HydrophobicContact CB-CE2 3.65Å
779	L	95.1	Very high	85.6	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.005	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	133.4	-175.2	-176.8	68.3	0	0	0	113.1	F697 I709 D710 L729 F762 I764 I848 I850	F697-L779 HydrophobicContact CD2-CD2 3.78Å; F697-L779 HydrophobicContact CE2-CD2 3.76Å; I709-L779 HydrophobicContact CB-CB 4.43Å; I709-L779 HydrophobicContact CB-CD2 4.17Å; I709-L779 HydrophobicContact CB-CG 4.23Å; I709-L779 HydrophobicContact CD1-CD2 4.16Å; I709-L779 HydrophobicContact CD1-CG 4.17Å; I709-L779 HydrophobicContact CG2-CD2 4.15Å; I709-L779 PolarHBondContact N-O 3.3Å; D710-L779 PolarHBondContact O-N 2.78Å; L729-L779 HydrophobicContact CD2-CD1 4.42Å; F762-L779 HydrophobicContact CB-CD1 4.14Å; I764-L779 HydrophobicContact CD1-CD1 4.17Å; I764-L779 HydrophobicContact CG1-CD1 3.63Å; L779-I848 HydrophobicContact CD2-CG2 4.26Å; L779-I850 HydrophobicContact CD2-CD1 4.08Å
780	Y	94.8	Very high	86	Confident	63 Å²	63	49.8 Å²	49.8	25%	0.247	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	157.8	-178.2	-58	-95.8	0	0	0	113.4	Y707 Y708 F762 K763 N778	Y707-Y780 CarbonylContact O-C 3.59Å; Y707-Y780 VanDerWaalsContact O-CA 3.24Å; Y707-Y780 WeakPolarHBondContact O-CA 3.35Å; Y708-Y780 HydrophobicContact CD2-CD1 4.23Å; Y708-Y780 AromaticContact CD2-CE1 3.61Å; Y708-Y780 HydrophobicContact CD2-CE1 3.61Å; Y708-Y780 AromaticContact CD2-CZ 3.78Å; Y708-Y780 HydrophobicContact CG-CE1 4.16Å; F762-Y780 CarbonylContact C-O 3.57Å; F762-Y780 WeakPolarHBondContact CA-O 3.44Å; K763-Y780 PolarHBondContact N-O 3.46Å; K763-Y780 PolarHBondContact O-N 3.26Å; N778-Y780 HydrophobicContact CB-CE2 3.65Å
781	T	92.5	Very high	87	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	148.8	167.4	66.7	0	0	0	0	112.3	I699 I704 G706 Y707 I709 P761 F762	I699-T781 HydrophobicContact CD1-CG2 3.33Å; I704-T781 PolarHBondContact O-OG1 3.41Å; G706-T781 WeakPolarHBondContact CA-O 3.45Å; G706-T781 PolarHBondContact N-O 2.85Å; G706-T781 PolarHBondContact N-OG1 2.88Å; Y707-T781 PolarHBondContact N-OG1 3.24Å; Y707-T781 PolarHBondContact O-N 3.31Å; I709-T781 HydrophobicContact CD1-CG2 4.24Å; I709-T781 HydrophobicContact CG1-CG2 4.5Å; P761-T781 CarbonylContact O-C 3.52Å; P761-T781 WeakPolarHBondContact O-CA 3.4Å; F762-T781 HydrophobicContact CE1-CG2 4.39Å
782	N	91.4	Very high	88	Confident	57 Å²	57	42.5 Å²	42.5	31%	0.305	20%	0.2	S	C	.	.			trans	-138.4	3	-177.1	-162.9	39.6	0	0	0	114	Q705 P761 K763	Q705-N782 PolarHBondContact NE2-O 3.38Å; P761-N782 PolarHBondContact O-N 3.3Å; K763-N782 HydrophobicContact CB-CB 4.48Å; K763-N782 HydrophobicContact CG-CB 4.44Å
783	G	85.4	Confident	88.7	Confident	23 Å²	23	42.8 Å²	42.8	24%	0.237	20%	0.2	C	C	.	.	S	Bend	trans	-162.6	-177.6	179.4	0	0	0	0	0	113.2
784	K	86.6	Confident	88.4	Confident	139 Å²	139	41.2 Å²	41.2	60%	0.604	19%	0.194	S	C	*	.			trans	-66.5	136.6	176.9	-166.9	-167.6	-178.3	-151.7	0	110.3	D786	K784-D786 IonicContact NZ-OD2 3.52Å; K784-D786 PolarHBondContact NZ-OD2 3.34Å
785	I	89.9	Confident	87.7	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.005	20%	0.198	C	C	.	.			trans	-112.6	122.2	172.3	-52.2	-60.2	0	0	0	107.8	I699 N702 P761 F762 Y828 V852	I699-I785 HydrophobicContact CG2-CG2 4.46Å; N702-I785 PolarHBondContact N-O 2.88Å; P761-I785 HydrophobicContact CB-CD1 3.83Å; P761-I785 HydrophobicContact CG-CD1 3.9Å; F762-I785 HydrophobicContact CE1-CD1 4.25Å; F762-I785 HydrophobicContact CZ-CD1 3.98Å; I785-Y828 HydrophobicContact CD1-CE2 4.1Å; I785-Y828 HydrophobicContact CG2-CE2 4.44Å; I785-V852 HydrophobicContact CG2-CB 4.46Å; I785-V852 HydrophobicContact CG2-CG1 3.71Å; I785-V852 HydrophobicContact CG2-CG2 3.83Å
786	D	88.3	Confident	86.7	Confident	34 Å²	34	49.3 Å²	49.3	18%	0.182	22%	0.223	C	C	.	.			trans	-143.3	116.9	-173.9	-178.5	-62.4	0	0	0	106.7	K784 E789 L790	K784-D786 IonicContact NZ-OD2 3.52Å; K784-D786 PolarHBondContact NZ-OD2 3.34Å; D786-E789 HydrophobicContact CB-CB 4.08Å; D786-E789 WeakPolarHBondContact OD1-CB 3.08Å; D786-E789 PolarHBondContact OD1-N 2.69Å; D786-L790 WeakPolarHBondContact O-CB 3.36Å; D786-L790 PolarHBondContact O-N 3.2Å; D786-L790 VanDerWaalsContact O-N 3.15Å
787	R	89.2	Confident	85.4	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.015	23%	0.229	C	C	.	.	H	α-helix	trans	-73.5	-39.8	-167.5	-174.3	178.5	167.4	-82.1	0.2	111.1	E701 E789 L790 I791 V852 D854 E894	E701-R787 HydrophobicContact CB-CB 4.3Å; E701-R787 WeakPolarHBondContact OE2-CB 3.41Å; E701-R787 PolarHBondContact OE2-N 2.81Å; R787-E789 PolarHBondContact O-N 3.14Å; R787-L790 WeakPolarHBondContact O-CB 3.19Å; R787-L790 PolarHBondContact O-N 2.57Å; R787-I791 HydrophobicContact CG-CD1 4.13Å; R787-I791 WeakPolarHBondContact O-CG1 3.42Å; R787-I791 PolarHBondContact O-N 2.82Å; R787-V852 HydrophobicContact CB-CG1 3.82Å; R787-V852 WeakPolarHBondContact CD-O 3.18Å; R787-V852 HydrophobicContact CG-CB 4.37Å; R787-V852 HydrophobicContact CG-CG1 4.17Å; R787-D854 IonicContact CZ-OD1 3.51Å; R787-D854 IonicContact NE-OD1 2.85Å; R787-D854 IonicContact NH1-OD1 3.88Å; R787-D854 PolarHBondContact NH1-OD1 3.09Å; R787-E894 IonicContact CZ-OE2 2.9Å; R787-E894 IonicContact NE-OE2 2.99Å; R787-E894 IonicContact NH2-OE1 2.79Å; R787-E894 IonicContact NH2-OE2 3.74Å; R787-E894 PolarHBondContact NH2-OE2 2.83Å
788	E	87.1	Confident	83.9	Confident	15 Å²	15	54.2 Å²	54.2	7%	0.07	25%	0.247	C	C	.	.	H	α-helix	trans	-72.2	-34.6	-176.6	-71.3	54.4	-110.1	0	0	110.1	R792	E788-R792 WeakPolarHBondContact O-CB 2.89Å; E788-R792 WeakPolarHBondContact O-CD 3.33Å; E788-R792 WeakPolarHBondContact O-CG 3.42Å; E788-R792 PolarHBondContact O-N 2.79Å
789	E	86	Confident	82	Confident	90 Å²	90	59.7 Å²	59.7	42%	0.421	27%	0.27	S	S	.	.	H	α-helix	trans	-66.9	-39.8	170.4	-161.6	-170.5	-178.4	0	0	112	K758 D786 R787 R792 F793	K758-E789 IonicContact NZ-OE1 2.9Å; K758-E789 PolarHBondContact NZ-OE1 2.72Å; K758-E789 IonicContact NZ-OE2 2.83Å; K758-E789 PolarHBondContact NZ-OE2 2.95Å; K758-E789 VanDerWaalsContact NZ-OE2 3.13Å; D786-E789 HydrophobicContact CB-CB 4.08Å; D786-E789 WeakPolarHBondContact OD1-CB 3.08Å; D786-E789 PolarHBondContact OD1-N 2.69Å; R787-E789 PolarHBondContact O-N 3.14Å; E789-R792 PolarHBondContact O-N 2.9Å; E789-F793 WeakPolarHBondContact O-CB 3.43Å; E789-F793 PolarHBondContact O-N 3.25Å
790	L	86.8	Confident	79.9	Confident	8 Å²	8	65.3 Å²	65.3	4%	0.042	30%	0.304	C	S	.	.	H	α-helix	trans	-62.8	-48.6	175.5	176.8	61.8	0	0	0	111.2	D786 R787 R792 F793 N794 S826 Y828 V852	D786-L790 WeakPolarHBondContact O-CB 3.36Å; D786-L790 PolarHBondContact O-N 3.2Å; D786-L790 VanDerWaalsContact O-N 3.15Å; R787-L790 WeakPolarHBondContact O-CB 3.19Å; R787-L790 PolarHBondContact O-N 2.57Å; L790-R792 VanDerWaalsContact C-N 3.34Å; L790-R792 PolarHBondContact O-N 3.2Å; L790-F793 WeakPolarHBondContact O-CB 3.41Å; L790-F793 PolarHBondContact O-N 2.8Å; L790-F793 VanDerWaalsContact O-N 3.09Å; L790-N794 WeakPolarHBondContact CD1-ND2 3.18Å; L790-N794 WeakPolarHBondContact O-CB 3.46Å; L790-N794 PolarHBondContact O-N 2.88Å; L790-S826 WeakPolarHBondContact CD2-O 3.32Å; L790-Y828 HydrophobicContact CD1-CD1 3.96Å; L790-Y828 HydrophobicContact CD1-CE1 3.65Å; L790-Y828 HydrophobicContact CD1-CE2 4.45Å; L790-Y828 HydrophobicContact CD2-CD2 4.07Å; L790-Y828 HydrophobicContact CD2-CE2 3.87Å; L790-Y828 HydrophobicContact CD2-CG 4.49Å; L790-V852 HydrophobicContact CD2-CB 4.48Å; L790-V852 HydrophobicContact CD2-CG2 3.76Å
791	I	84.2	Confident	77.7	Confident	16 Å²	16	66.1 Å²	66.1	8%	0.082	31%	0.312	C	S	.	.	H	α-helix	trans	-58.6	-46.5	176.6	-70.1	170.9	0	0	0	110.1	R787 F793 N794 Q795 L825	R787-I791 HydrophobicContact CG-CD1 4.13Å; R787-I791 WeakPolarHBondContact O-CG1 3.42Å; R787-I791 PolarHBondContact O-N 2.82Å; I791-F793 VanDerWaalsContact C-N 3.3Å; I791-F793 PolarHBondContact O-N 2.9Å; I791-N794 PolarHBondContact O-N 3.07Å; I791-Q795 HydrophobicContact CG2-CG 4.22Å; I791-Q795 VanDerWaalsContact O-CB 3.26Å; I791-Q795 WeakPolarHBondContact O-CB 3.12Å; I791-Q795 WeakPolarHBondContact O-CG 3.42Å; I791-Q795 PolarHBondContact O-N 2.72Å; I791-L825 HydrophobicContact CB-CB 4.49Å; I791-L825 HydrophobicContact CG1-CB 4.1Å; I791-L825 HydrophobicContact CG2-CB 4.27Å; I791-L825 HydrophobicContact CG2-CD1 4.38Å
792	R	82	Confident	75.2	Confident	134 Å²	134	72.4 Å²	72.4	51%	0.506	35%	0.345	S	S	.	.	H	α-helix	trans	-61.9	-37	176.6	-73.3	169.3	-169	169	7.5	112.2	E788 E789 L790 R796	E788-R792 WeakPolarHBondContact O-CB 2.89Å; E788-R792 WeakPolarHBondContact O-CD 3.33Å; E788-R792 WeakPolarHBondContact O-CG 3.42Å; E788-R792 PolarHBondContact O-N 2.79Å; E789-R792 PolarHBondContact O-N 2.9Å; L790-R792 VanDerWaalsContact C-N 3.34Å; L790-R792 PolarHBondContact O-N 3.2Å; R792-R796 WeakPolarHBondContact O-CB 3.35Å; R792-R796 VanDerWaalsContact O-CG 3.25Å; R792-R796 WeakPolarHBondContact O-CG 3.39Å; R792-R796 PolarHBondContact O-N 3.16Å
793	F	79.3	Confident	72.6	Confident	98 Å²	98	77.4 Å²	77.4	43%	0.43	36%	0.361	S	S	.	.	H	α-helix	trans	-68.1	-49.2	177.2	178.2	-97.9	0	0	0	111.5	E789 L790 I791 Q795 R796 K797	E789-F793 WeakPolarHBondContact O-CB 3.43Å; E789-F793 PolarHBondContact O-N 3.25Å; L790-F793 WeakPolarHBondContact O-CB 3.41Å; L790-F793 PolarHBondContact O-N 2.8Å; L790-F793 VanDerWaalsContact O-N 3.09Å; I791-F793 VanDerWaalsContact C-N 3.3Å; I791-F793 PolarHBondContact O-N 2.9Å; F793-Q795 PolarHBondContact O-N 2.87Å; F793-R796 WeakPolarHBondContact O-CB 3Å; F793-R796 PolarHBondContact O-N 2.68Å; F793-K797 PolarHBondContact O-N 3.38Å
794	N	77.3	Confident	70.4	Confident	28 Å²	28	79.3 Å²	79.3	15%	0.15	37%	0.374	C	S	.	.	H	α-helix	trans	-65	-38.6	178.6	-72.2	-18.4	0	0	0	111.6	L790 I791 R796 K797 L798 L825	L790-N794 WeakPolarHBondContact CD1-ND2 3.18Å; L790-N794 WeakPolarHBondContact O-CB 3.46Å; L790-N794 PolarHBondContact O-N 2.88Å; I791-N794 PolarHBondContact O-N 3.07Å; N794-R796 PolarHBondContact O-N 2.7Å; N794-K797 WeakPolarHBondContact O-CB 3.31Å; N794-K797 PolarHBondContact O-N 2.92Å; N794-L798 PolarHBondContact O-N 3.47Å; N794-L825 HydrophobicContact CB-CD2 3.57Å; N794-L825 PolarHBondContact ND2-O 3.04Å
795	Q	72.1	Confident	68.1	Low	76 Å²	76	81.6 Å²	81.6	36%	0.355	38%	0.38	S	S	.	.	H	α-helix	trans	-63.2	-38.3	172	-76.1	178.2	-1.5	0	0	112.9	I791 F793 K797 L798 K799 L825	I791-Q795 HydrophobicContact CG2-CG 4.22Å; I791-Q795 VanDerWaalsContact O-CB 3.26Å; I791-Q795 WeakPolarHBondContact O-CB 3.12Å; I791-Q795 WeakPolarHBondContact O-CG 3.42Å; I791-Q795 PolarHBondContact O-N 2.72Å; F793-Q795 PolarHBondContact O-N 2.87Å; Q795-K797 VanDerWaalsContact C-N 3.35Å; Q795-L798 PolarHBondContact O-N 2.72Å; Q795-K799 PolarHBondContact O-N 3.2Å; Q795-L825 HydrophobicContact CG-CD1 3.79Å; Q795-L825 HydrophobicContact CG-CD2 3.88Å; Q795-L825 HydrophobicContact CG-CG 4.48Å
796	R	71	Confident	65.8	Low	162 Å²	162	87.9 Å²	87.9	61%	0.611	41%	0.413	S	S	*	.	H	α-helix	trans	-66.5	-39	174.1	-77.3	173.3	-176.1	168.7	4.3	111.1	R792 F793 N794 L798 K799 T800	R792-R796 WeakPolarHBondContact O-CB 3.35Å; R792-R796 VanDerWaalsContact O-CG 3.25Å; R792-R796 WeakPolarHBondContact O-CG 3.39Å; R792-R796 PolarHBondContact O-N 3.16Å; F793-R796 WeakPolarHBondContact O-CB 3Å; F793-R796 PolarHBondContact O-N 2.68Å; N794-R796 PolarHBondContact O-N 2.7Å; R796-L798 VanDerWaalsContact C-N 3.34Å; R796-K799 PolarHBondContact O-N 3.03Å; R796-T800 PolarHBondContact O-N 3.35Å; R796-T800 PolarHBondContact O-OG1 2.8Å; R796-T800 VanDerWaalsContact O-OG1 3.04Å
797	K	65.6	Low	63.2	Low	82 Å²	82	92 Å²	92	36%	0.357	44%	0.435	S	S	.	.	H	α-helix	trans	-60.7	-44.1	175.1	-151.1	-171.7	-175.6	-155.4	0	110.8	D734 F793 N794 Q795 T800 I801	D734-K797 VanDerWaalsContact OD2-CE 3.29Å; D734-K797 WeakPolarHBondContact OD2-CE 3.5Å; D734-K797 IonicContact OD2-NZ 2.73Å; D734-K797 PolarHBondContact OD2-NZ 3.46Å; F793-K797 PolarHBondContact O-N 3.38Å; N794-K797 WeakPolarHBondContact O-CB 3.31Å; N794-K797 PolarHBondContact O-N 2.92Å; Q795-K797 VanDerWaalsContact C-N 3.35Å; K797-T800 PolarHBondContact O-N 3.4Å; K797-T800 PolarHBondContact O-OG1 2.73Å; K797-I801 PolarHBondContact O-N 2.62Å
798	L	63	Low	60.8	Low	77 Å²	77	97.7 Å²	97.7	40%	0.403	47%	0.465	S	S	.	.	H	α-helix	trans	-68.5	-36.2	175.9	-75.7	159.9	0	0	0	113.5	N794 Q795 R796 T800 I801 L825	N794-L798 PolarHBondContact O-N 3.47Å; Q795-L798 PolarHBondContact O-N 2.72Å; R796-L798 VanDerWaalsContact C-N 3.34Å; L798-T800 PolarHBondContact O-N 2.91Å; L798-I801 CarbonylContact O-C 3.55Å; L798-I801 WeakPolarHBondContact O-CB 3.34Å; L798-I801 PolarHBondContact O-N 2.8Å; L798-L825 HydrophobicContact CD1-CD2 3.54Å
799	K	54.4	Low	58.4	Low	145 Å²	145	102.4 Å²	102.4	63%	0.63	49%	0.491	S	S	*	.	H	α-helix	trans	-68.8	-20.2	176.2	-81.9	-177.2	177.4	177.2	0	114.2	Q795 R796	Q795-K799 PolarHBondContact O-N 3.2Å; R796-K799 PolarHBondContact O-N 3.03Å
800	T	51.5	Low	55.9	Low	119 Å²	119	104.4 Å²	104.4	73%	0.73	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-15.8	169.2	26.2	0	0	0	0	113.3	R796 K797 L798	R796-T800 PolarHBondContact O-N 3.35Å; R796-T800 PolarHBondContact O-OG1 2.8Å; R796-T800 VanDerWaalsContact O-OG1 3.04Å; K797-T800 PolarHBondContact O-N 3.4Å; K797-T800 PolarHBondContact O-OG1 2.73Å; L798-T800 PolarHBondContact O-N 2.91Å
801	I	48.4	Very low	53.6	Low	80 Å²	80	111.6 Å²	111.6	41%	0.41	54%	0.543	S	S	.	.	S	Bend	trans	-86.4	123.9	170.8	-60.6	168.3	0	0	0	105.7	K797 L798	K797-I801 PolarHBondContact O-N 2.62Å; L798-I801 CarbonylContact O-C 3.55Å; L798-I801 WeakPolarHBondContact O-CB 3.34Å; L798-I801 PolarHBondContact O-N 2.8Å
802	D	39.2	Very low	51.4	Low	132 Å²	132	116.4 Å²	116.4	71%	0.706	57%	0.569	S	S	*	*			trans	-46.9	143.4	-170.7	-134.4	-23.8	0	0	0	112.2	A804	D802-A804 HydrophobicContact CB-CB 4.43Å; D802-A804 PolarHBondContact O-N 3.49Å
803	Y	36.8	Very low	49.1	Very low	163 Å²	163	118.3 Å²	118.3	64%	0.639	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	21.3	177.2	-90.3	-91.7	0	0	0	113.7
804	A	39.5	Very low	47.1	Very low	62 Å²	62	118.4 Å²	118.4	51%	0.512	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.9	-20.6	-177.6	0	0	0	0	0	114.3	D802	D802-A804 HydrophobicContact CB-CB 4.43Å; D802-A804 PolarHBondContact O-N 3.49Å
805	Y	38.2	Very low	45.3	Very low	187 Å²	187	124 Å²	124	73%	0.733	62%	0.624	S	S	*	*	S	Bend	trans	-97.6	-9.5	-178.5	-84.4	-83.6	0	0	0	115.5
806	L	41.1	Very low	43.8	Very low	133 Å²	133	125.3 Å²	125.3	70%	0.696	63%	0.633	S	S	*	*	S	Bend	trans	-98.3	10.9	179.4	-79.6	162.8	0	0	0	114.2
807	N	34	Very low	42.3	Very low	120 Å²	120	121.2 Å²	121.2	64%	0.642	62%	0.623	S	S	*	*	S	Bend	trans	-116.5	15.4	179.3	-94.5	-21.4	0	0	0	114
808	I	38.6	Very low	41.1	Very low	124 Å²	124	122 Å²	122	64%	0.636	63%	0.632	S	S	*	*	S	Bend	trans	-107.1	129.9	169.7	-56.3	175.7	0	0	0	105.8
809	D	36.9	Very low	40.2	Very low	115 Å²	115	123.2 Å²	123.2	62%	0.615	64%	0.638	S	S	*	*			trans	83.1	36.1	-169.9	-57	-13.6	0	0	0	117.3	N811	D809-N811 PolarHBondContact O-N 3.18Å
810	N	33.6	Very low	39.6	Very low	132 Å²	132	124.5 Å²	124.5	71%	0.706	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	72.7	142.6	-84.3	-37.2	0	0	0	108.7
811	N	39.3	Very low	39.6	Very low	159 Å²	159	122.4 Å²	122.4	85%	0.85	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-169.2	1.7	158.6	-98.8	-15.3	0	0	0	116.1	D809	D809-N811 PolarHBondContact O-N 3.18Å
812	N	38.1	Very low	39.7	Very low	117 Å²	117	124 Å²	124	63%	0.626	63%	0.626	S	S	*	*			trans	-118.3	103.6	171.6	-82.5	-32	0	0	0	111.1	N814	N812-N814 PolarHBondContact O-N 3.43Å
813	N	33.7	Very low	40.6	Very low	173 Å²	173	122 Å²	122	93%	0.925	62%	0.615	S	S	*	*			trans	-59.8	84	162.4	-85.9	-31.3	0	0	0	109.4
814	N	36.3	Very low	42	Very low	100 Å²	100	120.2 Å²	120.2	54%	0.535	61%	0.613	S	S	.	*			trans	-123.8	109.8	162.5	-89.2	-24.5	0	0	0	108	N812 N816 N817	N812-N814 PolarHBondContact O-N 3.43Å; N814-N816 PolarHBondContact O-N 3.41Å; N814-N817 PolarHBondContact O-N 3.08Å
815	N	40	Very low	43.8	Very low	147 Å²	147	117.7 Å²	117.7	79%	0.786	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.4	-5	169.1	-79.5	-28.6	0	0	0	113.2
816	N	41.4	Very low	45.9	Very low	102 Å²	102	109.1 Å²	109.1	55%	0.545	56%	0.558	S	S	.	*	H	α-helix	trans	-74.6	-23	172.7	-68.5	-9.8	0	0	0	113.5	N814 N818 N819 Y820	N814-N816 PolarHBondContact O-N 3.41Å; N816-N818 VanDerWaalsContact C-N 3.26Å; N816-N818 PolarHBondContact O-N 3.45Å; N816-N819 PolarHBondContact O-N 2.66Å; N816-Y820 WeakPolarHBondContact O-CD2 3.33Å; N816-Y820 PolarHBondContact O-N 3.03Å
817	N	39.3	Very low	48.1	Very low	76 Å²	76	104 Å²	104	41%	0.406	53%	0.53	S	S	.	.	H	α-helix	trans	-66.9	-28.4	-177.9	-77.6	5	0	0	0	112.7	N814 I821	N814-N817 PolarHBondContact O-N 3.08Å; N817-I821 WeakPolarHBondContact O-CG1 3.37Å; N817-I821 PolarHBondContact O-N 3.47Å
818	N	39	Very low	50.7	Low	100 Å²	100	99.6 Å²	99.6	54%	0.535	51%	0.505	S	S	.	.	H	α-helix	trans	-71.6	-37.4	176.3	-70.9	-20.6	0	0	0	111.9	N816 I821 Y822	N816-N818 VanDerWaalsContact C-N 3.26Å; N816-N818 PolarHBondContact O-N 3.45Å; N818-I821 PolarHBondContact O-N 3.42Å; N818-Y822 WeakPolarHBondContact O-CD2 3.13Å; N818-Y822 PolarHBondContact O-N 2.64Å
819	N	44	Very low	53.1	Low	101 Å²	101	96.9 Å²	96.9	54%	0.54	49%	0.488	S	S	.	.	H	α-helix	trans	-68.1	-35.6	176.2	-84.9	9.9	0	0	0	112.3	N816 Y822 N823	N816-N819 PolarHBondContact O-N 2.66Å; N819-Y822 PolarHBondContact O-N 3.3Å; N819-N823 VanDerWaalsContact O-CB 3.27Å; N819-N823 WeakPolarHBondContact O-CB 3.4Å; N819-N823 VanDerWaalsContact O-CG 3.24Å; N819-N823 PolarHBondContact O-N 2.71Å
820	Y	42.5	Very low	55.6	Low	173 Å²	173	91.4 Å²	91.4	68%	0.678	46%	0.459	S	S	*	.	H	α-helix	trans	-64.1	-42.9	175.5	-92	-81.8	0	0	0	112.1	N816 N823 E824	N816-Y820 WeakPolarHBondContact O-CD2 3.33Å; N816-Y820 PolarHBondContact O-N 3.03Å; Y820-N823 PolarHBondContact O-N 3.48Å; Y820-E824 PolarHBondContact O-N 2.95Å
821	I	52.2	Low	58.4	Low	74 Å²	74	87.4 Å²	87.4	38%	0.379	44%	0.438	S	S	.	.	H	α-helix	trans	-66.5	-42.5	177.9	-64.4	167.5	0	0	0	110.9	N817 N818 E824 L825	N817-I821 WeakPolarHBondContact O-CG1 3.37Å; N817-I821 PolarHBondContact O-N 3.47Å; N818-I821 PolarHBondContact O-N 3.42Å; I821-E824 PolarHBondContact O-N 3.05Å; I821-L825 HydrophobicContact CG2-CD1 4Å; I821-L825 VanDerWaalsContact O-CG 3.22Å; I821-L825 WeakPolarHBondContact O-CG 3.5Å; I821-L825 PolarHBondContact O-N 2.85Å; I821-L825 VanDerWaalsContact O-N 3.15Å
822	Y	51.1	Low	61	Low	115 Å²	115	79.9 Å²	79.9	45%	0.451	40%	0.397	S	S	.	.	H	α-helix	trans	-66.5	-40.7	177.3	-89.7	-80.9	0	0	0	112.6	N818 N819 E824 L825 S826	N818-Y822 WeakPolarHBondContact O-CD2 3.13Å; N818-Y822 PolarHBondContact O-N 2.64Å; N819-Y822 PolarHBondContact O-N 3.3Å; Y822-E824 VanDerWaalsContact C-N 3.28Å; Y822-E824 PolarHBondContact O-N 2.96Å; Y822-L825 PolarHBondContact O-N 3Å; Y822-L825 VanDerWaalsContact O-N 3.11Å; Y822-S826 PolarHBondContact O-N 3.17Å; Y822-S826 PolarHBondContact O-OG 3.34Å
823	N	56.8	Low	63.6	Low	89 Å²	89	75.4 Å²	75.4	48%	0.476	37%	0.374	S	S	.	.	H	α-helix	trans	-65	-31.1	175.2	-75.9	-9.9	0	0	0	112.5	N819 Y820 L825 H827	N819-N823 VanDerWaalsContact O-CB 3.27Å; N819-N823 WeakPolarHBondContact O-CB 3.4Å; N819-N823 VanDerWaalsContact O-CG 3.24Å; N819-N823 PolarHBondContact O-N 2.71Å; Y820-N823 PolarHBondContact O-N 3.48Å; N823-L825 VanDerWaalsContact C-N 3.35Å; N823-H827 PolarHBondContact O-ND1 2.94Å
824	E	65.8	Low	66.5	Low	126 Å²	126	67.1 Å²	67.1	59%	0.589	33%	0.33	S	S	*	.	H	α-helix	trans	-70.6	-30.4	172	-89.7	-158	153.3	0	0	113.4	Y820 I821 Y822	Y820-E824 PolarHBondContact O-N 2.95Å; I821-E824 PolarHBondContact O-N 3.05Å; Y822-E824 VanDerWaalsContact C-N 3.28Å; Y822-E824 PolarHBondContact O-N 2.96Å
825	L	77.8	Confident	69.3	Low	8 Å²	8	64.2 Å²	64.2	4%	0.042	31%	0.313	C	S	.	.	H	α-helix	trans	-82.9	-21.5	-176.3	-69.2	172.4	0	0	0	113.3	I791 N794 Q795 L798 I821 Y822 N823	I791-L825 HydrophobicContact CB-CB 4.49Å; I791-L825 HydrophobicContact CG1-CB 4.1Å; I791-L825 HydrophobicContact CG2-CB 4.27Å; I791-L825 HydrophobicContact CG2-CD1 4.38Å; N794-L825 HydrophobicContact CB-CD2 3.57Å; N794-L825 PolarHBondContact ND2-O 3.04Å; Q795-L825 HydrophobicContact CG-CD1 3.79Å; Q795-L825 HydrophobicContact CG-CD2 3.88Å; Q795-L825 HydrophobicContact CG-CG 4.48Å; L798-L825 HydrophobicContact CD1-CD2 3.54Å; I821-L825 HydrophobicContact CG2-CD1 4Å; I821-L825 VanDerWaalsContact O-CG 3.22Å; I821-L825 WeakPolarHBondContact O-CG 3.5Å; I821-L825 PolarHBondContact O-N 2.85Å; I821-L825 VanDerWaalsContact O-N 3.15Å; Y822-L825 PolarHBondContact O-N 3Å; Y822-L825 VanDerWaalsContact O-N 3.11Å; N823-L825 VanDerWaalsContact C-N 3.35Å
826	S	82.6	Confident	71.9	Confident	8 Å²	8	57.2 Å²	57.2	6%	0.056	28%	0.276	C	S	.	.	S	Bend	trans	-98.5	5.3	-172.2	62.3	0	0	0	0	115.4	L790 Y822 V852	L790-S826 WeakPolarHBondContact CD2-O 3.32Å; Y822-S826 PolarHBondContact O-N 3.17Å; Y822-S826 PolarHBondContact O-OG 3.34Å; S826-V852 WeakPolarHBondContact O-CB 3.04Å; S826-V852 PolarHBondContact O-N 2.88Å
827	H	86.9	Confident	74.3	Confident	26 Å²	26	54 Å²	54	12%	0.12	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	154	178.8	70.4	-111.5	0	0	0	113.7	N823 Y849 I850 N851	N823-H827 PolarHBondContact O-ND1 2.94Å; H827-Y849 AromaticContact CD2-CD1 3.51Å; H827-Y849 AromaticContact NE2-CD1 3.43Å; H827-Y849 WeakPolarHBondContact NE2-CD1 3.13Å; H827-Y849 AromaticContact NE2-CE1 3.46Å; H827-Y849 WeakPolarHBondContact NE2-CE1 3.38Å; H827-I850 VanDerWaalsContact CA-O 3.29Å; H827-I850 WeakPolarHBondContact CA-O 3.42Å; H827-N851 VanDerWaalsContact CB-OD1 3.23Å; H827-N851 WeakPolarHBondContact CB-OD1 3.48Å
828	Y	88.9	Confident	76.6	Confident	26 Å²	26	50.5 Å²	50.5	10%	0.102	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	134.3	165.1	-68.3	-81	0	0	0	110.2	Y731 P761 F762 I785 L790 Y849 I850 V852	Y731-Y828 AromaticContact CE1-CD1 3.99Å; Y731-Y828 HydrophobicContact CE1-CD1 3.99Å; P761-Y828 HydrophobicContact CG-CE1 4Å; P761-Y828 HydrophobicContact CG-CE2 4.4Å; F762-Y828 HydrophobicContact CE2-CD1 4.23Å; F762-Y828 AromaticContact CE2-CD2 3.6Å; F762-Y828 HydrophobicContact CE2-CD2 3.6Å; F762-Y828 HydrophobicContact CE2-CE2 4.1Å; F762-Y828 AromaticContact CE2-CG 3.67Å; F762-Y828 HydrophobicContact CE2-CG 3.67Å; F762-Y828 AromaticContact CZ-CD2 3.62Å; F762-Y828 HydrophobicContact CZ-CD2 3.62Å; F762-Y828 HydrophobicContact CZ-CE2 4Å; F762-Y828 HydrophobicContact CZ-CG 4.17Å; I785-Y828 HydrophobicContact CD1-CE2 4.1Å; I785-Y828 HydrophobicContact CG2-CE2 4.44Å; L790-Y828 HydrophobicContact CD1-CD1 3.96Å; L790-Y828 HydrophobicContact CD1-CE1 3.65Å; L790-Y828 HydrophobicContact CD1-CE2 4.45Å; L790-Y828 HydrophobicContact CD2-CD2 4.07Å; L790-Y828 HydrophobicContact CD2-CE2 3.87Å; L790-Y828 HydrophobicContact CD2-CG 4.49Å; Y828-Y849 WeakPolarHBondContact O-CA 3.39Å; Y828-I850 PolarHBondContact N-O 2.05Å; Y828-I850 PolarHBondContact O-N 2.87Å; Y828-V852 HydrophobicContact CD2-CG2 4.07Å; Y828-V852 HydrophobicContact CE2-CG2 3.89Å
829	K	88.5	Confident	78.8	Confident	67 Å²	67	53 Å²	53	29%	0.291	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	106.3	176.7	-156.6	-178.4	-169.7	-146.5	0	110	E732 Y849	E732-K829 HydrophobicContact CB-CD 4.4Å; E732-K829 HydrophobicContact CB-CG 4.28Å; E732-K829 PolarHBondContact N-O 3.18Å; E732-K829 VanDerWaalsContact N-O 3.15Å; E732-K829 IonicContact OE1-NZ 3.03Å; E732-K829 PolarHBondContact OE1-NZ 3.29Å; E732-K829 WeakPolarHBondContact OE2-CD 3.46Å; E732-K829 WeakPolarHBondContact OE2-CE 3.23Å; E732-K829 WeakPolarHBondContact OE2-CG 3.25Å; E732-K829 IonicContact OE2-NZ 2.72Å; E732-K829 PolarHBondContact OE2-NZ 3.45Å; K829-Y849 HydrophobicContact CD-CE1 3.97Å; K829-Y849 WeakPolarHBondContact CE-OH 3.31Å; K829-Y849 HydrophobicContact CG-CD1 4.19Å; K829-Y849 HydrophobicContact CG-CE1 3.66Å
830	L	90.1	Very high	81	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	147.4	-175.3	-51	175.6	0	0	0	111	L729 N730 Y731 I760 F762 I848 I850	L729-L830 HydrophobicContact CD1-CB 3.97Å; L729-L830 HydrophobicContact CD1-CD1 4.29Å; L729-L830 HydrophobicContact CD2-CD1 4.46Å; N730-L830 CarbonylContact O-C 3.53Å; N730-L830 WeakPolarHBondContact O-CA 3.45Å; Y731-L830 HydrophobicContact CD1-CD2 3.69Å; Y731-L830 HydrophobicContact CE1-CD2 3.85Å; Y731-L830 HydrophobicContact CG-CD2 4.48Å; I760-L830 HydrophobicContact CG2-CD1 4.4Å; I760-L830 HydrophobicContact CG2-CD2 3.93Å; F762-L830 HydrophobicContact CB-CD1 4.35Å; F762-L830 HydrophobicContact CD2-CD1 3.61Å; F762-L830 HydrophobicContact CE2-CD1 4.21Å; F762-L830 HydrophobicContact CG-CD1 4.17Å; L830-I848 HydrophobicContact CB-CB 4.3Å; L830-I848 PolarHBondContact N-O 2.98Å; L830-I848 PolarHBondContact O-N 3.38Å; L830-I850 HydrophobicContact CD1-CD1 3.78Å
831	L	91.5	Very high	83.3	Confident	49 Å²	49	49 Å²	49	26%	0.257	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	121.2	176.6	-169.2	72.5	0	0	0	109.4	N730 L847	N730-L831 PolarHBondContact N-O 3.21Å; N730-L831 PolarHBondContact O-N 2.83Å; L831-L847 HydrophobicContact CD1-CD2 3.8Å; L831-L847 HydrophobicContact CD1-CG 4.49Å
832	L	94.1	Very high	85.3	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	123.8	173.6	172.7	61.9	0	0	0	109.5	F690 I712 Y728 L729 I764 L777 T845 V846 I848	F690-L832 HydrophobicContact CE1-CD2 3.75Å; F690-L832 HydrophobicContact CE1-CG 3.99Å; F690-L832 HydrophobicContact CZ-CD2 4.41Å; F690-L832 HydrophobicContact CZ-CG 4.15Å; I712-L832 HydrophobicContact CD1-CD2 3.79Å; I712-L832 HydrophobicContact CG2-CD2 4.1Å; Y728-L832 WeakPolarHBondContact O-CA 3.36Å; L729-L832 HydrophobicContact CD1-CB 4.37Å; I764-L832 HydrophobicContact CD1-CD1 3.76Å; I764-L832 HydrophobicContact CD1-CD2 4.21Å; L777-L832 HydrophobicContact CD1-CD1 4.46Å; L777-L832 HydrophobicContact CD1-CD2 3.81Å; L832-T845 CarbonylContact O-C 3.54Å; L832-T845 VanDerWaalsContact O-CA 3.26Å; L832-T845 WeakPolarHBondContact O-CA 3.12Å; L832-V846 HydrophobicContact CB-CG1 3.84Å; L832-V846 HydrophobicContact CD2-CG1 4.04Å; L832-V846 HydrophobicContact CG-CG1 4.19Å; L832-V846 PolarHBondContact N-O 3.48Å; L832-V846 PolarHBondContact O-N 3.22Å; L832-I848 HydrophobicContact CB-CD1 3.92Å; L832-I848 HydrophobicContact CD2-CD1 4.09Å
833	T	94	Very high	87.3	Confident	22 Å²	22	46.2 Å²	46.2	14%	0.135	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	133.4	-179	-52.6	0	0	0	0	110.7	F727 Y728 I843 A844 T845	F727-T833 CarbonylContact C-O 3.49Å; F727-T833 VanDerWaalsContact CA-O 3.22Å; F727-T833 WeakPolarHBondContact CA-O 3.45Å; Y728-T833 HydrophobicContact CD2-CG2 4.41Å; Y728-T833 PolarHBondContact N-O 3.27Å; Y728-T833 PolarHBondContact O-N 2.9Å; T833-I843 HydrophobicContact CG2-CB 4.47Å; T833-A844 CarbonylContact C-O 3.57Å; T833-A844 WeakPolarHBondContact CA-O 3.44Å; T833-T845 HydrophobicContact CG2-CG2 3.84Å; T833-T845 WeakPolarHBondContact OG1-CG2 3.21Å
834	A	94.7	Very high	89	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	132	166.7	0	0	0	0	0	109.4	P688 F690 V714 T726 F727 I843 A844	P688-A834 HydrophobicContact CB-CB 4.1Å; F690-A834 HydrophobicContact CE2-CB 4.11Å; F690-A834 HydrophobicContact CZ-CB 3.76Å; V714-A834 HydrophobicContact CG1-CB 4.15Å; T726-A834 CarbonylContact O-C 3.41Å; T726-A834 WeakPolarHBondContact O-CA 3.4Å; F727-A834 HydrophobicContact CD1-CB 3.82Å; F727-A834 HydrophobicContact CE1-CB 3.68Å; A834-I843 CarbonylContact O-C 3.43Å; A834-I843 VanDerWaalsContact O-CA 3.23Å; A834-I843 WeakPolarHBondContact O-CA 3.42Å; A834-A844 PolarHBondContact N-O 3.27Å; A834-A844 PolarHBondContact O-N 3.12Å
835	E	94.8	Very high	90.3	Very high	38 Å²	38	40.5 Å²	40.5	18%	0.178	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	127.1	-177.7	175.1	-174.6	176	0	0	110	L725 T726 Y728 K841 I843	L725-E835 CarbonylContact C-O 3.5Å; L725-E835 VanDerWaalsContact CA-O 3.28Å; L725-E835 WeakPolarHBondContact CA-O 3.23Å; T726-E835 PolarHBondContact N-O 2.9Å; T726-E835 PolarHBondContact O-N 2.88Å; Y728-E835 HydrophobicContact CE2-CB 4.34Å; Y728-E835 WeakPolarHBondContact CE2-OE2 3.45Å; Y728-E835 PolarHBondContact OH-OE2 2.73Å; E835-K841 WeakPolarHBondContact OE1-CD 3.18Å; E835-K841 IonicContact OE1-NZ 2.77Å; E835-K841 PolarHBondContact OE1-NZ 2.82Å; E835-I843 HydrophobicContact CB-CG2 3.79Å; E835-I843 HydrophobicContact CG-CG2 3.76Å
836	D	93.8	Very high	91.1	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	21%	0.211	C	C	.	.			trans	-76.2	178.5	173.1	77.9	20.2	0	0	0	112.8	N684 P688 N722 Q724 L725 G838 K841 R842	N684-D836 PolarHBondContact ND2-OD2 3.22Å; P688-D836 HydrophobicContact CG-CB 4.27Å; N722-D836 WeakPolarHBondContact O-CB 3.43Å; Q724-D836 CarbonylContact O-C 3.53Å; Q724-D836 WeakPolarHBondContact O-CA 3.36Å; L725-D836 HydrophobicContact CD2-CB 4.05Å; D836-G838 PolarHBondContact OD1-N 3.17Å; D836-K841 WeakPolarHBondContact OD1-CA 3.45Å; D836-R842 PolarHBondContact N-O 2.73Å; D836-R842 PolarHBondContact OD1-N 2.78Å; D836-R842 WeakPolarHBondContact OD2-CA 3.48Å; D836-R842 WeakPolarHBondContact OD2-CB 3.4Å; D836-R842 PolarHBondContact OD2-N 2.92Å
837	S	92.3	Very high	91.5	Very high	34 Å²	34	41.9 Å²	41.9	24%	0.238	22%	0.218	C	C	.	.			trans	-109.8	8.6	177.3	-56.5	0	0	0	0	113.8	I721 Q724	I721-S837 WeakPolarHBondContact CD1-O 3.48Å; I721-S837 WeakPolarHBondContact CG1-O 3.16Å; I721-S837 CarbonylContact O-C 3.41Å; I721-S837 WeakPolarHBondContact O-CA 3.46Å; I721-S837 VanDerWaalsContact O-CB 3.3Å; I721-S837 WeakPolarHBondContact O-CB 3.5Å; I721-S837 PolarHBondContact O-N 2.81Å; Q724-S837 PolarHBondContact O-N 3.19Å; Q724-S837 VanDerWaalsContact O-N 3.17Å; Q724-S837 PolarHBondContact O-OG 3.2Å
838	G	87.4	Confident	91.8	Very high	2 Å²	2	40.7 Å²	40.7	2%	0.021	21%	0.212	C	C	.	.	S	Bend	trans	-76.5	179.2	-173.7	0	0	0	0	0	115.1	I721 N722 D836 P840 K841	I721-G838 PolarHBondContact O-N 2.95Å; N722-G838 WeakPolarHBondContact OD1-CA 3.23Å; D836-G838 PolarHBondContact OD1-N 3.17Å; G838-P840 CarbonylContact O-C 3.59Å; G838-K841 WeakPolarHBondContact O-CA 3.18Å; G838-K841 WeakPolarHBondContact O-CG 3.24Å; G838-K841 PolarHBondContact O-N 3.11Å
839	I	86.2	Confident	91.9	Very high	153 Å²	153	41.7 Å²	41.7	79%	0.785	22%	0.216	S	C	*	.	S	Bend	trans	-129.1	112.9	173.5	-56.7	176.2	0	0	0	108.6
840	P	89.4	Confident	92.1	Very high	62 Å²	62	38.5 Å²	38.5	40%	0.403	20%	0.203	S	C	.	.	S	Bend	cis	-69.7	146.1	-2.7	30.8	-35	0	0	0	111.5	Y683 N684 G838	Y683-P840 WeakPolarHBondContact OH-CD 3.43Å; N684-P840 PolarHBondContact ND2-O 2.91Å; G838-P840 CarbonylContact O-C 3.59Å
841	K	91.3	Very high	92.1	Very high	128 Å²	128	41.1 Å²	41.1	56%	0.557	22%	0.216	S	C	*	.			trans	-63.4	137.7	174.6	-70.4	-178.1	162.9	-161.4	0	111.4	E835 D836 G838	E835-K841 WeakPolarHBondContact OE1-CD 3.18Å; E835-K841 IonicContact OE1-NZ 2.77Å; E835-K841 PolarHBondContact OE1-NZ 2.82Å; D836-K841 WeakPolarHBondContact OD1-CA 3.45Å; G838-K841 WeakPolarHBondContact O-CA 3.18Å; G838-K841 WeakPolarHBondContact O-CG 3.24Å; G838-K841 PolarHBondContact O-N 3.11Å
842	R	92.6	Very high	92	Very high	36 Å²	36	39 Å²	39	14%	0.136	21%	0.206	C	C	.	.			trans	-113.4	140.2	174.9	-57.3	174.3	164.4	-134.6	-3.2	110.9	N684 D685 E686 Y687 D836	N684-R842 PolarHBondContact O-NE 3.25Å; N684-R842 PolarHBondContact O-NH2 2.64Å; N684-R842 VanDerWaalsContact O-NH2 3.1Å; D685-R842 VanDerWaalsContact CA-NH2 3.28Å; D685-R842 VanDerWaalsContact O-CZ 3.3Å; D685-R842 PolarHBondContact O-NH1 3.29Å; D685-R842 PolarHBondContact O-NH2 2.91Å; E686-R842 WeakPolarHBondContact O-CD 3.22Å; Y687-R842 HydrophobicContact CD1-CB 3.59Å; Y687-R842 HydrophobicContact CD1-CG 4.18Å; Y687-R842 HydrophobicContact CE1-CB 3.78Å; Y687-R842 HydrophobicContact CE1-CG 3.99Å; Y687-R842 HydrophobicContact CG-CB 4.2Å; D836-R842 PolarHBondContact N-O 2.73Å; D836-R842 PolarHBondContact OD1-N 2.78Å; D836-R842 WeakPolarHBondContact OD2-CA 3.48Å; D836-R842 WeakPolarHBondContact OD2-CB 3.4Å; D836-R842 PolarHBondContact OD2-N 2.92Å
843	I	93.6	Very high	91.7	Very high	94 Å²	94	42.2 Å²	42.2	48%	0.482	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	144.9	-179.3	64	174	0	0	0	110	T833 A834 E835	T833-I843 HydrophobicContact CG2-CB 4.47Å; A834-I843 CarbonylContact O-C 3.43Å; A834-I843 VanDerWaalsContact O-CA 3.23Å; A834-I843 WeakPolarHBondContact O-CA 3.42Å; E835-I843 HydrophobicContact CB-CG2 3.79Å; E835-I843 HydrophobicContact CG-CG2 3.76Å
844	A	93.2	Very high	91.4	Very high	18 Å²	18	42.2 Å²	42.2	15%	0.149	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	142.2	168	0	0	0	0	0	109.9	P688 F690 T833 A834	P688-A844 HydrophobicContact CB-CB 4.29Å; P688-A844 WeakPolarHBondContact O-CB 2.97Å; F690-A844 HydrophobicContact CD2-CB 4.1Å; F690-A844 HydrophobicContact CE2-CB 3.79Å; T833-A844 CarbonylContact C-O 3.57Å; T833-A844 WeakPolarHBondContact CA-O 3.44Å; A834-A844 PolarHBondContact N-O 3.27Å; A834-A844 PolarHBondContact O-N 3.12Å
845	T	92.6	Very high	91.2	Very high	78 Å²	78	44.8 Å²	44.8	48%	0.479	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	139.3	179.1	58.5	0	0	0	0	110.8	L832 T833	L832-T845 CarbonylContact O-C 3.54Å; L832-T845 VanDerWaalsContact O-CA 3.26Å; L832-T845 WeakPolarHBondContact O-CA 3.12Å; T833-T845 HydrophobicContact CG2-CG2 3.84Å; T833-T845 WeakPolarHBondContact OG1-CG2 3.21Å
846	V	93.7	Very high	91	Very high	4 Å²	4	43.6 Å²	43.6	2%	0.024	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	144.2	177	72.5	0	0	0	0	110.9	F690 K692 K693 Y695 L832	F690-V846 HydrophobicContact CD1-CB 4.31Å; F690-V846 HydrophobicContact CD1-CG1 3.73Å; F690-V846 HydrophobicContact CD2-CB 3.97Å; F690-V846 HydrophobicContact CD2-CG1 4.18Å; F690-V846 HydrophobicContact CE1-CG1 3.69Å; F690-V846 HydrophobicContact CE2-CB 4.17Å; F690-V846 HydrophobicContact CE2-CG1 4.13Å; F690-V846 HydrophobicContact CG-CB 4.05Å; F690-V846 HydrophobicContact CG-CG1 4Å; F690-V846 HydrophobicContact CZ-CB 4.44Å; F690-V846 HydrophobicContact CZ-CG1 3.89Å; K692-V846 WeakPolarHBondContact O-CG2 3.38Å; K693-V846 VanDerWaalsContact O-CG2 3.27Å; K693-V846 WeakPolarHBondContact O-CG2 3.16Å; Y695-V846 HydrophobicContact CD2-CG1 4.11Å; Y695-V846 HydrophobicContact CD2-CG2 3.74Å; Y695-V846 HydrophobicContact CE2-CB 4.44Å; Y695-V846 HydrophobicContact CE2-CG1 3.97Å; Y695-V846 HydrophobicContact CE2-CG2 3.72Å; L832-V846 HydrophobicContact CB-CG1 3.84Å; L832-V846 HydrophobicContact CD2-CG1 4.04Å; L832-V846 HydrophobicContact CG-CG1 4.19Å; L832-V846 PolarHBondContact N-O 3.48Å; L832-V846 PolarHBondContact O-N 3.22Å
847	L	92.2	Very high	90.8	Very high	41 Å²	41	46.8 Å²	46.8	22%	0.215	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	136	176.1	-71.6	174.6	0	0	0	110.9	Y695 E732 L831 Y849	Y695-L847 PolarHBondContact N-O 3.17Å; E732-L847 HydrophobicContact CG-CD2 4.49Å; E732-L847 WeakPolarHBondContact OE2-CD2 3.3Å; L831-L847 HydrophobicContact CD1-CD2 3.8Å; L831-L847 HydrophobicContact CD1-CG 4.49Å; L847-Y849 HydrophobicContact CB-CE2 4.16Å; L847-Y849 HydrophobicContact CD1-CE2 4.44Å
848	I	93.1	Very high	90.7	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	115.4	173.9	-52.9	175.5	0	0	0	108.1	Y695 F697 I712 L729 L779 L830 L832 I850	Y695-I848 HydrophobicContact CD2-CG1 4.49Å; Y695-I848 CarbonylContact O-C 3.53Å; Y695-I848 WeakPolarHBondContact O-CA 3.3Å; F697-I848 HydrophobicContact CD2-CG2 3.7Å; F697-I848 HydrophobicContact CE2-CG2 3.76Å; I712-I848 HydrophobicContact CD1-CD1 3.66Å; I712-I848 HydrophobicContact CD1-CG1 4.37Å; L729-I848 HydrophobicContact CD1-CD1 4.33Å; L779-I848 HydrophobicContact CD2-CG2 4.26Å; L830-I848 HydrophobicContact CB-CB 4.3Å; L830-I848 PolarHBondContact N-O 2.98Å; L830-I848 PolarHBondContact O-N 3.38Å; L832-I848 HydrophobicContact CB-CD1 3.92Å; L832-I848 HydrophobicContact CD2-CD1 4.09Å; I848-I850 HydrophobicContact CG2-CD1 4.38Å; I848-I850 HydrophobicContact CG2-CG1 4Å
849	Y	91.2	Very high	90.9	Very high	48 Å²	48	50.7 Å²	50.7	19%	0.188	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	127.7	170.7	-67.4	-85.3	0	0	0	109.4	I694 Y695 E696 F697 H827 Y828 K829 L847	I694-Y849 HydrophobicContact CG2-CD2 3.54Å; I694-Y849 HydrophobicContact CG2-CE2 3.72Å; Y695-Y849 PolarHBondContact O-N 2.8Å; E696-Y849 WeakPolarHBondContact CA-O 3.09Å; E696-Y849 HydrophobicContact CG-CD2 4.42Å; F697-Y849 PolarHBondContact N-O 3.25Å; H827-Y849 AromaticContact CD2-CD1 3.51Å; H827-Y849 AromaticContact NE2-CD1 3.43Å; H827-Y849 WeakPolarHBondContact NE2-CD1 3.13Å; H827-Y849 AromaticContact NE2-CE1 3.46Å; H827-Y849 WeakPolarHBondContact NE2-CE1 3.38Å; Y828-Y849 WeakPolarHBondContact O-CA 3.39Å; K829-Y849 HydrophobicContact CD-CE1 3.97Å; K829-Y849 WeakPolarHBondContact CE-OH 3.31Å; K829-Y849 HydrophobicContact CG-CD1 4.19Å; K829-Y849 HydrophobicContact CG-CE1 3.66Å; L847-Y849 HydrophobicContact CB-CE2 4.16Å; L847-Y849 HydrophobicContact CD1-CE2 4.44Å
850	I	91.9	Very high	91.2	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	101.2	175	-53.1	176	0	0	0	108.2	F697 I699 I709 F762 L779 H827 Y828 L830 I848	F697-I850 CarbonylContact O-C 3.59Å; F697-I850 WeakPolarHBondContact O-CA 3.25Å; I699-I850 HydrophobicContact CB-CG2 4.45Å; I699-I850 HydrophobicContact CG2-CG2 3.72Å; I709-I850 HydrophobicContact CD1-CD1 4.21Å; F762-I850 HydrophobicContact CD1-CD1 3.68Å; F762-I850 HydrophobicContact CD2-CD1 3.87Å; F762-I850 HydrophobicContact CE1-CD1 3.51Å; F762-I850 HydrophobicContact CE1-CG2 4.06Å; F762-I850 HydrophobicContact CE2-CD1 3.69Å; F762-I850 HydrophobicContact CG-CD1 3.85Å; F762-I850 HydrophobicContact CZ-CB 4.19Å; F762-I850 HydrophobicContact CZ-CD1 3.52Å; F762-I850 HydrophobicContact CZ-CG1 4.44Å; F762-I850 HydrophobicContact CZ-CG2 3.88Å; L779-I850 HydrophobicContact CD2-CD1 4.08Å; H827-I850 VanDerWaalsContact CA-O 3.29Å; H827-I850 WeakPolarHBondContact CA-O 3.42Å; Y828-I850 PolarHBondContact N-O 2.05Å; Y828-I850 PolarHBondContact O-N 2.87Å; L830-I850 HydrophobicContact CD1-CD1 3.78Å; I848-I850 HydrophobicContact CG2-CD1 4.38Å; I848-I850 HydrophobicContact CG2-CG1 4Å
851	N	89.7	Confident	91.3	Very high	54 Å²	54	45.3 Å²	45.3	29%	0.289	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	126.7	-179.4	-66.4	-24.5	0	0	0	110.4	F697 S698 I699 H827	F697-N851 PolarHBondContact O-N 3.45Å; S698-N851 WeakPolarHBondContact CA-O 3.44Å; I699-N851 PolarHBondContact N-O 2.84Å; H827-N851 VanDerWaalsContact CB-OD1 3.23Å; H827-N851 WeakPolarHBondContact CB-OD1 3.48Å
852	V	89.9	Confident	91.2	Very high	5 Å²	5	40.1 Å²	40.1	3%	0.03	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	115	176.6	-172.9	0	0	0	0	109.5	I699 E701 I785 R787 L790 S826 Y828	I699-V852 HydrophobicContact CG2-CG2 4.44Å; I699-V852 CarbonylContact O-C 3.54Å; I699-V852 WeakPolarHBondContact O-CA 3.18Å; E701-V852 HydrophobicContact CB-CG1 3.71Å; I785-V852 HydrophobicContact CG2-CB 4.46Å; I785-V852 HydrophobicContact CG2-CG1 3.71Å; I785-V852 HydrophobicContact CG2-CG2 3.83Å; R787-V852 HydrophobicContact CB-CG1 3.82Å; R787-V852 WeakPolarHBondContact CD-O 3.18Å; R787-V852 HydrophobicContact CG-CB 4.37Å; R787-V852 HydrophobicContact CG-CG1 4.17Å; L790-V852 HydrophobicContact CD2-CB 4.48Å; L790-V852 HydrophobicContact CD2-CG2 3.76Å; S826-V852 WeakPolarHBondContact O-CB 3.04Å; S826-V852 PolarHBondContact O-N 2.88Å; Y828-V852 HydrophobicContact CD2-CG2 4.07Å; Y828-V852 HydrophobicContact CE2-CG2 3.89Å
853	I	88.6	Confident	91	Very high	69 Å²	69	43.2 Å²	43.2	35%	0.354	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	128.8	-179.9	-56	169.4	0	0	0	109.6	I699 E701	I699-I853 PolarHBondContact O-N 2.87Å; E701-I853 PolarHBondContact N-O 3.24Å
854	D	88	Confident	90.4	Very high	22 Å²	22	42.4 Å²	42.4	12%	0.118	23%	0.229	C	C	.	.			trans	-62.1	143.2	178.1	-167.8	92.4	0	0	0	113.2	E701 R787 E894 N897	E701-D854 WeakPolarHBondContact OE1-CA 3.46Å; R787-D854 IonicContact CZ-OD1 3.51Å; R787-D854 IonicContact NE-OD1 2.85Å; R787-D854 IonicContact NH1-OD1 3.88Å; R787-D854 PolarHBondContact NH1-OD1 3.09Å; D854-E894 HydrophobicContact CB-CB 4.06Å; D854-E894 WeakPolarHBondContact OD1-CB 3.37Å; D854-E894 PolarHBondContact OD1-N 3.25Å; D854-E894 PolarHBondContact OD2-N 2.69Å; D854-E894 VanDerWaalsContact OD2-N 3.12Å; D854-N897 PolarHBondContact OD2-ND2 2.92Å
855	V	89.8	Confident	89.9	Confident	54 Å²	54	41.6 Å²	41.6	33%	0.327	22%	0.222	S	C	.	.			trans	-133.3	137.5	176.7	174.6	0	0	0	0	108.1	E701 D857	E701-V855 HydrophobicContact CG-CB 3.89Å; E701-V855 HydrophobicContact CG-CG2 3.85Å; E701-V855 PolarHBondContact OE1-N 3.16Å; V855-D857 PolarHBondContact O-N 3.43Å
856	N	90.2	Very high	89.2	Confident	13 Å²	13	44 Å²	44	7%	0.07	23%	0.23	C	C	.	.	S	Bend	trans	-69.8	86.2	-178.3	-160.4	62.4	0	0	0	111.9	D893 N897 D975 P979	N856-D893 WeakPolarHBondContact CA-OD2 3.19Å; N856-D893 PolarHBondContact OD1-OD2 3.36Å; N856-N897 HydrophobicContact CB-CB 4.08Å; N856-N897 PolarHBondContact N-ND2 2.8Å; N856-N897 VanDerWaalsContact OD1-CA 3.25Å; N856-N897 WeakPolarHBondContact OD1-CA 3.13Å; N856-N897 WeakPolarHBondContact OD1-CB 3.41Å; N856-D975 PolarHBondContact ND2-OD2 2.63Å; N856-D975 PolarHBondContact OD1-OD2 2.85Å; N856-P979 PolarHBondContact ND2-O 2.55Å
857	D	89.7	Confident	88.5	Confident	67 Å²	67	50.5 Å²	50.5	36%	0.358	26%	0.26	S	S	.	.			trans	-122	-1.1	-178.9	76.7	-4.7	0	0	0	115	N702 V855 D893	N702-D857 PolarHBondContact ND2-OD2 2.72Å; V855-D857 PolarHBondContact O-N 3.43Å; D857-D893 PolarHBondContact N-OD2 3.14Å
858	E	89.7	Confident	87.8	Confident	82 Å²	82	52.5 Å²	52.5	38%	0.383	27%	0.272	S	S	.	.			trans	-117.1	148.7	171.9	-65.1	-78.8	-173.9	0	0	112.4	P892 D893 L981	E858-P892 HydrophobicContact CB-CB 4.25Å; E858-P892 HydrophobicContact CB-CG 3.89Å; E858-P892 HydrophobicContact CG-CB 4.31Å; E858-P892 HydrophobicContact CG-CG 4.19Å; E858-D893 WeakPolarHBondContact CB-OD1 3.32Å; E858-D893 PolarHBondContact N-OD2 2.87Å; E858-L981 WeakPolarHBondContact O-CD1 3.46Å
859	A	91.5	Very high	87.1	Confident	36 Å²	36	53.9 Å²	53.9	30%	0.298	28%	0.279	S	S	.	.			trans	-107.7	154.8	-177.5	0	0	0	0	0	113	D891 L981	A859-D891 VanDerWaalsContact C-OD2 3.24Å; A859-L981 HydrophobicContact CB-CB 3.7Å; A859-L981 HydrophobicContact CB-CD1 4.4Å
860	P	93.9	Very high	86.4	Confident	2 Å²	2	54 Å²	54	1%	0.013	28%	0.282	C	S	.	.			trans	-64.3	139.8	-177.2	-21.8	29.3	0	0	0	113.9	A889 D891 I900 A973 D975 S983	P860-A889 HydrophobicContact CB-CB 4.45Å; P860-D891 WeakPolarHBondContact CA-OD2 3.38Å; P860-D891 HydrophobicContact CB-CB 4.45Å; P860-D891 WeakPolarHBondContact CD-OD2 3.43Å; P860-D891 HydrophobicContact CG-CB 4.43Å; P860-D891 WeakPolarHBondContact CG-OD2 3.33Å; P860-I900 HydrophobicContact CB-CD1 4.23Å; P860-I900 HydrophobicContact CB-CG1 4.12Å; P860-I900 HydrophobicContact CG-CG1 4.28Å; P860-A973 HydrophobicContact CB-CB 4.33Å; P860-D975 HydrophobicContact CG-CB 4.12Å; P860-S983 WeakPolarHBondContact O-CB 3.35Å; P860-S983 PolarHBondContact O-OG 2.79Å
861	I	91.3	Very high	85.8	Confident	100 Å²	100	55.9 Å²	55.9	51%	0.513	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	122.3	-176.9	-53.3	174.6	0	0	0	111.7	M863 A889 N890	I861-M863 PolarHBondContact O-N 3.35Å; I861-A889 CarbonylContact O-C 3.36Å; I861-A889 WeakPolarHBondContact O-CA 3.32Å; I861-A889 WeakPolarHBondContact O-CB 3.47Å; I861-N890 PolarHBondContact N-O 2.77Å; I861-N890 PolarHBondContact O-N 3Å
862	F	88.9	Confident	85.5	Confident	19 Å²	19	55.7 Å²	55.7	8%	0.083	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	119.2	177.9	-78.9	-85.4	0	0	0	113.6	F887 K888 A889 Y902 V971 A973 S983 R985	F862-F887 HydrophobicContact CE1-CB 4.41Å; F862-K888 CarbonylContact C-O 3.57Å; F862-A889 HydrophobicContact CD1-CB 4.25Å; F862-A889 HydrophobicContact CG-CB 4.36Å; F862-Y902 HydrophobicContact CE1-CD1 4.42Å; F862-Y902 HydrophobicContact CE1-CE1 4.18Å; F862-V971 HydrophobicContact CE1-CG1 3.9Å; F862-V971 HydrophobicContact CZ-CG1 3.89Å; F862-A973 HydrophobicContact CE1-CB 4.19Å; F862-A973 HydrophobicContact CE2-CB 3.83Å; F862-A973 HydrophobicContact CZ-CB 3.57Å; F862-S983 WeakPolarHBondContact CD2-OG 3.48Å; F862-S983 WeakPolarHBondContact CE2-OG 3.34Å; F862-R985 VanDerWaalsContact CB-NH1 3.28Å; F862-R985 HydrophobicContact CD1-CB 4.43Å; F862-R985 HydrophobicContact CD2-CB 4.08Å; F862-R985 HydrophobicContact CE1-CB 4.28Å; F862-R985 HydrophobicContact CE2-CB 3.92Å; F862-R985 HydrophobicContact CG-CB 4.34Å; F862-R985 HydrophobicContact CZ-CB 4.02Å; F862-R985 PolarHBondContact O-NH1 2.79Å
863	M	88.2	Confident	84.9	Confident	102 Å²	102	58.1 Å²	58.1	50%	0.502	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-23.3	174.6	-64.1	-58.4	-47.1	0	0	114	I861 I866 K888 N890	I861-M863 PolarHBondContact O-N 3.35Å; M863-I866 WeakPolarHBondContact O-CG1 3.26Å; M863-K888 WeakPolarHBondContact CA-O 3.18Å; M863-K888 HydrophobicContact CB-CG 4.37Å; M863-K888 PolarHBondContact N-O 3.25Å; M863-N890 HydrophobicContact CG-CB 4.39Å
864	N	82.2	Confident	84.4	Confident	76 Å²	76	55 Å²	55	41%	0.406	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	127.3	175.8	-173.9	50.8	0	0	0	111.5	K886 F887 K888	N864-K886 PolarHBondContact ND2-O 2.77Å; N864-F887 WeakPolarHBondContact O-CA 3.34Å; N864-K888 HydrophobicContact CB-CB 4.14Å; N864-K888 PolarHBondContact N-O 3.29Å; N864-K888 PolarHBondContact O-N 3.06Å
865	P	82.6	Confident	83.8	Confident	2 Å²	2	55 Å²	55	1%	0.013	29%	0.288	C	S	.	.	S	Bend	cis	-64.1	161.2	-11.8	30.4	-32.4	0	0	0	110.7	I870 I885 F887 R985	P865-I870 HydrophobicContact CB-CD1 3.39Å; P865-I870 HydrophobicContact CB-CG1 4.43Å; P865-I870 HydrophobicContact CG-CD1 4.27Å; P865-I885 HydrophobicContact CG-CD1 4.45Å; P865-F887 HydrophobicContact CG-CE1 4.48Å; P865-R985 HydrophobicContact CG-CG 4.48Å; P865-R985 PolarHBondContact O-NE 2.84Å; P865-R985 PolarHBondContact O-NH1 2.89Å
866	I	77.8	Confident	83.2	Confident	127 Å²	127	52.6 Å²	52.6	65%	0.651	27%	0.273	S	S	*	.			trans	-92.6	-13.5	177.6	-56.4	170	0	0	0	111.2	M863 R985	M863-I866 WeakPolarHBondContact O-CG1 3.26Å; I866-R985 VanDerWaalsContact O-CZ 3.28Å; I866-R985 PolarHBondContact O-NH1 3.24Å; I866-R985 PolarHBondContact O-NH2 3.2Å
867	Q	77.4	Confident	82.3	Confident	141 Å²	141	56.7 Å²	56.7	66%	0.659	30%	0.295	S	S	*	.	S	Bend	trans	-119.5	156.7	-178.7	-64.6	176	-3.7	0	0	110.7	I870 R985	Q867-I870 HydrophobicContact CB-CD1 4.46Å; Q867-R985 PolarHBondContact O-NE 2.89Å
868	D	78.1	Confident	81.6	Confident	84 Å²	84	56 Å²	56	45%	0.449	29%	0.29	S	S	.	.	S	Bend	trans	-92.7	158.1	178	-73.8	11.3	0	0	0	111.6	I870 R985	D868-I870 VanDerWaalsContact C-N 3.34Å; D868-I870 PolarHBondContact O-N 3.33Å; D868-R985 WeakPolarHBondContact OD1-CG 3.18Å; D868-R985 IonicContact OD1-CZ 2.74Å; D868-R985 IonicContact OD1-NE 2.71Å; D868-R985 PolarHBondContact OD1-NE 2.84Å; D868-R985 IonicContact OD1-NH2 3.66Å; D868-R985 PolarHBondContact OD1-NH2 3.19Å
869	D	78.2	Confident	80.9	Confident	28 Å²	28	57 Å²	57	15%	0.15	30%	0.297	C	S	.	.	S	Bend	trans	58.7	34.8	177.1	-67.5	-30.9	0	0	0	115.3	T921 R968 Y986	D869-T921 WeakPolarHBondContact CB-OG1 3.48Å; D869-T921 PolarHBondContact O-OG1 2.99Å; D869-R968 VanDerWaalsContact CG-NH2 3.27Å; D869-R968 IonicContact OD1-CZ 3.56Å; D869-R968 VanDerWaalsContact OD1-CZ 3.27Å; D869-R968 IonicContact OD1-NE 3.49Å; D869-R968 PolarHBondContact OD1-NE 2.82Å; D869-R968 IonicContact OD1-NH2 3.99Å; D869-R968 PolarHBondContact OD1-NH2 2.78Å; D869-R968 IonicContact OD2-CZ 3.08Å; D869-R968 IonicContact OD2-NE 3.09Å; D869-R968 IonicContact OD2-NH2 3.9Å; D869-R968 PolarHBondContact OD2-NH2 2.8Å; D869-Y986 PolarHBondContact N-O 3.07Å; D869-Y986 WeakPolarHBondContact OD1-CB 3.43Å
870	I	77.6	Confident	80.2	Confident	51 Å²	51	58.2 Å²	58.2	26%	0.262	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	133.6	170.2	-62.3	-173.4	0	0	0	110.2	P865 Q867 D868 Y872 C988	P865-I870 HydrophobicContact CB-CD1 3.39Å; P865-I870 HydrophobicContact CB-CG1 4.43Å; P865-I870 HydrophobicContact CG-CD1 4.27Å; Q867-I870 HydrophobicContact CB-CD1 4.46Å; D868-I870 VanDerWaalsContact C-N 3.34Å; D868-I870 PolarHBondContact O-N 3.33Å; I870-Y872 HydrophobicContact CB-CE2 3.92Å; I870-Y872 HydrophobicContact CG2-CD2 4.17Å; I870-Y872 HydrophobicContact CG2-CE1 4.38Å; I870-Y872 HydrophobicContact CG2-CE2 3.49Å; I870-Y872 VanDerWaalsContact CG2-CE2 3.49Å; I870-C988 PolarHBondContact O-N 3.26Å
871	I	78.3	Confident	79.4	Confident	39 Å²	39	60.6 Å²	60.6	20%	0.2	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	122.4	178.3	-61.6	154.5	0	0	0	110.1	L925 C988 H990 T1007	I871-L925 HydrophobicContact CD1-CD1 3.81Å; I871-L925 HydrophobicContact CG1-CD1 4.23Å; I871-L925 HydrophobicContact CG2-CD1 4.14Å; I871-C988 WeakPolarHBondContact CA-O 3.08Å; I871-C988 HydrophobicContact CB-CB 4.32Å; I871-C988 HydrophobicContact CG1-CB 3.77Å; I871-H990 HydrophobicContact CG2-CB 4.41Å; I871-T1007 HydrophobicContact CD1-CG2 3.96Å
872	Y	83	Confident	78.8	Confident	50 Å²	50	60.2 Å²	60.2	20%	0.196	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	135.1	170	-66.5	-84.4	0	0	0	109.2	I870 I884 I885 F987 C988 L989 H990	I870-Y872 HydrophobicContact CB-CE2 3.92Å; I870-Y872 HydrophobicContact CG2-CD2 4.17Å; I870-Y872 HydrophobicContact CG2-CE1 4.38Å; I870-Y872 HydrophobicContact CG2-CE2 3.49Å; I870-Y872 VanDerWaalsContact CG2-CE2 3.49Å; Y872-I884 HydrophobicContact CG-CG2 4.47Å; Y872-I885 HydrophobicContact CD1-CB 4.45Å; Y872-I885 HydrophobicContact CE1-CB 4.12Å; Y872-I885 HydrophobicContact CE1-CD1 4.05Å; Y872-I885 HydrophobicContact CE1-CG1 3.77Å; Y872-I885 HydrophobicContact CE2-CD1 3.6Å; Y872-I885 HydrophobicContact CE2-CG1 4.18Å; Y872-I885 WeakPolarHBondContact OH-CD1 2.91Å; Y872-F987 HydrophobicContact CD2-CB 4.46Å; Y872-F987 HydrophobicContact CD2-CD2 4Å; Y872-F987 HydrophobicContact CE2-CB 4.37Å; Y872-C988 PolarHBondContact N-O 3.44Å; Y872-L989 CarbonylContact O-C 3.43Å; Y872-L989 WeakPolarHBondContact O-CA 2.99Å; Y872-H990 PolarHBondContact O-N 3.04Å
873	T	77.7	Confident	78.6	Confident	56 Å²	56	61.9 Å²	61.9	34%	0.344	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	132.7	-179.5	-55	0	0	0	0	110	H990 M992 I1003	T873-H990 CarbonylContact C-O 3.52Å; T873-H990 VanDerWaalsContact CA-O 3.27Å; T873-H990 WeakPolarHBondContact CA-O 3.46Å; T873-H990 HydrophobicContact CG2-CB 4.43Å; T873-M992 HydrophobicContact CG2-CG 3.61Å; T873-M992 HydrophobicContact CG2-SD 3.43Å; T873-M992 WeakPolarHBondContact CG2-SD 3.37Å; T873-I1003 HydrophobicContact CG2-CD1 4.26Å
874	I	78.6	Confident	78.4	Confident	5 Å²	5	57.9 Å²	57.9	3%	0.026	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	144.2	178.2	82.3	-178.6	0	0	0	109.9	E878 Y882 I884 L954 L958 L989 H990 L991 M992	I874-E878 HydrophobicContact CB-CG 4.35Å; I874-Y882 HydrophobicContact CG2-CE1 4.34Å; I874-I884 HydrophobicContact CD1-CD1 4.33Å; I874-I884 HydrophobicContact CG2-CG1 4.23Å; I874-I884 HydrophobicContact CG2-CG2 4.34Å; I874-L954 HydrophobicContact CD1-CD1 4.27Å; I874-L958 HydrophobicContact CD1-CD1 3.62Å; I874-L958 HydrophobicContact CG1-CD1 3.99Å; I874-L989 HydrophobicContact CD1-CD1 4.46Å; I874-L989 HydrophobicContact CD1-CD2 4.49Å; I874-L989 HydrophobicContact CG2-CD1 3.61Å; I874-H990 PolarHBondContact N-O 3.45Å; I874-L991 HydrophobicContact CD1-CD2 3.41Å; I874-L991 VanDerWaalsContact CD1-CD2 3.41Å; I874-L991 HydrophobicContact CG1-CD2 3.31Å; I874-L991 CarbonylContact O-C 3.54Å; I874-L991 WeakPolarHBondContact O-CA 3.41Å; I874-M992 PolarHBondContact O-N 3.28Å
875	S	74.7	Confident	78.6	Confident	22 Å²	22	54.9 Å²	54.9	15%	0.154	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	144.8	173.5	-179	0	0	0	0	110.3	N877 E878 M992	S875-N877 PolarHBondContact O-N 2.73Å; S875-N877 PolarHBondContact OG-N 3.13Å; S875-E878 WeakPolarHBondContact O-CB 3.46Å; S875-E878 WeakPolarHBondContact O-CG 3.14Å; S875-E878 PolarHBondContact O-N 3.13Å; S875-M992 CarbonylContact C-O 3.55Å; S875-M992 WeakPolarHBondContact CA-O 3.45Å
876	M	78.3	Confident	78.9	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.01	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-18.3	169.5	-67.6	-65.3	-69	0	0	111.9	Q957 L958 P959 L962 L991 M992 D993	M876-Q957 PolarHBondContact O-NE2 2.83Å; M876-Q957 VanDerWaalsContact O-NE2 3.11Å; M876-L958 HydrophobicContact CE-CB 3.86Å; M876-L958 HydrophobicContact SD-CB 3.94Å; M876-L958 HydrophobicContact SD-CD1 4.11Å; M876-P959 WeakPolarHBondContact CE-O 3.21Å; M876-L962 HydrophobicContact CE-CB 4.14Å; M876-L962 HydrophobicContact SD-CB 4.48Å; M876-L991 HydrophobicContact SD-CB 3.71Å; M876-L991 HydrophobicContact SD-CD1 4.18Å; M876-M992 WeakPolarHBondContact CG-O 3.26Å; M876-M992 PolarHBondContact N-O 2.91Å; M876-D993 WeakPolarHBondContact CG-OD1 3.13Å
877	N	70.9	Confident	79.5	Confident	100 Å²	100	54.3 Å²	54.3	54%	0.535	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	1.1	176.6	-59.9	-21.8	0	0	0	113.3	S875 I879	S875-N877 PolarHBondContact O-N 2.73Å; S875-N877 PolarHBondContact OG-N 3.13Å; N877-I879 PolarHBondContact O-N 3.11Å
878	E	75.2	Confident	80.2	Confident	51 Å²	51	53.7 Å²	53.7	24%	0.238	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-63.1	136	173.4	-68.4	-53.9	156.3	0	0	110.1	I874 S875 Y882 L954 Q957	I874-E878 HydrophobicContact CB-CG 4.35Å; S875-E878 WeakPolarHBondContact O-CB 3.46Å; S875-E878 WeakPolarHBondContact O-CG 3.14Å; S875-E878 PolarHBondContact O-N 3.13Å; E878-Y882 HydrophobicContact CB-CG 4.19Å; E878-Y882 HydrophobicContact CG-CD1 4.18Å; E878-Y882 HydrophobicContact CG-CD2 4.22Å; E878-Y882 HydrophobicContact CG-CE1 4.45Å; E878-Y882 HydrophobicContact CG-CE2 4.48Å; E878-Y882 HydrophobicContact CG-CG 4.05Å; E878-Y882 WeakPolarHBondContact OE2-CD2 3.45Å; E878-L954 HydrophobicContact CB-CD2 4.04Å; E878-L954 VanDerWaalsContact O-CD2 3.31Å; E878-L954 WeakPolarHBondContact O-CD2 3.16Å; E878-Q957 PolarHBondContact O-NE2 2.9Å
879	I	74.9	Confident	80.9	Confident	103 Å²	103	50 Å²	50	53%	0.528	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-80.8	149.7	179.4	55.8	170.8	0	0	0	110.6	N877 G881 Y882	N877-I879 PolarHBondContact O-N 3.11Å; I879-G881 PolarHBondContact O-N 3.45Å; I879-Y882 WeakPolarHBondContact O-CB 3.24Å; I879-Y882 PolarHBondContact O-N 3.13Å; I879-Y882 VanDerWaalsContact O-N 3.08Å
880	P	76.8	Confident	81.5	Confident	62 Å²	62	53.4 Å²	53.4	40%	0.403	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	129.3	165.6	-26.1	34.7	0	0	0	110.5	L954	P880-L954 CarbonylContact C-O 3.53Å; P880-L954 WeakPolarHBondContact CA-O 3.22Å
881	G	76.3	Confident	82.1	Confident	53 Å²	53	51.4 Å²	51.4	55%	0.546	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	106.9	-13.2	-172.6	0	0	0	0	0	114.3	I879 Q883 F953 L954	I879-G881 PolarHBondContact O-N 3.45Å; G881-Q883 PolarHBondContact O-N 2.87Å; G881-F953 WeakPolarHBondContact O-CD1 2.89Å; G881-L954 PolarHBondContact N-O 2.84Å
882	Y	79.8	Confident	82.6	Confident	91 Å²	91	51.8 Å²	51.8	36%	0.357	27%	0.274	S	S	.	.			trans	-60.1	127.4	172.9	-177.4	-96.1	0	0	0	111.1	I874 E878 I879 I884 F953 L954	I874-Y882 HydrophobicContact CG2-CE1 4.34Å; E878-Y882 HydrophobicContact CB-CG 4.19Å; E878-Y882 HydrophobicContact CG-CD1 4.18Å; E878-Y882 HydrophobicContact CG-CD2 4.22Å; E878-Y882 HydrophobicContact CG-CE1 4.45Å; E878-Y882 HydrophobicContact CG-CE2 4.48Å; E878-Y882 HydrophobicContact CG-CG 4.05Å; E878-Y882 WeakPolarHBondContact OE2-CD2 3.45Å; I879-Y882 WeakPolarHBondContact O-CB 3.24Å; I879-Y882 PolarHBondContact O-N 3.13Å; I879-Y882 VanDerWaalsContact O-N 3.08Å; Y882-I884 HydrophobicContact CD1-CG1 4.16Å; Y882-I884 HydrophobicContact CE1-CG1 4.45Å; Y882-F953 CarbonylContact O-C 2.91Å; Y882-F953 WeakPolarHBondContact O-CA 3.22Å; Y882-L954 PolarHBondContact O-N 2.85Å
883	Q	83.6	Confident	82.9	Confident	55 Å²	55	49.9 Å²	49.9	26%	0.257	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	116.8	178.4	-168.3	-174.8	-39.3	0	0	110.7	G881 L952 F953	G881-Q883 PolarHBondContact O-N 2.87Å; Q883-L952 CarbonylContact C-O 3.48Å; Q883-F953 HydrophobicContact CB-CD1 3.68Å; Q883-F953 HydrophobicContact CB-CE1 3.53Å; Q883-F953 HydrophobicContact CB-CZ 4.41Å; Q883-F953 HydrophobicContact CG-CD1 3.96Å; Q883-F953 HydrophobicContact CG-CE1 3.62Å; Q883-F953 HydrophobicContact CG-CZ 4.03Å
884	I	85.2	Confident	83.4	Confident	18 Å²	18	50.5 Å²	50.5	9%	0.092	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	-52.6	-177.1	-58.3	172.8	0	0	0	111.1	Y872 I874 Y882 L943 L952 L989	Y872-I884 HydrophobicContact CG-CG2 4.47Å; I874-I884 HydrophobicContact CD1-CD1 4.33Å; I874-I884 HydrophobicContact CG2-CG1 4.23Å; I874-I884 HydrophobicContact CG2-CG2 4.34Å; Y882-I884 HydrophobicContact CD1-CG1 4.16Å; Y882-I884 HydrophobicContact CE1-CG1 4.45Å; I884-L943 HydrophobicContact CD1-CD2 3.35Å; I884-L952 HydrophobicContact CB-CD2 4.26Å; I884-L952 HydrophobicContact CB-CG 4.38Å; I884-L952 HydrophobicContact CD1-CD2 4.21Å; I884-L952 HydrophobicContact CD1-CG 4.24Å; I884-L952 HydrophobicContact CG2-CD2 4.27Å; I884-L952 PolarHBondContact N-O 3.43Å; I884-L989 HydrophobicContact CD1-CD1 4.31Å; I884-L989 HydrophobicContact CD1-CD2 3.87Å; I884-L989 HydrophobicContact CG2-CD1 3.68Å
885	I	86.7	Confident	83.7	Confident	12 Å²	12	52.5 Å²	52.5	6%	0.062	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	158	-177.7	-163.7	-157.7	0	0	0	110.1	P865 Y872 F887 S951 L952	P865-I885 HydrophobicContact CG-CD1 4.45Å; Y872-I885 HydrophobicContact CD1-CB 4.45Å; Y872-I885 HydrophobicContact CE1-CB 4.12Å; Y872-I885 HydrophobicContact CE1-CD1 4.05Å; Y872-I885 HydrophobicContact CE1-CG1 3.77Å; Y872-I885 HydrophobicContact CE2-CD1 3.6Å; Y872-I885 HydrophobicContact CE2-CG1 4.18Å; Y872-I885 WeakPolarHBondContact OH-CD1 2.91Å; I885-F887 HydrophobicContact CD1-CD1 4.02Å; I885-F887 HydrophobicContact CD1-CE1 3.62Å; I885-F887 HydrophobicContact CD1-CZ 4Å; I885-F887 HydrophobicContact CG2-CD2 4.26Å; I885-F887 HydrophobicContact CG2-CE1 4.19Å; I885-F887 HydrophobicContact CG2-CE2 3.59Å; I885-F887 HydrophobicContact CG2-CZ 3.54Å; I885-S951 CarbonylContact O-C 3.58Å; I885-S951 WeakPolarHBondContact O-CA 3.22Å; I885-L952 HydrophobicContact CG2-CB 3.87Å; I885-L952 HydrophobicContact CG2-CD2 4.11Å; I885-L952 PolarHBondContact O-N 2.78Å
886	K	88.9	Confident	84.3	Confident	115 Å²	115	56.6 Å²	56.6	50%	0.5	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	109	167.3	-174	174.3	-178.5	178.8	0	111.2	N864 T949 G950	N864-K886 PolarHBondContact ND2-O 2.77Å; K886-T949 VanDerWaalsContact CE-O 3.26Å; K886-T949 WeakPolarHBondContact CE-O 3.13Å; K886-G950 CarbonylContact C-O 3.58Å; K886-G950 WeakPolarHBondContact CA-O 3.43Å
887	F	90.3	Very high	84.8	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.009	32%	0.315	C	S	.	.			trans	-70.8	145.7	171.5	-59.1	-71.6	0	0	0	111	F862 N864 P865 I885 Y902 L945 G950 L952 V971 F987	F862-F887 HydrophobicContact CE1-CB 4.41Å; N864-F887 WeakPolarHBondContact O-CA 3.34Å; P865-F887 HydrophobicContact CG-CE1 4.48Å; I885-F887 HydrophobicContact CD1-CD1 4.02Å; I885-F887 HydrophobicContact CD1-CE1 3.62Å; I885-F887 HydrophobicContact CD1-CZ 4Å; I885-F887 HydrophobicContact CG2-CD2 4.26Å; I885-F887 HydrophobicContact CG2-CE1 4.19Å; I885-F887 HydrophobicContact CG2-CE2 3.59Å; I885-F887 HydrophobicContact CG2-CZ 3.54Å; F887-Y902 HydrophobicContact CB-CD1 4.32Å; F887-Y902 HydrophobicContact CB-CE1 4.16Å; F887-L945 HydrophobicContact CD2-CD1 4.02Å; F887-L945 HydrophobicContact CE2-CD1 4.29Å; F887-G950 VanDerWaalsContact CD2-O 3.25Å; F887-G950 WeakPolarHBondContact CD2-O 3.03Å; F887-G950 PolarHBondContact N-O 2.79Å; F887-L952 HydrophobicContact CE2-CB 4.33Å; F887-V971 HydrophobicContact CD1-CG1 3.74Å; F887-V971 HydrophobicContact CD2-CB 4.38Å; F887-V971 HydrophobicContact CD2-CG1 4.38Å; F887-V971 HydrophobicContact CD2-CG2 3.91Å; F887-V971 HydrophobicContact CE1-CB 4.37Å; F887-V971 HydrophobicContact CE1-CG1 3.62Å; F887-V971 HydrophobicContact CE2-CB 4.17Å; F887-V971 HydrophobicContact CE2-CG1 4.28Å; F887-V971 HydrophobicContact CE2-CG2 4.13Å; F887-V971 HydrophobicContact CG-CG1 4.13Å; F887-V971 HydrophobicContact CG-CG2 4.18Å; F887-V971 HydrophobicContact CZ-CB 4.18Å; F887-V971 HydrophobicContact CZ-CG1 3.92Å; F887-F987 HydrophobicContact CE1-CD1 4.24Å; F887-F987 HydrophobicContact CE2-CE1 4.29Å; F887-F987 AromaticContact CZ-CD1 3.72Å; F887-F987 HydrophobicContact CZ-CD1 3.72Å; F887-F987 AromaticContact CZ-CE1 3.6Å; F887-F987 HydrophobicContact CZ-CE1 3.6Å; F887-F987 HydrophobicContact CZ-CG 4.3Å; F887-F987 HydrophobicContact CZ-CZ 4.1Å
888	K	92	Very high	85.7	Confident	128 Å²	128	55.2 Å²	55.2	56%	0.557	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.4	124.7	173.9	-173.3	179	179.9	-176.6	0	109.6	F862 M863 N864	F862-K888 CarbonylContact C-O 3.57Å; M863-K888 WeakPolarHBondContact CA-O 3.18Å; M863-K888 HydrophobicContact CB-CG 4.37Å; M863-K888 PolarHBondContact N-O 3.25Å; N864-K888 HydrophobicContact CB-CB 4.14Å; N864-K888 PolarHBondContact N-O 3.29Å; N864-K888 PolarHBondContact O-N 3.06Å
889	A	91.9	Very high	86.4	Confident	8 Å²	8	58.1 Å²	58.1	7%	0.066	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	162	168.2	0	0	0	0	0	110.6	P860 I861 F862 I900 Y902 A973	P860-A889 HydrophobicContact CB-CB 4.45Å; I861-A889 CarbonylContact O-C 3.36Å; I861-A889 WeakPolarHBondContact O-CA 3.32Å; I861-A889 WeakPolarHBondContact O-CB 3.47Å; F862-A889 HydrophobicContact CD1-CB 4.25Å; F862-A889 HydrophobicContact CG-CB 4.36Å; A889-I900 HydrophobicContact CB-CD1 3.94Å; A889-I900 HydrophobicContact CB-CG2 4.49Å; A889-I900 WeakPolarHBondContact O-CD1 3.36Å; A889-Y902 HydrophobicContact CB-CE1 4.16Å; A889-Y902 PolarHBondContact N-OH 2.95Å; A889-A973 HydrophobicContact CB-CB 3.97Å
890	N	91	Very high	87.2	Confident	98 Å²	98	54.7 Å²	54.7	52%	0.524	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	140.5	177.4	-167.8	73.2	0	0	0	110.3	I861 M863	I861-N890 PolarHBondContact N-O 2.77Å; I861-N890 PolarHBondContact O-N 3Å; M863-N890 HydrophobicContact CG-CB 4.39Å
891	D	89.9	Confident	88	Confident	10 Å²	10	56.1 Å²	56.1	5%	0.053	30%	0.298	C	S	.	.			trans	-120.5	132.5	-179.2	-163.3	-65	0	0	0	109.5	A859 P860 D893 I900	A859-D891 VanDerWaalsContact C-OD2 3.24Å; P860-D891 WeakPolarHBondContact CA-OD2 3.38Å; P860-D891 HydrophobicContact CB-CB 4.45Å; P860-D891 WeakPolarHBondContact CD-OD2 3.43Å; P860-D891 HydrophobicContact CG-CB 4.43Å; P860-D891 WeakPolarHBondContact CG-OD2 3.33Å; D891-D893 PolarHBondContact OD1-N 3.09Å; D891-D893 VanDerWaalsContact OD1-N 3.08Å; D891-I900 HydrophobicContact CB-CD1 4.35Å; D891-I900 HydrophobicContact CB-CG1 4.32Å
892	P	88.7	Confident	88.9	Confident	47 Å²	47	54.1 Å²	54.1	31%	0.305	27%	0.274	S	S	.	.	S	Bend	trans	-72.1	-22.1	-178.3	-17.8	32.7	0	0	0	116.5	E858	E858-P892 HydrophobicContact CB-CB 4.25Å; E858-P892 HydrophobicContact CB-CG 3.89Å; E858-P892 HydrophobicContact CG-CB 4.31Å; E858-P892 HydrophobicContact CG-CG 4.19Å
893	D	90.3	Very high	89.5	Confident	9 Å²	9	51.8 Å²	51.8	5%	0.048	27%	0.271	C	S	.	.	S	Bend	trans	-72.6	-177.1	-172.6	-65.3	-11.9	0	0	0	111.7	N856 D857 E858 D891 N897 S898	N856-D893 WeakPolarHBondContact CA-OD2 3.19Å; N856-D893 PolarHBondContact OD1-OD2 3.36Å; D857-D893 PolarHBondContact N-OD2 3.14Å; E858-D893 WeakPolarHBondContact CB-OD1 3.32Å; E858-D893 PolarHBondContact N-OD2 2.87Å; D891-D893 PolarHBondContact OD1-N 3.09Å; D891-D893 VanDerWaalsContact OD1-N 3.08Å; D893-N897 HydrophobicContact CB-CB 3.45Å; D893-N897 VanDerWaalsContact CB-CB 3.45Å; D893-S898 WeakPolarHBondContact O-CB 3.45Å
894	E	87.2	Confident	89.7	Confident	69 Å²	69	50.7 Å²	50.7	32%	0.322	27%	0.267	S	S	.	.			trans	-105.4	147.1	179.5	-172.8	172.4	-152.6	0	0	114.2	R787 D854 L896 N897	R787-E894 IonicContact CZ-OE2 2.9Å; R787-E894 IonicContact NE-OE2 2.99Å; R787-E894 IonicContact NH2-OE1 2.79Å; R787-E894 IonicContact NH2-OE2 3.74Å; R787-E894 PolarHBondContact NH2-OE2 2.83Å; D854-E894 HydrophobicContact CB-CB 4.06Å; D854-E894 WeakPolarHBondContact OD1-CB 3.37Å; D854-E894 PolarHBondContact OD1-N 3.25Å; D854-E894 PolarHBondContact OD2-N 2.69Å; D854-E894 VanDerWaalsContact OD2-N 3.12Å; E894-L896 PolarHBondContact O-N 2.84Å; E894-N897 VanDerWaalsContact O-CB 3.31Å; E894-N897 WeakPolarHBondContact O-CB 3.46Å; E894-N897 PolarHBondContact O-N 2.82Å; E894-N897 VanDerWaalsContact O-N 3.12Å
895	G	86	Confident	89.5	Confident	48 Å²	48	54 Å²	54	50%	0.495	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.3	-118.1	164.3	0	0	0	0	0	113.7	S898 K899	G895-S898 PolarHBondContact O-OG 3Å; G895-K899 WeakPolarHBondContact O-CB 3.43Å; G895-K899 PolarHBondContact O-N 2.97Å
896	L	86.9	Confident	88.7	Confident	108 Å²	108	55 Å²	55	57%	0.565	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-30.6	177.6	-71.3	175.6	0	0	0	111.9	E894 S898 K899 M976 G977	E894-L896 PolarHBondContact O-N 2.84Å; L896-S898 PolarHBondContact O-N 3.37Å; L896-K899 HydrophobicContact CD2-CD 4.22Å; L896-K899 PolarHBondContact O-N 3.21Å; L896-M976 HydrophobicContact CB-CB 4.37Å; L896-M976 HydrophobicContact CD2-CB 4.33Å; L896-M976 CarbonylContact O-C 3.54Å; L896-M976 VanDerWaalsContact O-C 3.29Å; L896-M976 VanDerWaalsContact O-CA 3.32Å; L896-M976 WeakPolarHBondContact O-CA 3.29Å; L896-M976 VanDerWaalsContact O-CB 3.32Å; L896-M976 WeakPolarHBondContact O-CB 3.37Å; L896-M976 PolarHBondContact O-N 3.01Å; L896-M976 VanDerWaalsContact O-N 3.08Å; L896-G977 PolarHBondContact O-N 3.49Å
897	N	88.8	Confident	87.5	Confident	28 Å²	28	51.5 Å²	51.5	15%	0.15	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-33.5	174.6	-59	-15.5	0	0	0	110	D854 N856 D893 E894 K899 D975 G977	D854-N897 PolarHBondContact OD2-ND2 2.92Å; N856-N897 HydrophobicContact CB-CB 4.08Å; N856-N897 PolarHBondContact N-ND2 2.8Å; N856-N897 VanDerWaalsContact OD1-CA 3.25Å; N856-N897 WeakPolarHBondContact OD1-CA 3.13Å; N856-N897 WeakPolarHBondContact OD1-CB 3.41Å; D893-N897 HydrophobicContact CB-CB 3.45Å; D893-N897 VanDerWaalsContact CB-CB 3.45Å; E894-N897 VanDerWaalsContact O-CB 3.31Å; E894-N897 WeakPolarHBondContact O-CB 3.46Å; E894-N897 PolarHBondContact O-N 2.82Å; E894-N897 VanDerWaalsContact O-N 3.12Å; N897-K899 PolarHBondContact O-N 3.08Å; N897-D975 WeakPolarHBondContact O-CB 3.31Å; N897-G977 VanDerWaalsContact OD1-CA 3.3Å; N897-G977 WeakPolarHBondContact OD1-CA 3.47Å
898	S	89.3	Confident	85.7	Confident	44 Å²	44	58.1 Å²	58.1	31%	0.308	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-8.2	176.2	106.6	0	0	0	0	115.5	D893 G895 L896 I900	D893-S898 WeakPolarHBondContact O-CB 3.45Å; G895-S898 PolarHBondContact O-OG 3Å; L896-S898 PolarHBondContact O-N 3.37Å; S898-I900 PolarHBondContact O-N 3.49Å
899	K	90.9	Very high	83.7	Confident	113 Å²	113	58 Å²	58	49%	0.491	31%	0.314	S	S	.	.			trans	-90.5	113.4	-164.1	-172.8	170.4	-179.1	177.9	0	111.6	G895 L896 N897 D975 M976	G895-K899 WeakPolarHBondContact O-CB 3.43Å; G895-K899 PolarHBondContact O-N 2.97Å; L896-K899 HydrophobicContact CD2-CD 4.22Å; L896-K899 PolarHBondContact O-N 3.21Å; N897-K899 PolarHBondContact O-N 3.08Å; K899-D975 CarbonylContact O-C 3.54Å; K899-D975 VanDerWaalsContact O-C 3.3Å; K899-D975 WeakPolarHBondContact O-CA 3.36Å; K899-M976 HydrophobicContact CB-CB 4.33Å; K899-M976 HydrophobicContact CB-CG 4.36Å; K899-M976 HydrophobicContact CB-SD 4.33Å; K899-M976 HydrophobicContact CD-SD 3.71Å; K899-M976 HydrophobicContact CG-CG 4.43Å; K899-M976 HydrophobicContact CG-SD 3.87Å; K899-M976 WeakPolarHBondContact O-CG 3.44Å; K899-M976 PolarHBondContact O-N 2.8Å; K899-M976 VanDerWaalsContact O-N 3.09Å
900	I	91.7	Very high	81	Confident	30 Å²	30	64 Å²	64	15%	0.154	35%	0.345	C	S	.	.			trans	-89.4	134.3	-171.3	-58.9	164.2	0	0	0	112.5	P860 A889 D891 S898 Y902 A973 S974	P860-I900 HydrophobicContact CB-CD1 4.23Å; P860-I900 HydrophobicContact CB-CG1 4.12Å; P860-I900 HydrophobicContact CG-CG1 4.28Å; A889-I900 HydrophobicContact CB-CD1 3.94Å; A889-I900 HydrophobicContact CB-CG2 4.49Å; A889-I900 WeakPolarHBondContact O-CD1 3.36Å; D891-I900 HydrophobicContact CB-CD1 4.35Å; D891-I900 HydrophobicContact CB-CG1 4.32Å; S898-I900 PolarHBondContact O-N 3.49Å; I900-Y902 HydrophobicContact CG2-CD1 4.45Å; I900-Y902 HydrophobicContact CG2-CD2 4.34Å; I900-Y902 HydrophobicContact CG2-CE1 4.01Å; I900-Y902 HydrophobicContact CG2-CE2 3.87Å; I900-A973 HydrophobicContact CG2-CB 3.88Å; I900-S974 CarbonylContact C-O 3.48Å; I900-S974 WeakPolarHBondContact CA-O 3.12Å
901	K	93	Very high	78.2	Confident	92 Å²	92	67.4 Å²	67.4	40%	0.4	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	126	169.5	-175.1	-178.7	-179.9	-178	0	110.1	Q947 S974 M976	K901-Q947 WeakPolarHBondContact CA-O 3.33Å; K901-Q947 HydrophobicContact CG-CB 4.32Å; K901-S974 PolarHBondContact N-O 3.29Å; K901-S974 PolarHBondContact O-N 3.11Å; K901-M976 HydrophobicContact CB-CE 4.47Å; K901-M976 HydrophobicContact CD-CE 4.21Å
902	Y	94.4	Very high	75.4	Confident	12 Å²	12	71.2 Å²	71.2	5%	0.047	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	140.7	176.9	-56	-87.7	0	0	0	112	F862 F887 A889 I900 Q947 V971 V972 A973	F862-Y902 HydrophobicContact CE1-CD1 4.42Å; F862-Y902 HydrophobicContact CE1-CE1 4.18Å; F887-Y902 HydrophobicContact CB-CD1 4.32Å; F887-Y902 HydrophobicContact CB-CE1 4.16Å; A889-Y902 HydrophobicContact CB-CE1 4.16Å; A889-Y902 PolarHBondContact N-OH 2.95Å; I900-Y902 HydrophobicContact CG2-CD1 4.45Å; I900-Y902 HydrophobicContact CG2-CD2 4.34Å; I900-Y902 HydrophobicContact CG2-CE1 4.01Å; I900-Y902 HydrophobicContact CG2-CE2 3.87Å; Y902-Q947 WeakPolarHBondContact CD2-O 3.39Å; Y902-Q947 PolarHBondContact N-O 3.42Å; Y902-Q947 WeakPolarHBondContact O-CA 3.42Å; Y902-Q947 WeakPolarHBondContact O-CB 3.26Å; Y902-Q947 WeakPolarHBondContact O-CG 3.14Å; Y902-V971 HydrophobicContact CD1-CG2 4.34Å; Y902-V972 CarbonylContact C-O 3.59Å; Y902-V972 VanDerWaalsContact CA-O 3.22Å; Y902-V972 WeakPolarHBondContact CA-O 3.41Å; Y902-A973 HydrophobicContact CD1-CB 4.01Å; Y902-A973 HydrophobicContact CE1-CB 3.97Å
903	S	92.5	Very high	72.8	Confident	42 Å²	42	76.7 Å²	76.7	29%	0.294	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	147.5	169.8	58.3	0	0	0	0	111.8	V971 V972	S903-V971 CarbonylContact O-C 3.51Å; S903-V971 WeakPolarHBondContact O-CA 3.26Å; S903-V972 PolarHBondContact N-O 2.93Å; S903-V972 PolarHBondContact O-N 3.33Å
904	L	88.8	Confident	69.9	Low	31 Å²	31	83.5 Å²	83.5	16%	0.162	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	130.9	177.7	-167	70	0	0	0	109.4	L940 L943 L945 L952 L969 C970 F987	L904-L940 HydrophobicContact CB-CD2 4.29Å; L904-L940 HydrophobicContact CD2-CD2 3.85Å; L904-L940 HydrophobicContact CG-CD2 3.99Å; L904-L943 HydrophobicContact CD2-CB 4.26Å; L904-L943 HydrophobicContact CD2-CD1 3.94Å; L904-L945 HydrophobicContact CB-CB 4.23Å; L904-L945 HydrophobicContact CB-CD2 3.88Å; L904-L952 HydrophobicContact CD2-CD1 3.75Å; L904-L969 HydrophobicContact CD1-CB 4.17Å; L904-C970 WeakPolarHBondContact CA-O 3.32Å; L904-F987 HydrophobicContact CD1-CE1 3.7Å; L904-F987 HydrophobicContact CD1-CZ 3.9Å
905	I	81.3	Confident	67.2	Low	87 Å²	87	83.2 Å²	83.2	45%	0.446	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	137.1	-179.3	-52.5	177.9	0	0	0	108	C970 V972	I905-C970 HydrophobicContact CB-CB 4.48Å; I905-C970 PolarHBondContact N-O 2.79Å; I905-C970 PolarHBondContact O-N 2.73Å; I905-V972 HydrophobicContact CD1-CG2 3.59Å; I905-V972 HydrophobicContact CG1-CG2 4.29Å
906	E	69.5	Low	64.6	Low	34 Å²	34	88.9 Å²	88.9	16%	0.159	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	134.4	169.2	-114.3	-179.3	155.4	0	0	110.3	I908 S936 C937 N938 L940 L969	E906-I908 PolarHBondContact O-N 3.35Å; E906-I908 VanDerWaalsContact O-N 3.15Å; E906-S936 PolarHBondContact OE1-OG 3.06Å; E906-S936 WeakPolarHBondContact OE2-CB 3.46Å; E906-S936 PolarHBondContact OE2-OG 3.16Å; E906-C937 WeakPolarHBondContact OE1-CA 3.36Å; E906-C937 WeakPolarHBondContact OE1-CB 3.38Å; E906-C937 PolarHBondContact OE1-N 2.81Å; E906-N938 PolarHBondContact OE1-N 2.83Å; E906-L940 HydrophobicContact CB-CD1 3.59Å; E906-L940 HydrophobicContact CB-CG 4.43Å; E906-L940 HydrophobicContact CG-CD1 3.76Å; E906-L940 HydrophobicContact CG-CG 4.14Å; E906-L969 HydrophobicContact CG-CD2 3.68Å
907	S	62.4	Low	61.7	Low	42 Å²	42	87.5 Å²	87.5	29%	0.294	51%	0.506	S	S	.	.			trans	-76.1	100.5	173	176.8	0	0	0	0	109.5	Q909	S907-Q909 PolarHBondContact O-N 3.3Å
908	I	54.2	Low	58.9	Low	140 Å²	140	90 Å²	90	72%	0.718	53%	0.526	S	S	*	.			trans	-69.1	118.1	159.2	-56.2	172.8	0	0	0	105.9	E906 D910	E906-I908 PolarHBondContact O-N 3.35Å; E906-I908 VanDerWaalsContact O-N 3.15Å; I908-D910 VanDerWaalsContact C-N 3.31Å; I908-D910 PolarHBondContact O-N 3Å
909	Q	48.7	Very low	56.5	Low	126 Å²	126	91.6 Å²	91.6	59%	0.589	54%	0.537	S	S	*	.			trans	-70.6	93.7	171.1	-89.1	-176.7	-6.3	0	0	108.2	S907 N911	S907-Q909 PolarHBondContact O-N 3.3Å; Q909-N911 PolarHBondContact O-N 3.15Å
910	D	36.1	Very low	54.5	Low	133 Å²	133	86.8 Å²	86.8	71%	0.711	52%	0.517	S	S	*	.			trans	-65.9	121.6	167.1	-92.7	-28.2	0	0	0	109.4	I908 S912	I908-D910 VanDerWaalsContact C-N 3.31Å; I908-D910 PolarHBondContact O-N 3Å; D910-S912 PolarHBondContact O-N 3.26Å
911	N	32.2	Very low	52.7	Low	170 Å²	170	87.9 Å²	87.9	91%	0.909	53%	0.526	S	S	*	.	S	Bend	trans	-71.9	65.8	171.7	-84.1	-37.2	0	0	0	110	Q909	Q909-N911 PolarHBondContact O-N 3.15Å
912	S	31.3	Very low	51	Low	91 Å²	91	84.2 Å²	84.2	64%	0.636	51%	0.512	S	S	*	.			trans	-162.5	66.3	169.9	62.4	0	0	0	0	111.2	D910	D910-S912 PolarHBondContact O-N 3.26Å
913	D	33.3	Very low	49.1	Very low	162 Å²	162	89.8 Å²	89.8	87%	0.866	54%	0.536	S	S	*	.			trans	-149	97.1	150.1	-106.5	-23.8	0	0	0	111.4	G915	D913-G915 PolarHBondContact O-N 3.04Å
914	T	30	Very low	47.2	Very low	151 Å²	151	92.2 Å²	92.2	93%	0.926	55%	0.546	S	S	*	.			trans	-69.3	94	162.2	45.5	0	0	0	0	108.7
915	G	29.7	Very low	45.3	Very low	64 Å²	64	91.1 Å²	91.1	66%	0.66	54%	0.54	S	S	*	.			trans	177.1	101.4	173.2	0	0	0	0	0	114.4	D913 G917	D913-G915 PolarHBondContact O-N 3.04Å; G915-G917 PolarHBondContact O-N 2.98Å
916	N	30.9	Very low	43.6	Very low	166 Å²	166	90 Å²	90	89%	0.888	54%	0.535	S	S	*	.			trans	35.7	79.1	158.6	-76.3	-9.2	0	0	0	118.7	S918	N916-S918 PolarHBondContact O-N 3.34Å
917	G	26.5	Very low	42.4	Very low	80 Å²	80	99.9 Å²	99.9	83%	0.825	57%	0.571	S	S	*	*				70	34.9	104.5	0	0	0	0	0	120.6	G915	G915-G917 PolarHBondContact O-N 2.98Å
918	S	30.6	Very low	41.6	Very low	80 Å²	80	107.2 Å²	107.2	56%	0.559	60%	0.597	S	S	*	*			trans	-92.1	99.2	155.7	-70.6	0	0	0	0	108.6	N916 S920 Y1012	N916-S918 PolarHBondContact O-N 3.34Å; S918-S920 VanDerWaalsContact C-N 3.34Å; S918-S920 PolarHBondContact O-N 2.82Å; S918-Y1012 PolarHBondContact OG-OH 3.36Å; S918-Y1012 VanDerWaalsContact OG-OH 3.13Å
919	S	39.1	Very low	41.2	Very low	78 Å²	78	104.9 Å²	104.9	55%	0.545	59%	0.594	S	S	.	*			trans	-59.1	92.2	175.4	175.1	0	0	0	0	109.4	T921	S919-T921 PolarHBondContact O-N 2.69Å
920	S	49.2	Very low	40.8	Very low	11 Å²	11	104.7 Å²	104.7	8%	0.077	60%	0.596	C	S	.	*			trans	-46	118.1	177.1	57.8	0	0	0	0	109.2	S918 C922 K923	S918-S920 VanDerWaalsContact C-N 3.34Å; S918-S920 PolarHBondContact O-N 2.82Å; S920-C922 PolarHBondContact O-N 2.75Å; S920-K923 VanDerWaalsContact O-CB 3.31Å; S920-K923 WeakPolarHBondContact O-CB 3.24Å; S920-K923 PolarHBondContact O-N 3.34Å; S920-K923 WeakPolarHBondContact OG-CD 3.06Å; S920-K923 WeakPolarHBondContact OG-CE 3.38Å; S920-K923 WeakPolarHBondContact OG-CG 3.32Å
921	T	53.5	Low	40.9	Very low	53 Å²	53	107 Å²	107	33%	0.325	60%	0.604	S	S	.	*	G	3₁₀ helix	trans	-52.5	-28.4	-177.5	45.3	0	0	0	0	112	D869 S919 K923 N924	D869-T921 WeakPolarHBondContact CB-OG1 3.48Å; D869-T921 PolarHBondContact O-OG1 2.99Å; S919-T921 PolarHBondContact O-N 2.69Å; T921-K923 PolarHBondContact O-N 2.74Å; T921-K923 VanDerWaalsContact O-N 3.16Å; T921-N924 PolarHBondContact O-N 2.76Å
922	C	58	Low	41	Very low	16 Å²	16	104.8 Å²	104.8	11%	0.108	59%	0.593	C	S	.	*	G	3₁₀ helix	trans	-58.6	-25	173.6	-41.4	0	0	0	0	114	S920 N924 R968 C988	S920-C922 PolarHBondContact O-N 2.75Å; C922-N924 VanDerWaalsContact C-N 3.34Å; C922-N924 PolarHBondContact O-N 3.45Å; C922-R968 HydrophobicContact CB-CB 4.31Å; C922-R968 VanDerWaalsContact SG-CG 3.54Å; C922-C988 WeakPolarHBondContact CA-SG 3.09Å; C922-C988 HydrophobicContact CB-CB 3.89Å; C922-C988 WeakPolarHBondContact CB-SG 3.29Å; C922-C988 PolarHBondContact N-SG 3.04Å; C922-C988 WeakPolarHBondContact SG-CB 3.42Å; C922-C988 CovalentContact SG-SG 2.02Å; C922-C988 PolarHBondContact SG-SG 2.99Å
923	K	54.1	Low	41.2	Very low	129 Å²	129	108.4 Å²	108.4	56%	0.561	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-71	-19.8	-174.4	-84.7	173.5	-175.5	179.7	0	114.5	S920 T921	S920-K923 VanDerWaalsContact O-CB 3.31Å; S920-K923 WeakPolarHBondContact O-CB 3.24Å; S920-K923 PolarHBondContact O-N 3.34Å; S920-K923 WeakPolarHBondContact OG-CD 3.06Å; S920-K923 WeakPolarHBondContact OG-CE 3.38Å; S920-K923 WeakPolarHBondContact OG-CG 3.32Å; T921-K923 PolarHBondContact O-N 2.74Å; T921-K923 VanDerWaalsContact O-N 3.16Å
924	N	51.3	Low	41.4	Very low	93 Å²	93	108.6 Å²	108.6	50%	0.497	60%	0.6	S	S	.	*	G	3₁₀ helix	trans	-89.8	0.2	-172.2	-74.7	-22.9	0	0	0	114.9	T921 C922 Q1006	T921-N924 PolarHBondContact O-N 2.76Å; C922-N924 VanDerWaalsContact C-N 3.34Å; C922-N924 PolarHBondContact O-N 3.45Å; N924-Q1006 VanDerWaalsContact CB-OE1 3.28Å
925	L	48.8	Very low	42.2	Very low	7 Å²	7	109 Å²	109	4%	0.037	59%	0.592	C	S	.	*	S	Bend	trans	-96.4	-6.8	-163.4	-82.3	157.3	0	0	0	118.2	I871 T966 W1002	I871-L925 HydrophobicContact CD1-CD1 3.81Å; I871-L925 HydrophobicContact CG1-CD1 4.23Å; I871-L925 HydrophobicContact CG2-CD1 4.14Å; L925-T966 HydrophobicContact CB-CG2 4.38Å; L925-T966 WeakPolarHBondContact CB-OG1 3.4Å; L925-T966 HydrophobicContact CD1-CG2 4.03Å; L925-W1002 HydrophobicContact CD2-CE3 4.24Å; L925-W1002 HydrophobicContact CD2-CH2 3.96Å; L925-W1002 HydrophobicContact CD2-CZ3 3.47Å; L925-W1002 VanDerWaalsContact CD2-CZ3 3.47Å; L925-W1002 WeakPolarHBondContact O-CH2 3.18Å; L925-W1002 WeakPolarHBondContact O-CZ3 3.43Å
926	N	45.9	Very low	43.3	Very low	64 Å²	64	108.8 Å²	108.8	34%	0.342	58%	0.58	S	S	.	*			trans	-161.8	122	164.4	-138	-23.2	0	0	0	115.3	K928 N964	N926-K928 PolarHBondContact O-N 2.83Å; N926-K928 VanDerWaalsContact O-N 3.16Å; N926-N964 WeakPolarHBondContact ND2-CB 3.33Å; N926-N964 PolarHBondContact ND2-O 2.91Å
927	R	45.2	Very low	44.9	Very low	242 Å²	242	102.3 Å²	102.3	91%	0.913	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	13.3	179.7	-142.5	176	-172.9	172.5	1.9	113.5
928	K	45.4	Very low	47	Very low	196 Å²	196	103.6 Å²	103.6	85%	0.852	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116	-9.5	-177.1	-94.9	-177.3	176	-179.8	0	115.8	N926	N926-K928 PolarHBondContact O-N 2.83Å; N926-K928 VanDerWaalsContact O-N 3.16Å
929	S	44.9	Very low	49.3	Very low	91 Å²	91	99.8 Å²	99.8	64%	0.636	51%	0.508	S	S	*	.	S	Bend	trans	-95.3	7.5	171.9	66.5	0	0	0	0	113.7	M931	S929-M931 PolarHBondContact O-N 2.8Å; S929-M931 VanDerWaalsContact O-N 3.1Å
930	L	41.2	Very low	51.3	Low	121 Å²	121	99.2 Å²	99.2	63%	0.634	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	24.2	-174.4	-122.6	107.2	0	0	0	115
931	M	37	Very low	53	Low	182 Å²	182	104 Å²	104	90%	0.897	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.8	0.4	177.3	-75.7	-143.7	163.9	0	0	116.8	S929	S929-M931 PolarHBondContact O-N 2.8Å; S929-M931 VanDerWaalsContact O-N 3.1Å
932	D	35	Very low	54.6	Low	123 Å²	123	103.1 Å²	103.1	66%	0.658	51%	0.511	S	S	*	.			trans	-124.7	88.7	168.6	-93.2	-37.1	0	0	0	111	N934	D932-N934 PolarHBondContact O-N 3.31Å
933	H	36.7	Very low	56	Low	168 Å²	168	103 Å²	103	78%	0.778	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	24.8	-175.1	-95.7	-57.5	0	0	0	115.3
934	N	36.2	Very low	57.8	Low	165 Å²	165	102.9 Å²	102.9	88%	0.882	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-153.7	17.7	-172.5	-101.3	-15.1	0	0	0	116.4	D932	D932-N934 PolarHBondContact O-N 3.31Å
935	Q	46.3	Very low	59.7	Low	161 Å²	161	99.3 Å²	99.3	75%	0.752	49%	0.487	S	S	*	.			trans	-114.1	122.4	179.2	-77.8	179	-14.8	0	0	111.9
936	S	54.4	Low	61.6	Low	58 Å²	58	100.7 Å²	100.7	41%	0.406	50%	0.495	S	S	.	.			trans	-49.2	145.9	161	136.8	0	0	0	0	108.5	E906 N938	E906-S936 PolarHBondContact OE1-OG 3.06Å; E906-S936 WeakPolarHBondContact OE2-CB 3.46Å; E906-S936 PolarHBondContact OE2-OG 3.16Å; S936-N938 PolarHBondContact O-N 3.34Å; S936-N938 WeakPolarHBondContact OG-CA 3.23Å; S936-N938 PolarHBondContact OG-N 2.77Å; S936-N938 PolarHBondContact OG-OD1 3.28Å
937	C	63.2	Low	63.8	Low	31 Å²	31	102.6 Å²	102.6	21%	0.209	50%	0.501	C	S	.	.			trans	-63.7	-8.7	176.3	-118.1	0	0	0	0	111.6	E906 L939 V965 C967	E906-C937 WeakPolarHBondContact OE1-CA 3.36Å; E906-C937 WeakPolarHBondContact OE1-CB 3.38Å; E906-C937 PolarHBondContact OE1-N 2.81Å; C937-L939 HydrophobicContact CB-CB 4.31Å; C937-L939 PolarHBondContact O-N 2.95Å; C937-V965 VanDerWaalsContact SG-CG1 3.56Å; C937-C967 HydrophobicContact CB-CB 3.64Å; C937-C967 WeakPolarHBondContact CB-SG 3.46Å; C937-C967 WeakPolarHBondContact SG-CA 3.49Å; C937-C967 WeakPolarHBondContact SG-CB 3.38Å; C937-C967 CovalentContact SG-SG 2.03Å; C937-C967 PolarHBondContact SG-SG 3.13Å
938	N	70.9	Confident	65.8	Low	106 Å²	106	96.1 Å²	96.1	57%	0.567	49%	0.489	S	S	*	.			trans	46.8	25.2	-174.5	-89.4	-23.2	0	0	0	112.1	E906 S936 L940 Y942	E906-N938 PolarHBondContact OE1-N 2.83Å; S936-N938 PolarHBondContact O-N 3.34Å; S936-N938 WeakPolarHBondContact OG-CA 3.23Å; S936-N938 PolarHBondContact OG-N 2.77Å; S936-N938 PolarHBondContact OG-OD1 3.28Å; N938-L940 VanDerWaalsContact C-N 3.32Å; N938-Y942 VanDerWaalsContact O-CD2 3.25Å; N938-Y942 WeakPolarHBondContact O-CD2 3.46Å; N938-Y942 VanDerWaalsContact O-CE2 3.28Å; N938-Y942 WeakPolarHBondContact O-CE2 3.47Å
939	L	78.9	Confident	67.8	Low	0 Å²	0	89.4 Å²	89.4	0%	0	46%	0.464	C	S	.	.	G	3₁₀ helix	trans	-79	-24.4	-173.2	-138.7	84.7	0	0	0	111.6	C937 E941 Y942 L943 L962 C967 L989 L991	C937-L939 HydrophobicContact CB-CB 4.31Å; C937-L939 PolarHBondContact O-N 2.95Å; L939-E941 PolarHBondContact O-N 2.99Å; L939-E941 VanDerWaalsContact O-N 3.16Å; L939-Y942 CarbonylContact O-C 3.57Å; L939-Y942 WeakPolarHBondContact O-CA 3.38Å; L939-Y942 PolarHBondContact O-N 2.84Å; L939-L943 HydrophobicContact CD2-CD1 3.95Å; L939-L943 HydrophobicContact CD2-CG 4.28Å; L939-L943 HydrophobicContact CG-CD1 4.48Å; L939-L943 WeakPolarHBondContact O-CG 3.43Å; L939-L943 PolarHBondContact O-N 2.94Å; L939-L962 HydrophobicContact CD1-CD1 3.9Å; L939-L962 HydrophobicContact CD1-CD2 4.49Å; L939-C967 HydrophobicContact CB-CB 4.5Å; L939-C967 HydrophobicContact CD2-CB 4.29Å; L939-L989 HydrophobicContact CD2-CB 4.46Å; L939-L989 HydrophobicContact CD2-CD2 3.37Å; L939-L989 HydrophobicContact CD2-CG 4.13Å; L939-L991 HydrophobicContact CD1-CD1 3.66Å
940	L	81.6	Confident	69.8	Low	67 Å²	67	85 Å²	85	35%	0.351	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-53.9	-33.5	178.2	-81.5	163.1	0	0	0	112.5	L904 E906 N938 Y942 L943	L904-L940 HydrophobicContact CB-CD2 4.29Å; L904-L940 HydrophobicContact CD2-CD2 3.85Å; L904-L940 HydrophobicContact CG-CD2 3.99Å; E906-L940 HydrophobicContact CB-CD1 3.59Å; E906-L940 HydrophobicContact CB-CG 4.43Å; E906-L940 HydrophobicContact CG-CD1 3.76Å; E906-L940 HydrophobicContact CG-CG 4.14Å; N938-L940 VanDerWaalsContact C-N 3.32Å; L940-Y942 VanDerWaalsContact C-N 3.26Å; L940-Y942 PolarHBondContact O-N 2.74Å; L940-L943 PolarHBondContact O-N 2.78Å
941	E	84.1	Confident	72.1	Confident	111 Å²	111	79.7 Å²	79.7	52%	0.519	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-69.5	-25.8	178.3	-161.5	-171.6	155.6	0	0	112.7	L939 S955 K956	L939-E941 PolarHBondContact O-N 2.99Å; L939-E941 VanDerWaalsContact O-N 3.16Å; E941-S955 PolarHBondContact O-OG 3.04Å; E941-K956 HydrophobicContact CG-CD 4.44Å; E941-K956 IonicContact OE1-NZ 2.63Å; E941-K956 PolarHBondContact OE1-NZ 3.48Å
942	Y	86.9	Confident	74.5	Confident	34 Å²	34	71 Å²	71	13%	0.133	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-96.5	-1.8	-179.8	-54	-82.4	0	0	0	112.9	N938 L939 L940 L954 S955 K956 L958 P959 L962	N938-Y942 VanDerWaalsContact O-CD2 3.25Å; N938-Y942 WeakPolarHBondContact O-CD2 3.46Å; N938-Y942 VanDerWaalsContact O-CE2 3.28Å; N938-Y942 WeakPolarHBondContact O-CE2 3.47Å; L939-Y942 CarbonylContact O-C 3.57Å; L939-Y942 WeakPolarHBondContact O-CA 3.38Å; L939-Y942 PolarHBondContact O-N 2.84Å; L940-Y942 VanDerWaalsContact C-N 3.26Å; L940-Y942 PolarHBondContact O-N 2.74Å; Y942-L954 CarbonylContact O-C 3.33Å; Y942-L954 WeakPolarHBondContact O-CA 3.33Å; Y942-L954 WeakPolarHBondContact O-CD1 3.48Å; Y942-S955 WeakPolarHBondContact CA-OG 3.37Å; Y942-S955 PolarHBondContact O-N 3.39Å; Y942-S955 PolarHBondContact O-OG 2.83Å; Y942-K956 HydrophobicContact CD1-CB 3.71Å; Y942-K956 HydrophobicContact CE1-CB 4.32Å; Y942-L958 HydrophobicContact CG-CD2 4.38Å; Y942-P959 HydrophobicContact CE1-CG 3.82Å; Y942-P959 HydrophobicContact CE2-CG 4.35Å; Y942-P959 WeakPolarHBondContact OH-CG 3.25Å; Y942-L962 HydrophobicContact CD2-CD1 3.92Å; Y942-L962 HydrophobicContact CE2-CD1 3.78Å
943	L	89.1	Confident	77	Confident	15 Å²	15	67.2 Å²	67.2	8%	0.079	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	144.3	-178.6	-67.1	-178.5	0	0	0	111.2	I884 L904 L939 L940 L952 F953 S955 L969 L989	I884-L943 HydrophobicContact CD1-CD2 3.35Å; L904-L943 HydrophobicContact CD2-CB 4.26Å; L904-L943 HydrophobicContact CD2-CD1 3.94Å; L939-L943 HydrophobicContact CD2-CD1 3.95Å; L939-L943 HydrophobicContact CD2-CG 4.28Å; L939-L943 HydrophobicContact CG-CD1 4.48Å; L939-L943 WeakPolarHBondContact O-CG 3.43Å; L939-L943 PolarHBondContact O-N 2.94Å; L940-L943 PolarHBondContact O-N 2.78Å; L943-L952 HydrophobicContact CB-CD1 4.18Å; L943-L952 HydrophobicContact CD1-CD1 4.39Å; L943-L952 HydrophobicContact CD1-CD2 4.49Å; L943-F953 CarbonylContact C-O 3.59Å; L943-F953 WeakPolarHBondContact CA-O 3.2Å; L943-S955 PolarHBondContact N-OG 3.01Å; L943-L969 HydrophobicContact CD1-CD1 3.43Å; L943-L969 VanDerWaalsContact CD1-CD1 3.43Å; L943-L989 HydrophobicContact CD1-CD2 4.05Å; L943-L989 HydrophobicContact CD2-CD2 4Å
944	Y	90.4	Very high	79.3	Confident	125 Å²	125	59.3 Å²	59.3	49%	0.49	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	114.2	170.4	169.4	-103.8	0	0	0	109.2	N946 L952 F953	Y944-N946 HydrophobicContact CE1-CB 3.95Å; Y944-L952 CarbonylContact O-C 3.58Å; Y944-F953 HydrophobicContact CD1-CB 4.41Å; Y944-F953 AromaticContact CD1-CD2 3.83Å; Y944-F953 HydrophobicContact CD1-CD2 3.83Å; Y944-F953 HydrophobicContact CD1-CG 4.49Å; Y944-F953 HydrophobicContact CE1-CD2 4.27Å; Y944-F953 PolarHBondContact N-O 3.49Å; Y944-F953 PolarHBondContact O-N 3.19Å
945	L	91.5	Very high	81.6	Confident	18 Å²	18	53.8 Å²	53.8	9%	0.094	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	118.9	170.2	-179.9	66.1	0	0	0	109.1	F887 L904 Q947 L952 V971	F887-L945 HydrophobicContact CD2-CD1 4.02Å; F887-L945 HydrophobicContact CE2-CD1 4.29Å; L904-L945 HydrophobicContact CB-CB 4.23Å; L904-L945 HydrophobicContact CB-CD2 3.88Å; L945-Q947 PolarHBondContact O-N 3.09Å; L945-Q947 VanDerWaalsContact O-N 3.13Å; L945-L952 HydrophobicContact CB-CD1 3.98Å; L945-L952 HydrophobicContact CD1-CB 4.18Å; L945-L952 HydrophobicContact CD1-CD1 4.32Å; L945-V971 HydrophobicContact CD2-CG2 4.07Å
946	N	89	Confident	83.4	Confident	37 Å²	37	50.5 Å²	50.5	20%	0.198	26%	0.262	C	S	.	.			trans	-72.2	108.2	170.8	-178	-60.1	0	0	0	109.4	Y944 T948 T949 G950 S951 F953	Y944-N946 HydrophobicContact CE1-CB 3.95Å; N946-T948 PolarHBondContact O-N 3.35Å; N946-T948 VanDerWaalsContact O-N 3.08Å; N946-T948 PolarHBondContact OD1-N 2.89Å; N946-T948 PolarHBondContact OD1-OG1 2.82Å; N946-T949 WeakPolarHBondContact CB-OG1 3.45Å; N946-T949 PolarHBondContact O-N 2.8Å; N946-T949 WeakPolarHBondContact OD1-CG2 3.04Å; N946-T949 PolarHBondContact OD1-N 2.82Å; N946-T949 PolarHBondContact OD1-OG1 3.31Å; N946-G950 PolarHBondContact O-N 2.94Å; N946-S951 PolarHBondContact N-O 3.03Å; N946-F953 HydrophobicContact CB-CE2 4.4Å
947	Q	91.3	Very high	84.7	Confident	103 Å²	103	52.2 Å²	52.2	48%	0.481	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-18.5	-171.8	-61.2	-174.2	-9.2	0	0	114.5	K901 Y902 L945	K901-Q947 WeakPolarHBondContact CA-O 3.33Å; K901-Q947 HydrophobicContact CG-CB 4.32Å; Y902-Q947 WeakPolarHBondContact CD2-O 3.39Å; Y902-Q947 PolarHBondContact N-O 3.42Å; Y902-Q947 WeakPolarHBondContact O-CA 3.42Å; Y902-Q947 WeakPolarHBondContact O-CB 3.26Å; Y902-Q947 WeakPolarHBondContact O-CG 3.14Å; L945-Q947 PolarHBondContact O-N 3.09Å; L945-Q947 VanDerWaalsContact O-N 3.13Å
948	T	87.5	Confident	85.4	Confident	106 Å²	106	50.8 Å²	50.8	65%	0.65	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	-36.6	-179.5	56.6	0	0	0	0	112.7	N946	N946-T948 PolarHBondContact O-N 3.35Å; N946-T948 VanDerWaalsContact O-N 3.08Å; N946-T948 PolarHBondContact OD1-N 2.89Å; N946-T948 PolarHBondContact OD1-OG1 2.82Å
949	T	88.2	Confident	85.9	Confident	55 Å²	55	47.3 Å²	47.3	34%	0.337	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-14	-175.8	66.7	0	0	0	0	114.3	K886 N946 S951	K886-T949 VanDerWaalsContact CE-O 3.26Å; K886-T949 WeakPolarHBondContact CE-O 3.13Å; N946-T949 WeakPolarHBondContact CB-OG1 3.45Å; N946-T949 PolarHBondContact O-N 2.8Å; N946-T949 WeakPolarHBondContact OD1-CG2 3.04Å; N946-T949 PolarHBondContact OD1-N 2.82Å; N946-T949 PolarHBondContact OD1-OG1 3.31Å; T949-S951 PolarHBondContact O-N 2.93Å; T949-S951 PolarHBondContact OG1-N 2.64Å; T949-S951 PolarHBondContact OG1-OG 2.88Å
950	G	86.5	Confident	85.6	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.271	C	S	.	.			trans	70.9	8.5	-173.8	0	0	0	0	0	114	K886 F887 N946	K886-G950 CarbonylContact C-O 3.58Å; K886-G950 WeakPolarHBondContact CA-O 3.43Å; F887-G950 VanDerWaalsContact CD2-O 3.25Å; F887-G950 WeakPolarHBondContact CD2-O 3.03Å; F887-G950 PolarHBondContact N-O 2.79Å; N946-G950 PolarHBondContact O-N 2.94Å
951	S	89.6	Confident	85.3	Confident	8 Å²	8	57 Å²	57	6%	0.056	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	121.9	179.5	-51.7	0	0	0	0	110.7	I885 N946 T949 F953	I885-S951 CarbonylContact O-C 3.58Å; I885-S951 WeakPolarHBondContact O-CA 3.22Å; N946-S951 PolarHBondContact N-O 3.03Å; T949-S951 PolarHBondContact O-N 2.93Å; T949-S951 PolarHBondContact OG1-N 2.64Å; T949-S951 PolarHBondContact OG1-OG 2.88Å; S951-F953 WeakPolarHBondContact O-CD2 3.32Å; S951-F953 WeakPolarHBondContact O-CE2 3.5Å
952	L	88.4	Confident	84.9	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	129.6	175.4	-176.2	69.2	0	0	0	109.8	Q883 I884 I885 F887 L904 L943 Y944 L945 F987	Q883-L952 CarbonylContact C-O 3.48Å; I884-L952 HydrophobicContact CB-CD2 4.26Å; I884-L952 HydrophobicContact CB-CG 4.38Å; I884-L952 HydrophobicContact CD1-CD2 4.21Å; I884-L952 HydrophobicContact CD1-CG 4.24Å; I884-L952 HydrophobicContact CG2-CD2 4.27Å; I884-L952 PolarHBondContact N-O 3.43Å; I885-L952 HydrophobicContact CG2-CB 3.87Å; I885-L952 HydrophobicContact CG2-CD2 4.11Å; I885-L952 PolarHBondContact O-N 2.78Å; F887-L952 HydrophobicContact CE2-CB 4.33Å; L904-L952 HydrophobicContact CD2-CD1 3.75Å; L943-L952 HydrophobicContact CB-CD1 4.18Å; L943-L952 HydrophobicContact CD1-CD1 4.39Å; L943-L952 HydrophobicContact CD1-CD2 4.49Å; Y944-L952 CarbonylContact O-C 3.58Å; L945-L952 HydrophobicContact CB-CD1 3.98Å; L945-L952 HydrophobicContact CD1-CB 4.18Å; L945-L952 HydrophobicContact CD1-CD1 4.32Å; L952-F987 HydrophobicContact CD2-CE2 3.78Å; L952-F987 HydrophobicContact CD2-CZ 3.51Å
953	F	87	Confident	84.1	Confident	44 Å²	44	51.7 Å²	51.7	19%	0.193	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	158.2	-178	-59.7	-92.3	0	0	0	111.6	G881 Y882 Q883 L943 Y944 N946 S951	G881-F953 WeakPolarHBondContact O-CD1 2.89Å; Y882-F953 CarbonylContact O-C 2.91Å; Y882-F953 WeakPolarHBondContact O-CA 3.22Å; Q883-F953 HydrophobicContact CB-CD1 3.68Å; Q883-F953 HydrophobicContact CB-CE1 3.53Å; Q883-F953 HydrophobicContact CB-CZ 4.41Å; Q883-F953 HydrophobicContact CG-CD1 3.96Å; Q883-F953 HydrophobicContact CG-CE1 3.62Å; Q883-F953 HydrophobicContact CG-CZ 4.03Å; L943-F953 CarbonylContact C-O 3.59Å; L943-F953 WeakPolarHBondContact CA-O 3.2Å; Y944-F953 HydrophobicContact CD1-CB 4.41Å; Y944-F953 AromaticContact CD1-CD2 3.83Å; Y944-F953 HydrophobicContact CD1-CD2 3.83Å; Y944-F953 HydrophobicContact CD1-CG 4.49Å; Y944-F953 HydrophobicContact CE1-CD2 4.27Å; Y944-F953 PolarHBondContact N-O 3.49Å; Y944-F953 PolarHBondContact O-N 3.19Å; N946-F953 HydrophobicContact CB-CE2 4.4Å; S951-F953 WeakPolarHBondContact O-CD2 3.32Å; S951-F953 WeakPolarHBondContact O-CE2 3.5Å
954	L	85.1	Confident	83.1	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.01	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	123	161.7	-169.2	71.3	0	0	0	109.3	I874 E878 P880 G881 Y882 Y942 K956 L958	I874-L954 HydrophobicContact CD1-CD1 4.27Å; E878-L954 HydrophobicContact CB-CD2 4.04Å; E878-L954 VanDerWaalsContact O-CD2 3.31Å; E878-L954 WeakPolarHBondContact O-CD2 3.16Å; P880-L954 CarbonylContact C-O 3.53Å; P880-L954 WeakPolarHBondContact CA-O 3.22Å; G881-L954 PolarHBondContact N-O 2.84Å; Y882-L954 PolarHBondContact O-N 2.85Å; Y942-L954 CarbonylContact O-C 3.33Å; Y942-L954 WeakPolarHBondContact O-CA 3.33Å; Y942-L954 WeakPolarHBondContact O-CD1 3.48Å; L954-K956 WeakPolarHBondContact CG-O 2.76Å; L954-L958 HydrophobicContact CD1-CD1 4.03Å; L954-L958 HydrophobicContact CD1-CD2 3.64Å; L954-L958 HydrophobicContact CD1-CG 3.63Å; L954-L958 HydrophobicContact CD2-CD1 4.2Å; L954-L958 HydrophobicContact CD2-CG 4.13Å
955	S	84.2	Confident	82.4	Confident	48 Å²	48	49.3 Å²	49.3	34%	0.336	26%	0.261	S	S	.	.			trans	-98.1	-26.5	-175.6	68.7	0	0	0	0	113.8	E941 Y942 L943	E941-S955 PolarHBondContact O-OG 3.04Å; Y942-S955 WeakPolarHBondContact CA-OG 3.37Å; Y942-S955 PolarHBondContact O-N 3.39Å; Y942-S955 PolarHBondContact O-OG 2.83Å; L943-S955 PolarHBondContact N-OG 3.01Å
956	K	83.6	Confident	81.7	Confident	92 Å²	92	49.9 Å²	49.9	40%	0.4	27%	0.266	S	S	.	.	S	Bend	trans	-138	153.7	-178.2	-69.2	178.8	179.4	171.3	0	109.1	E941 Y942 L954 L958	E941-K956 HydrophobicContact CG-CD 4.44Å; E941-K956 IonicContact OE1-NZ 2.63Å; E941-K956 PolarHBondContact OE1-NZ 3.48Å; Y942-K956 HydrophobicContact CD1-CB 3.71Å; Y942-K956 HydrophobicContact CE1-CB 4.32Å; L954-K956 WeakPolarHBondContact CG-O 2.76Å; K956-L958 PolarHBondContact O-N 2.79Å
957	Q	81.3	Confident	81.2	Confident	94 Å²	94	48.1 Å²	48.1	44%	0.439	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-58.4	131.9	174.3	-170.1	65.6	36.4	0	0	108.6	M876 E878 P959	M876-Q957 PolarHBondContact O-NE2 2.83Å; M876-Q957 VanDerWaalsContact O-NE2 3.11Å; E878-Q957 PolarHBondContact O-NE2 2.9Å; Q957-P959 VanDerWaalsContact O-CD 3.29Å; Q957-P959 WeakPolarHBondContact O-CD 3.19Å
958	L	79	Confident	80.8	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-67.3	121	176.3	-67.3	161.5	0	0	0	108.7	I874 M876 Y942 L954 K956 L962 L991	I874-L958 HydrophobicContact CD1-CD1 3.62Å; I874-L958 HydrophobicContact CG1-CD1 3.99Å; M876-L958 HydrophobicContact CE-CB 3.86Å; M876-L958 HydrophobicContact SD-CB 3.94Å; M876-L958 HydrophobicContact SD-CD1 4.11Å; Y942-L958 HydrophobicContact CG-CD2 4.38Å; L954-L958 HydrophobicContact CD1-CD1 4.03Å; L954-L958 HydrophobicContact CD1-CD2 3.64Å; L954-L958 HydrophobicContact CD1-CG 3.63Å; L954-L958 HydrophobicContact CD2-CD1 4.2Å; L954-L958 HydrophobicContact CD2-CG 4.13Å; K956-L958 PolarHBondContact O-N 2.79Å; L958-L962 HydrophobicContact CD2-CD1 4.32Å; L958-L991 HydrophobicContact CD1-CD2 4.01Å; L958-L991 HydrophobicContact CD2-CD1 4.08Å; L958-L991 HydrophobicContact CD2-CD2 4.32Å
959	P	80	Confident	80.8	Confident	33 Å²	33	41.5 Å²	41.5	21%	0.214	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-70.4	139.6	176.8	29.9	-39.1	0	0	0	109.8	M876 Y942 Q957 H961 L962	M876-P959 WeakPolarHBondContact CE-O 3.21Å; Y942-P959 HydrophobicContact CE1-CG 3.82Å; Y942-P959 HydrophobicContact CE2-CG 4.35Å; Y942-P959 WeakPolarHBondContact OH-CG 3.25Å; Q957-P959 VanDerWaalsContact O-CD 3.29Å; Q957-P959 WeakPolarHBondContact O-CD 3.19Å; P959-H961 VanDerWaalsContact CB-CE1 3.43Å; P959-H961 WeakPolarHBondContact CB-CE1 3.39Å; P959-H961 WeakPolarHBondContact CB-ND1 3.24Å; P959-H961 WeakPolarHBondContact CG-CE1 3.29Å; P959-H961 PolarHBondContact O-N 2.83Å; P959-L962 HydrophobicContact CG-CD1 3.7Å; P959-L962 HydrophobicContact CG-CG 3.99Å; P959-L962 PolarHBondContact O-N 2.82Å
960	N	72.7	Confident	80.8	Confident	132 Å²	132	39.3 Å²	39.3	71%	0.706	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	-51.7	-22.7	-173.7	-59.7	-1	0	0	0	115	L962 S963	N960-L962 PolarHBondContact O-N 2.91Å; N960-S963 WeakPolarHBondContact O-CB 3.47Å; N960-S963 PolarHBondContact O-N 2.95Å
961	H	75.8	Confident	81	Confident	138 Å²	138	39.3 Å²	39.3	64%	0.639	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	-67.3	-16.9	176.1	70	-98.8	0	0	0	114.2	P959 S963	P959-H961 VanDerWaalsContact CB-CE1 3.43Å; P959-H961 WeakPolarHBondContact CB-CE1 3.39Å; P959-H961 WeakPolarHBondContact CB-ND1 3.24Å; P959-H961 WeakPolarHBondContact CG-CE1 3.29Å; P959-H961 PolarHBondContact O-N 2.83Å; H961-S963 VanDerWaalsContact C-N 3.32Å
962	L	74.8	Confident	81.2	Confident	10 Å²	10	39.5 Å²	39.5	5%	0.052	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-88.9	3.5	177.5	-63.4	176	0	0	0	113.3	M876 L939 Y942 L958 P959 N960 N964 V965 L991	M876-L962 HydrophobicContact CE-CB 4.14Å; M876-L962 HydrophobicContact SD-CB 4.48Å; L939-L962 HydrophobicContact CD1-CD1 3.9Å; L939-L962 HydrophobicContact CD1-CD2 4.49Å; Y942-L962 HydrophobicContact CD2-CD1 3.92Å; Y942-L962 HydrophobicContact CE2-CD1 3.78Å; L958-L962 HydrophobicContact CD2-CD1 4.32Å; P959-L962 HydrophobicContact CG-CD1 3.7Å; P959-L962 HydrophobicContact CG-CG 3.99Å; P959-L962 PolarHBondContact O-N 2.82Å; N960-L962 PolarHBondContact O-N 2.91Å; L962-N964 PolarHBondContact O-N 3.48Å; L962-V965 VanDerWaalsContact O-CB 3.28Å; L962-V965 WeakPolarHBondContact O-CB 3.31Å; L962-V965 VanDerWaalsContact O-CG2 3.3Å; L962-V965 WeakPolarHBondContact O-CG2 3.37Å; L962-V965 PolarHBondContact O-N 3.16Å; L962-L991 HydrophobicContact CB-CD1 3.57Å; L962-L991 HydrophobicContact CD1-CD1 4.47Å; L962-L991 WeakPolarHBondContact O-CB 3.26Å; L962-L991 VanDerWaalsContact O-CD1 3.25Å; L962-L991 WeakPolarHBondContact O-CD1 3.21Å
963	S	70.3	Confident	81.5	Confident	25 Å²	25	39.5 Å²	39.5	18%	0.175	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	134.4	175.1	170.4	0	0	0	0	112.8	N960 H961 V965 D993	N960-S963 WeakPolarHBondContact O-CB 3.47Å; N960-S963 PolarHBondContact O-N 2.95Å; H961-S963 VanDerWaalsContact C-N 3.32Å; S963-V965 PolarHBondContact O-N 2.02Å; S963-D993 VanDerWaalsContact CB-OD1 3.27Å; S963-D993 WeakPolarHBondContact CB-OD1 3.5Å; S963-D993 WeakPolarHBondContact CB-OD2 3.44Å; S963-D993 VanDerWaalsContact OG-CB 3.27Å; S963-D993 WeakPolarHBondContact OG-CB 3.36Å; S963-D993 PolarHBondContact OG-OD1 2.91Å; S963-D993 PolarHBondContact OG-OD2 2.86Å
964	N	69.4	Low	81.9	Confident	49 Å²	49	38.6 Å²	38.6	26%	0.262	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	22	-179.2	-67.6	-31.2	0	0	0	114.6	N926 L962 L991	N926-N964 WeakPolarHBondContact ND2-CB 3.33Å; N926-N964 PolarHBondContact ND2-O 2.91Å; L962-N964 PolarHBondContact O-N 3.48Å; N964-L991 WeakPolarHBondContact CA-O 3.45Å; N964-L991 PolarHBondContact N-O 3.38Å
965	V	75.6	Confident	82.2	Confident	40 Å²	40	38.7 Å²	38.7	24%	0.242	20%	0.202	C	C	.	.			trans	-86.9	141.5	173.3	179.1	0	0	0	0	110.1	C937 L962 S963 H990 L991	C937-V965 VanDerWaalsContact SG-CG1 3.56Å; L962-V965 VanDerWaalsContact O-CB 3.28Å; L962-V965 WeakPolarHBondContact O-CB 3.31Å; L962-V965 VanDerWaalsContact O-CG2 3.3Å; L962-V965 WeakPolarHBondContact O-CG2 3.37Å; L962-V965 PolarHBondContact O-N 3.16Å; S963-V965 PolarHBondContact O-N 2.02Å; V965-H990 WeakPolarHBondContact O-CA 3.44Å; V965-L991 HydrophobicContact CB-CD1 4.49Å; V965-L991 PolarHBondContact O-N 3.49Å
966	T	75.8	Confident	82.5	Confident	30 Å²	30	40.3 Å²	40.3	18%	0.184	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	123.6	171.7	-47.2	0	0	0	0	109.7	L925 C988 L989 H990	L925-T966 HydrophobicContact CB-CG2 4.38Å; L925-T966 WeakPolarHBondContact CB-OG1 3.4Å; L925-T966 HydrophobicContact CD1-CG2 4.03Å; T966-C988 HydrophobicContact CG2-CB 4.2Å; T966-L989 CarbonylContact C-O 3.58Å; T966-L989 VanDerWaalsContact CA-O 3.3Å; T966-L989 WeakPolarHBondContact CA-O 3.35Å; T966-H990 HydrophobicContact CG2-CB 4.31Å; T966-H990 PolarHBondContact OG1-ND1 2.76Å
967	C	78.3	Confident	82.5	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.007	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	134.2	-177.5	-54.8	0	0	0	0	110.8	C937 L939 C988 L989	C937-C967 HydrophobicContact CB-CB 3.64Å; C937-C967 WeakPolarHBondContact CB-SG 3.46Å; C937-C967 WeakPolarHBondContact SG-CA 3.49Å; C937-C967 WeakPolarHBondContact SG-CB 3.38Å; C937-C967 CovalentContact SG-SG 2.03Å; C937-C967 PolarHBondContact SG-SG 3.13Å; L939-C967 HydrophobicContact CB-CB 4.5Å; L939-C967 HydrophobicContact CD2-CB 4.29Å; C967-C988 CarbonylContact O-C 3.56Å; C967-C988 WeakPolarHBondContact O-CA 3.21Å; C967-L989 PolarHBondContact N-O 2.84Å; C967-L989 PolarHBondContact O-N 2.88Å
968	R	84	Confident	82.6	Confident	69 Å²	69	39.5 Å²	39.5	26%	0.26	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	121.6	173.8	-170.8	176	-169.9	-133.4	9.8	109.6	D869 C922 F987	D869-R968 VanDerWaalsContact CG-NH2 3.27Å; D869-R968 IonicContact OD1-CZ 3.56Å; D869-R968 VanDerWaalsContact OD1-CZ 3.27Å; D869-R968 IonicContact OD1-NE 3.49Å; D869-R968 PolarHBondContact OD1-NE 2.82Å; D869-R968 IonicContact OD1-NH2 3.99Å; D869-R968 PolarHBondContact OD1-NH2 2.78Å; D869-R968 IonicContact OD2-CZ 3.08Å; D869-R968 IonicContact OD2-NE 3.09Å; D869-R968 IonicContact OD2-NH2 3.9Å; D869-R968 PolarHBondContact OD2-NH2 2.8Å; C922-R968 HydrophobicContact CB-CB 4.31Å; C922-R968 VanDerWaalsContact SG-CG 3.54Å; R968-F987 WeakPolarHBondContact CA-O 3.27Å
969	L	86.6	Confident	83	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	149.5	-173.7	-61.6	171.7	0	0	0	110.1	L904 E906 L943 Y986 F987 L989	L904-L969 HydrophobicContact CD1-CB 4.17Å; E906-L969 HydrophobicContact CG-CD2 3.68Å; L943-L969 HydrophobicContact CD1-CD1 3.43Å; L943-L969 VanDerWaalsContact CD1-CD1 3.43Å; L969-Y986 WeakPolarHBondContact O-CA 3.42Å; L969-F987 HydrophobicContact CB-CD1 4.11Å; L969-F987 HydrophobicContact CB-CE1 3.49Å; L969-F987 VanDerWaalsContact CB-CE1 3.49Å; L969-F987 HydrophobicContact CB-CE2 4.14Å; L969-F987 HydrophobicContact CB-CZ 3.51Å; L969-F987 HydrophobicContact CD1-CE1 4.44Å; L969-F987 HydrophobicContact CD1-CE2 3.88Å; L969-F987 HydrophobicContact CD1-CZ 3.59Å; L969-F987 HydrophobicContact CG-CZ 4.17Å; L969-F987 PolarHBondContact N-O 3.08Å; L969-F987 WeakPolarHBondContact O-CD1 3.46Å; L969-F987 PolarHBondContact O-N 2.91Å; L969-L989 HydrophobicContact CD1-CB 4.45Å; L969-L989 HydrophobicContact CD1-CD2 4.39Å
970	C	88.9	Confident	83.5	Confident	9 Å²	9	45.3 Å²	45.3	6%	0.061	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	129.1	177.7	179.7	0	0	0	0	109.8	L904 I905 R985 Y986	L904-C970 WeakPolarHBondContact CA-O 3.32Å; I905-C970 HydrophobicContact CB-CB 4.48Å; I905-C970 PolarHBondContact N-O 2.79Å; I905-C970 PolarHBondContact O-N 2.73Å; C970-R985 WeakPolarHBondContact CA-O 3.42Å; C970-Y986 HydrophobicContact CB-CD1 3.96Å; C970-Y986 HydrophobicContact CB-CE1 3.85Å
971	V	91.4	Very high	84.5	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	134.8	169.2	65.8	0	0	0	0	109.6	F862 F887 Y902 S903 L945 T984 R985	F862-V971 HydrophobicContact CE1-CG1 3.9Å; F862-V971 HydrophobicContact CZ-CG1 3.89Å; F887-V971 HydrophobicContact CD1-CG1 3.74Å; F887-V971 HydrophobicContact CD2-CB 4.38Å; F887-V971 HydrophobicContact CD2-CG1 4.38Å; F887-V971 HydrophobicContact CD2-CG2 3.91Å; F887-V971 HydrophobicContact CE1-CB 4.37Å; F887-V971 HydrophobicContact CE1-CG1 3.62Å; F887-V971 HydrophobicContact CE2-CB 4.17Å; F887-V971 HydrophobicContact CE2-CG1 4.28Å; F887-V971 HydrophobicContact CE2-CG2 4.13Å; F887-V971 HydrophobicContact CG-CG1 4.13Å; F887-V971 HydrophobicContact CG-CG2 4.18Å; F887-V971 HydrophobicContact CZ-CB 4.18Å; F887-V971 HydrophobicContact CZ-CG1 3.92Å; Y902-V971 HydrophobicContact CD1-CG2 4.34Å; S903-V971 CarbonylContact O-C 3.51Å; S903-V971 WeakPolarHBondContact O-CA 3.26Å; L945-V971 HydrophobicContact CD2-CG2 4.07Å; V971-T984 CarbonylContact O-C 3.51Å; V971-T984 WeakPolarHBondContact O-CA 3.48Å; V971-R985 HydrophobicContact CG1-CB 3.8Å; V971-R985 WeakPolarHBondContact CG1-O 3.43Å; V971-R985 PolarHBondContact N-O 2.8Å; V971-R985 PolarHBondContact O-N 2.83Å
972	V	93.7	Very high	85.3	Confident	12 Å²	12	39.6 Å²	39.6	7%	0.073	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	133.6	176	-174.4	0	0	0	0	108.3	Y902 S903 I905 N982 S983 T984	Y902-V972 CarbonylContact C-O 3.59Å; Y902-V972 VanDerWaalsContact CA-O 3.22Å; Y902-V972 WeakPolarHBondContact CA-O 3.41Å; S903-V972 PolarHBondContact N-O 2.93Å; S903-V972 PolarHBondContact O-N 3.33Å; I905-V972 HydrophobicContact CD1-CG2 3.59Å; I905-V972 HydrophobicContact CG1-CG2 4.29Å; V972-N982 HydrophobicContact CG1-CB 4.07Å; V972-S983 CarbonylContact C-O 3.59Å; V972-S983 WeakPolarHBondContact CA-O 3.47Å; V972-T984 HydrophobicContact CB-CG2 4.41Å; V972-T984 HydrophobicContact CG1-CG2 4.16Å; V972-T984 HydrophobicContact CG2-CG2 3.91Å
973	A	94.1	Very high	86.2	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	116.5	168.6	0	0	0	0	0	108.3	P860 F862 A889 I900 Y902 N982 S983	P860-A973 HydrophobicContact CB-CB 4.33Å; F862-A973 HydrophobicContact CE1-CB 4.19Å; F862-A973 HydrophobicContact CE2-CB 3.83Å; F862-A973 HydrophobicContact CZ-CB 3.57Å; A889-A973 HydrophobicContact CB-CB 3.97Å; I900-A973 HydrophobicContact CG2-CB 3.88Å; Y902-A973 HydrophobicContact CD1-CB 4.01Å; Y902-A973 HydrophobicContact CE1-CB 3.97Å; A973-N982 CarbonylContact O-C 3.59Å; A973-N982 VanDerWaalsContact O-CA 3.23Å; A973-N982 WeakPolarHBondContact O-CA 3.12Å; A973-N982 WeakPolarHBondContact O-CB 3.47Å; A973-S983 PolarHBondContact N-O 3.39Å; A973-S983 PolarHBondContact O-N 3.34Å
974	S	94.5	Very high	87.1	Confident	25 Å²	25	42.9 Å²	42.9	18%	0.175	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	142.6	176.2	-58.1	0	0	0	0	109.9	I900 K901 L981 N982	I900-S974 CarbonylContact C-O 3.48Å; I900-S974 WeakPolarHBondContact CA-O 3.12Å; K901-S974 PolarHBondContact N-O 3.29Å; K901-S974 PolarHBondContact O-N 3.11Å; S974-L981 WeakPolarHBondContact CA-O 3.49Å; S974-N982 WeakPolarHBondContact OG-CB 3.1Å
975	D	91.8	Very high	88	Confident	4 Å²	4	42.1 Å²	42.1	2%	0.021	24%	0.236	C	C	.	.			trans	-67.6	-179	164.5	63.2	35.6	0	0	0	111.3	N856 P860 N897 K899 G977 S980 L981	N856-D975 PolarHBondContact ND2-OD2 2.63Å; N856-D975 PolarHBondContact OD1-OD2 2.85Å; P860-D975 HydrophobicContact CG-CB 4.12Å; N897-D975 WeakPolarHBondContact O-CB 3.31Å; K899-D975 CarbonylContact O-C 3.54Å; K899-D975 VanDerWaalsContact O-C 3.3Å; K899-D975 WeakPolarHBondContact O-CA 3.36Å; D975-G977 PolarHBondContact OD1-N 3.4Å; D975-G977 VanDerWaalsContact OD1-N 3.11Å; D975-S980 PolarHBondContact O-OG 3.11Å; D975-S980 VanDerWaalsContact O-OG 3.13Å; D975-S980 WeakPolarHBondContact OD1-CA 3.47Å; D975-S980 VanDerWaalsContact OD1-CB 3.24Å; D975-S980 WeakPolarHBondContact OD1-CB 3.22Å; D975-S980 PolarHBondContact OD1-OG 3.3Å; D975-L981 VanDerWaalsContact CG-N 3.25Å; D975-L981 PolarHBondContact N-O 3.37Å; D975-L981 PolarHBondContact OD1-N 3.15Å; D975-L981 VanDerWaalsContact OD2-CA 3.3Å; D975-L981 WeakPolarHBondContact OD2-CA 3.32Å; D975-L981 WeakPolarHBondContact OD2-CB 3.41Å; D975-L981 PolarHBondContact OD2-N 2.91Å
976	M	90.1	Very high	88.6	Confident	83 Å²	83	44 Å²	44	41%	0.409	24%	0.239	S	C	.	.	S	Bend	trans	-113.4	19.7	170.9	-68.2	-173.1	137.2	0	0	112.4	L896 K899 K901	L896-M976 HydrophobicContact CB-CB 4.37Å; L896-M976 HydrophobicContact CD2-CB 4.33Å; L896-M976 CarbonylContact O-C 3.54Å; L896-M976 VanDerWaalsContact O-C 3.29Å; L896-M976 VanDerWaalsContact O-CA 3.32Å; L896-M976 WeakPolarHBondContact O-CA 3.29Å; L896-M976 VanDerWaalsContact O-CB 3.32Å; L896-M976 WeakPolarHBondContact O-CB 3.37Å; L896-M976 PolarHBondContact O-N 3.01Å; L896-M976 VanDerWaalsContact O-N 3.08Å; K899-M976 HydrophobicContact CB-CB 4.33Å; K899-M976 HydrophobicContact CB-CG 4.36Å; K899-M976 HydrophobicContact CB-SD 4.33Å; K899-M976 HydrophobicContact CD-SD 3.71Å; K899-M976 HydrophobicContact CG-CG 4.43Å; K899-M976 HydrophobicContact CG-SD 3.87Å; K899-M976 WeakPolarHBondContact O-CG 3.44Å; K899-M976 PolarHBondContact O-N 2.8Å; K899-M976 VanDerWaalsContact O-N 3.09Å; K901-M976 HydrophobicContact CB-CE 4.47Å; K901-M976 HydrophobicContact CD-CE 4.21Å
977	G	83.8	Confident	89.1	Confident	6 Å²	6	42.6 Å²	42.6	6%	0.062	23%	0.231	C	C	.	.	S	Bend	trans	-77.6	171.6	179.6	0	0	0	0	0	113.6	L896 N897 D975 P979 S980	L896-G977 PolarHBondContact O-N 3.49Å; N897-G977 VanDerWaalsContact OD1-CA 3.3Å; N897-G977 WeakPolarHBondContact OD1-CA 3.47Å; D975-G977 PolarHBondContact OD1-N 3.4Å; D975-G977 VanDerWaalsContact OD1-N 3.11Å; G977-P979 CarbonylContact O-C 3.6Å; G977-S980 WeakPolarHBondContact O-CA 3.47Å; G977-S980 WeakPolarHBondContact O-CB 3.35Å; G977-S980 PolarHBondContact O-N 3.36Å; G977-S980 VanDerWaalsContact O-N 3.13Å
978	I	84.6	Confident	89.3	Confident	163 Å²	163	42.5 Å²	42.5	84%	0.836	23%	0.23	S	C	*	.	S	Bend	trans	-125	112.5	174.2	-58.8	176.6	0	0	0	108.5
979	P	87.2	Confident	89.3	Confident	93 Å²	93	39.2 Å²	39.2	60%	0.604	22%	0.218	S	C	*	.	S	Bend	cis	-73.2	146.3	-2.7	32.5	-34.7	0	0	0	111.8	N856 G977	N856-P979 PolarHBondContact ND2-O 2.55Å; G977-P979 CarbonylContact O-C 3.6Å
980	S	90.3	Very high	89.1	Confident	63 Å²	63	39.4 Å²	39.4	44%	0.441	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-75.1	131.5	-179.8	178.1	0	0	0	0	112.2	D975 G977	D975-S980 PolarHBondContact O-OG 3.11Å; D975-S980 VanDerWaalsContact O-OG 3.13Å; D975-S980 WeakPolarHBondContact OD1-CA 3.47Å; D975-S980 VanDerWaalsContact OD1-CB 3.24Å; D975-S980 WeakPolarHBondContact OD1-CB 3.22Å; D975-S980 PolarHBondContact OD1-OG 3.3Å; G977-S980 WeakPolarHBondContact O-CA 3.47Å; G977-S980 WeakPolarHBondContact O-CB 3.35Å; G977-S980 PolarHBondContact O-N 3.36Å; G977-S980 VanDerWaalsContact O-N 3.13Å
981	L	93.3	Very high	88.6	Confident	55 Å²	55	39 Å²	39	29%	0.288	22%	0.216	S	C	.	.	P	Polyproline II helix	trans	-103.6	151.3	175.7	-50.8	173.9	0	0	0	110	E858 A859 S974 D975	E858-L981 WeakPolarHBondContact O-CD1 3.46Å; A859-L981 HydrophobicContact CB-CB 3.7Å; A859-L981 HydrophobicContact CB-CD1 4.4Å; S974-L981 WeakPolarHBondContact CA-O 3.49Å; D975-L981 VanDerWaalsContact CG-N 3.25Å; D975-L981 PolarHBondContact N-O 3.37Å; D975-L981 PolarHBondContact OD1-N 3.15Å; D975-L981 VanDerWaalsContact OD2-CA 3.3Å; D975-L981 WeakPolarHBondContact OD2-CA 3.32Å; D975-L981 WeakPolarHBondContact OD2-CB 3.41Å; D975-L981 PolarHBondContact OD2-N 2.91Å
982	N	93	Very high	87.7	Confident	95 Å²	95	39.9 Å²	39.9	51%	0.508	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	160.2	-175.8	70.1	41.8	0	0	0	114	V972 A973 S974	V972-N982 HydrophobicContact CG1-CB 4.07Å; A973-N982 CarbonylContact O-C 3.59Å; A973-N982 VanDerWaalsContact O-CA 3.23Å; A973-N982 WeakPolarHBondContact O-CA 3.12Å; A973-N982 WeakPolarHBondContact O-CB 3.47Å; S974-N982 WeakPolarHBondContact OG-CB 3.1Å
983	S	92.5	Very high	86.2	Confident	30 Å²	30	42.5 Å²	42.5	21%	0.21	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	156.3	169.3	65.6	0	0	0	0	111.1	P860 F862 V972 A973	P860-S983 WeakPolarHBondContact O-CB 3.35Å; P860-S983 PolarHBondContact O-OG 2.79Å; F862-S983 WeakPolarHBondContact CD2-OG 3.48Å; F862-S983 WeakPolarHBondContact CE2-OG 3.34Å; V972-S983 CarbonylContact C-O 3.59Å; V972-S983 WeakPolarHBondContact CA-O 3.47Å; A973-S983 PolarHBondContact N-O 3.39Å; A973-S983 PolarHBondContact O-N 3.34Å
984	T	90.8	Very high	84.3	Confident	74 Å²	74	46.7 Å²	46.7	45%	0.454	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	153	-173.7	61.7	0	0	0	0	112.8	V971 V972	V971-T984 CarbonylContact O-C 3.51Å; V971-T984 WeakPolarHBondContact O-CA 3.48Å; V972-T984 HydrophobicContact CB-CG2 4.41Å; V972-T984 HydrophobicContact CG1-CG2 4.16Å; V972-T984 HydrophobicContact CG2-CG2 3.91Å
985	R	88	Confident	82.2	Confident	33 Å²	33	52.5 Å²	52.5	13%	0.125	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	134.9	179.8	-163.5	144.4	-141.3	149.6	29.4	113	F862 P865 I866 Q867 D868 C970 V971	F862-R985 VanDerWaalsContact CB-NH1 3.28Å; F862-R985 HydrophobicContact CD1-CB 4.43Å; F862-R985 HydrophobicContact CD2-CB 4.08Å; F862-R985 HydrophobicContact CE1-CB 4.28Å; F862-R985 HydrophobicContact CE2-CB 3.92Å; F862-R985 HydrophobicContact CG-CB 4.34Å; F862-R985 HydrophobicContact CZ-CB 4.02Å; F862-R985 PolarHBondContact O-NH1 2.79Å; P865-R985 HydrophobicContact CG-CG 4.48Å; P865-R985 PolarHBondContact O-NE 2.84Å; P865-R985 PolarHBondContact O-NH1 2.89Å; I866-R985 VanDerWaalsContact O-CZ 3.28Å; I866-R985 PolarHBondContact O-NH1 3.24Å; I866-R985 PolarHBondContact O-NH2 3.2Å; Q867-R985 PolarHBondContact O-NE 2.89Å; D868-R985 WeakPolarHBondContact OD1-CG 3.18Å; D868-R985 IonicContact OD1-CZ 2.74Å; D868-R985 IonicContact OD1-NE 2.71Å; D868-R985 PolarHBondContact OD1-NE 2.84Å; D868-R985 IonicContact OD1-NH2 3.66Å; D868-R985 PolarHBondContact OD1-NH2 3.19Å; C970-R985 WeakPolarHBondContact CA-O 3.42Å; V971-R985 HydrophobicContact CG1-CB 3.8Å; V971-R985 WeakPolarHBondContact CG1-O 3.43Å; V971-R985 PolarHBondContact N-O 2.8Å; V971-R985 PolarHBondContact O-N 2.83Å
986	Y	86.9	Confident	80	Confident	78 Å²	78	57.6 Å²	57.6	31%	0.306	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	146.1	-179.6	-65.1	-89	0	0	0	112.9	D869 L969 C970	D869-Y986 PolarHBondContact N-O 3.07Å; D869-Y986 WeakPolarHBondContact OD1-CB 3.43Å; L969-Y986 WeakPolarHBondContact O-CA 3.42Å; C970-Y986 HydrophobicContact CB-CD1 3.96Å; C970-Y986 HydrophobicContact CB-CE1 3.85Å
987	F	86.3	Confident	77.8	Confident	1 Å²	1	58 Å²	58	0%	0.004	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	158.7	172.6	72.4	-79.1	0	0	0	112.1	Y872 F887 L904 L952 R968 L969 L989	Y872-F987 HydrophobicContact CD2-CB 4.46Å; Y872-F987 HydrophobicContact CD2-CD2 4Å; Y872-F987 HydrophobicContact CE2-CB 4.37Å; F887-F987 HydrophobicContact CE1-CD1 4.24Å; F887-F987 HydrophobicContact CE2-CE1 4.29Å; F887-F987 AromaticContact CZ-CD1 3.72Å; F887-F987 HydrophobicContact CZ-CD1 3.72Å; F887-F987 AromaticContact CZ-CE1 3.6Å; F887-F987 HydrophobicContact CZ-CE1 3.6Å; F887-F987 HydrophobicContact CZ-CG 4.3Å; F887-F987 HydrophobicContact CZ-CZ 4.1Å; L904-F987 HydrophobicContact CD1-CE1 3.7Å; L904-F987 HydrophobicContact CD1-CZ 3.9Å; L952-F987 HydrophobicContact CD2-CE2 3.78Å; L952-F987 HydrophobicContact CD2-CZ 3.51Å; R968-F987 WeakPolarHBondContact CA-O 3.27Å; L969-F987 HydrophobicContact CB-CD1 4.11Å; L969-F987 HydrophobicContact CB-CE1 3.49Å; L969-F987 VanDerWaalsContact CB-CE1 3.49Å; L969-F987 HydrophobicContact CB-CE2 4.14Å; L969-F987 HydrophobicContact CB-CZ 3.51Å; L969-F987 HydrophobicContact CD1-CE1 4.44Å; L969-F987 HydrophobicContact CD1-CE2 3.88Å; L969-F987 HydrophobicContact CD1-CZ 3.59Å; L969-F987 HydrophobicContact CG-CZ 4.17Å; L969-F987 PolarHBondContact N-O 3.08Å; L969-F987 WeakPolarHBondContact O-CD1 3.46Å; L969-F987 PolarHBondContact O-N 2.91Å; F987-L989 HydrophobicContact CE2-CB 4.46Å
988	C	82.8	Confident	75.8	Confident	0 Å²	0	61 Å²	61	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	141.6	175.6	-36	0	0	0	0	111	I870 I871 Y872 C922 T966 C967	I870-C988 PolarHBondContact O-N 3.26Å; I871-C988 WeakPolarHBondContact CA-O 3.08Å; I871-C988 HydrophobicContact CB-CB 4.32Å; I871-C988 HydrophobicContact CG1-CB 3.77Å; Y872-C988 PolarHBondContact N-O 3.44Å; C922-C988 WeakPolarHBondContact CA-SG 3.09Å; C922-C988 HydrophobicContact CB-CB 3.89Å; C922-C988 WeakPolarHBondContact CB-SG 3.29Å; C922-C988 PolarHBondContact N-SG 3.04Å; C922-C988 WeakPolarHBondContact SG-CB 3.42Å; C922-C988 CovalentContact SG-SG 2.02Å; C922-C988 PolarHBondContact SG-SG 2.99Å; T966-C988 HydrophobicContact CG2-CB 4.2Å; C967-C988 CarbonylContact O-C 3.56Å; C967-C988 WeakPolarHBondContact O-CA 3.21Å
989	L	85.4	Confident	73.8	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	116.7	173.9	-171.9	60	0	0	0	110.2	Y872 I874 I884 L939 L943 T966 C967 L969 F987 L991	Y872-L989 CarbonylContact O-C 3.43Å; Y872-L989 WeakPolarHBondContact O-CA 2.99Å; I874-L989 HydrophobicContact CD1-CD1 4.46Å; I874-L989 HydrophobicContact CD1-CD2 4.49Å; I874-L989 HydrophobicContact CG2-CD1 3.61Å; I884-L989 HydrophobicContact CD1-CD1 4.31Å; I884-L989 HydrophobicContact CD1-CD2 3.87Å; I884-L989 HydrophobicContact CG2-CD1 3.68Å; L939-L989 HydrophobicContact CD2-CB 4.46Å; L939-L989 HydrophobicContact CD2-CD2 3.37Å; L939-L989 HydrophobicContact CD2-CG 4.13Å; L943-L989 HydrophobicContact CD1-CD2 4.05Å; L943-L989 HydrophobicContact CD2-CD2 4Å; T966-L989 CarbonylContact C-O 3.58Å; T966-L989 VanDerWaalsContact CA-O 3.3Å; T966-L989 WeakPolarHBondContact CA-O 3.35Å; C967-L989 PolarHBondContact N-O 2.84Å; C967-L989 PolarHBondContact O-N 2.88Å; L969-L989 HydrophobicContact CD1-CB 4.45Å; L969-L989 HydrophobicContact CD1-CD2 4.39Å; F987-L989 HydrophobicContact CE2-CB 4.46Å; L989-L991 HydrophobicContact CG-CD2 4.37Å
990	H	80.7	Confident	71.7	Confident	4 Å²	4	57 Å²	57	2%	0.019	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	127.4	-177.6	-175.5	64.4	0	0	0	111	I871 Y872 T873 I874 V965 T966	I871-H990 HydrophobicContact CG2-CB 4.41Å; Y872-H990 PolarHBondContact O-N 3.04Å; T873-H990 CarbonylContact C-O 3.52Å; T873-H990 VanDerWaalsContact CA-O 3.27Å; T873-H990 WeakPolarHBondContact CA-O 3.46Å; T873-H990 HydrophobicContact CG2-CB 4.43Å; I874-H990 PolarHBondContact N-O 3.45Å; V965-H990 WeakPolarHBondContact O-CA 3.44Å; T966-H990 HydrophobicContact CG2-CB 4.31Å; T966-H990 PolarHBondContact OG1-ND1 2.76Å
991	L	79.8	Confident	69.2	Low	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	132.3	-176.4	-51.4	-177.5	0	0	0	111.1	I874 M876 L939 L958 L962 N964 V965 L989	I874-L991 HydrophobicContact CD1-CD2 3.41Å; I874-L991 VanDerWaalsContact CD1-CD2 3.41Å; I874-L991 HydrophobicContact CG1-CD2 3.31Å; I874-L991 CarbonylContact O-C 3.54Å; I874-L991 WeakPolarHBondContact O-CA 3.41Å; M876-L991 HydrophobicContact SD-CB 3.71Å; M876-L991 HydrophobicContact SD-CD1 4.18Å; L939-L991 HydrophobicContact CD1-CD1 3.66Å; L958-L991 HydrophobicContact CD1-CD2 4.01Å; L958-L991 HydrophobicContact CD2-CD1 4.08Å; L958-L991 HydrophobicContact CD2-CD2 4.32Å; L962-L991 HydrophobicContact CB-CD1 3.57Å; L962-L991 HydrophobicContact CD1-CD1 4.47Å; L962-L991 WeakPolarHBondContact O-CB 3.26Å; L962-L991 VanDerWaalsContact O-CD1 3.25Å; L962-L991 WeakPolarHBondContact O-CD1 3.21Å; N964-L991 WeakPolarHBondContact CA-O 3.45Å; N964-L991 PolarHBondContact N-O 3.38Å; V965-L991 HydrophobicContact CB-CD1 4.49Å; V965-L991 PolarHBondContact O-N 3.49Å; L989-L991 HydrophobicContact CG-CD2 4.37Å
992	M	71.1	Confident	66.6	Low	18 Å²	18	63.1 Å²	63.1	9%	0.089	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	135.4	-175.9	-57.5	-167	100.2	0	0	113.8	T873 I874 S875 M876 T994 Q999 I1003	T873-M992 HydrophobicContact CG2-CG 3.61Å; T873-M992 HydrophobicContact CG2-SD 3.43Å; T873-M992 WeakPolarHBondContact CG2-SD 3.37Å; I874-M992 PolarHBondContact O-N 3.28Å; S875-M992 CarbonylContact C-O 3.55Å; S875-M992 WeakPolarHBondContact CA-O 3.45Å; M876-M992 WeakPolarHBondContact CG-O 3.26Å; M876-M992 PolarHBondContact N-O 2.91Å; M992-T994 PolarHBondContact O-N 3.27Å; M992-Q999 HydrophobicContact CE-CB 3.8Å; M992-I1003 HydrophobicContact CE-CD1 3.27Å; M992-I1003 HydrophobicContact CE-CG1 4.28Å; M992-I1003 HydrophobicContact SD-CD1 3.42Å; M992-I1003 WeakPolarHBondContact SD-CD1 3.18Å
993	D	62.3	Low	64.1	Low	68 Å²	68	59.7 Å²	59.7	36%	0.364	31%	0.309	S	S	.	.	S	Bend	trans	-74.6	-13.1	-166.7	-118.1	-5.1	0	0	0	117.5	M876 S963	M876-D993 WeakPolarHBondContact CG-OD1 3.13Å; S963-D993 VanDerWaalsContact CB-OD1 3.27Å; S963-D993 WeakPolarHBondContact CB-OD1 3.5Å; S963-D993 WeakPolarHBondContact CB-OD2 3.44Å; S963-D993 VanDerWaalsContact OG-CB 3.27Å; S963-D993 WeakPolarHBondContact OG-CB 3.36Å; S963-D993 PolarHBondContact OG-OD1 2.91Å; S963-D993 PolarHBondContact OG-OD2 2.86Å
994	T	55.3	Low	61.7	Low	88 Å²	88	62.3 Å²	62.3	54%	0.54	33%	0.327	S	S	.	.	S	Bend	trans	175.4	158.8	178.3	16.2	0	0	0	0	107.6	M992 E996	M992-T994 PolarHBondContact O-N 3.27Å; T994-E996 PolarHBondContact O-N 3.46Å
995	I	51.2	Low	59.3	Low	146 Å²	146	62.4 Å²	62.4	75%	0.749	33%	0.331	S	S	*	.			trans	-72.4	72.4	175.4	-53.8	169.3	0	0	0	108.6	S997 L1000	I995-S997 PolarHBondContact O-N 3.01Å; I995-L1000 HydrophobicContact CG2-CD1 4.04Å
996	E	45.3	Very low	57.2	Low	112 Å²	112	64.7 Å²	64.7	52%	0.523	34%	0.343	S	S	.	.			trans	-81.3	107.4	160.3	-120.1	-170.4	-162.6	0	0	106.9	T994 S998 Q999	T994-E996 PolarHBondContact O-N 3.46Å; E996-S998 WeakPolarHBondContact CB-OG 3.4Å; E996-S998 WeakPolarHBondContact CG-OG 3.34Å; E996-S998 PolarHBondContact O-N 2.87Å; E996-S998 PolarHBondContact OE2-OG 3.35Å; E996-Q999 HydrophobicContact CB-CG 4.25Å; E996-Q999 PolarHBondContact O-N 2.95Å
997	S	42.9	Very low	54.8	Low	91 Å²	91	64.6 Å²	64.6	64%	0.636	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-12.9	176.9	36.4	0	0	0	0	113.6	I995	I995-S997 PolarHBondContact O-N 3.01Å
998	S	42.1	Very low	52.2	Low	68 Å²	68	71.3 Å²	71.3	48%	0.476	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-32.4	168.9	40.8	0	0	0	0	114	E996	E996-S998 WeakPolarHBondContact CB-OG 3.4Å; E996-S998 WeakPolarHBondContact CG-OG 3.34Å; E996-S998 PolarHBondContact O-N 2.87Å; E996-S998 PolarHBondContact OE2-OG 3.35Å
999	Q	43.2	Very low	49.8	Very low	78 Å²	78	78 Å²	78	36%	0.364	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-29.6	-177.2	-65.7	-87.5	-20.7	0	0	112.3	M992 E996 K1001 W1002	M992-Q999 HydrophobicContact CE-CB 3.8Å; E996-Q999 HydrophobicContact CB-CG 4.25Å; E996-Q999 PolarHBondContact O-N 2.95Å; Q999-K1001 VanDerWaalsContact C-N 3.26Å; Q999-K1001 PolarHBondContact O-N 3.35Å; Q999-W1002 PolarHBondContact O-N 3.15Å; Q999-W1002 VanDerWaalsContact O-N 3.11Å
1000	L	42.9	Very low	47.1	Very low	94 Å²	94	83.8 Å²	83.8	49%	0.492	45%	0.453	S	S	.	.	H	α-helix	trans	-65.1	-23.2	176.9	-80.8	157.8	0	0	0	114.1	I995 W1002 S1004	I995-L1000 HydrophobicContact CG2-CD1 4.04Å; L1000-W1002 VanDerWaalsContact C-N 3.33Å; L1000-S1004 PolarHBondContact O-OG 2.62Å; L1000-S1004 VanDerWaalsContact O-OG 3.04Å
1001	K	37.7	Very low	44.7	Very low	145 Å²	145	91.1 Å²	91.1	63%	0.63	49%	0.488	S	S	*	.	H	α-helix	trans	-74.4	-20.6	173.7	-83.2	-178.9	176.3	175.2	0	113.7	Q999 S1004	Q999-K1001 VanDerWaalsContact C-N 3.26Å; Q999-K1001 PolarHBondContact O-N 3.35Å; K1001-S1004 PolarHBondContact O-OG 3.16Å
1002	W	38.5	Very low	42.4	Very low	102 Å²	102	101 Å²	101	39%	0.386	53%	0.526	S	S	.	.	H	α-helix	trans	-82.7	-37.8	178.2	-172.9	71.6	0	0	0	111.6	L925 Q999 L1000 S1005	L925-W1002 HydrophobicContact CD2-CE3 4.24Å; L925-W1002 HydrophobicContact CD2-CH2 3.96Å; L925-W1002 HydrophobicContact CD2-CZ3 3.47Å; L925-W1002 VanDerWaalsContact CD2-CZ3 3.47Å; L925-W1002 WeakPolarHBondContact O-CH2 3.18Å; L925-W1002 WeakPolarHBondContact O-CZ3 3.43Å; Q999-W1002 PolarHBondContact O-N 3.15Å; Q999-W1002 VanDerWaalsContact O-N 3.11Å; L1000-W1002 VanDerWaalsContact C-N 3.33Å; W1002-S1005 PolarHBondContact O-N 2.03Å; W1002-S1005 VanDerWaalsContact O-N 3.15Å; W1002-S1005 PolarHBondContact O-OG 3.32Å
1003	I	41.4	Very low	40.4	Very low	24 Å²	24	104.5 Å²	104.5	12%	0.123	55%	0.553	C	S	.	*	H	α-helix	trans	-70.3	-34.2	-179.6	-65.6	179.8	0	0	0	112.6	T873 M992 S1005 Q1006 T1007	T873-I1003 HydrophobicContact CG2-CD1 4.26Å; M992-I1003 HydrophobicContact CE-CD1 3.27Å; M992-I1003 HydrophobicContact CE-CG1 4.28Å; M992-I1003 HydrophobicContact SD-CD1 3.42Å; M992-I1003 WeakPolarHBondContact SD-CD1 3.18Å; I1003-S1005 PolarHBondContact O-N 2.88Å; I1003-Q1006 PolarHBondContact O-N 2.89Å; I1003-T1007 PolarHBondContact O-OG1 3.16Å
1004	S	41.8	Very low	39	Very low	85 Å²	85	106.1 Å²	106.1	59%	0.594	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	-10.2	173.3	45	0	0	0	0	113.8	L1000 K1001	L1000-S1004 PolarHBondContact O-OG 2.62Å; L1000-S1004 VanDerWaalsContact O-OG 3.04Å; K1001-S1004 PolarHBondContact O-OG 3.16Å
1005	S	40.1	Very low	38.1	Very low	75 Å²	75	109 Å²	109	52%	0.524	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.2	-10.1	179.5	80.2	0	0	0	0	114.8	W1002 I1003	W1002-S1005 PolarHBondContact O-N 2.03Å; W1002-S1005 VanDerWaalsContact O-N 3.15Å; W1002-S1005 PolarHBondContact O-OG 3.32Å; I1003-S1005 PolarHBondContact O-N 2.88Å
1006	Q	43.6	Very low	37.5	Very low	81 Å²	81	111.8 Å²	111.8	38%	0.379	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-112.8	-7.1	-172	-79.7	-90.4	-40.5	0	0	114.5	N924 I1003	N924-Q1006 VanDerWaalsContact CB-OE1 3.28Å; I1003-Q1006 PolarHBondContact O-N 2.89Å
1007	T	36.8	Very low	37.1	Very low	77 Å²	77	112.5 Å²	112.5	47%	0.472	59%	0.586	S	S	.	*	S	Bend	trans	-100.8	10.4	-177.6	48.6	0	0	0	0	115	I871 I1003	I871-T1007 HydrophobicContact CD1-CG2 3.96Å; I1003-T1007 PolarHBondContact O-OG1 3.16Å
1008	N	31.7	Very low	37	Very low	142 Å²	142	117.3 Å²	117.3	76%	0.759	59%	0.592	S	S	*	*	S	Bend	trans	-126.6	71.9	169.8	-85.7	-24.9	0	0	0	109.4
1009	N	31.4	Very low	36.7	Very low	140 Å²	140	118 Å²	118	75%	0.749	59%	0.593	S	S	*	*			trans	-161.8	132.2	156.7	-91.9	-24.9	0	0	0	110.1
1010	N	29.8	Very low	37	Very low	121 Å²	121	121.1 Å²	121.1	65%	0.647	61%	0.611	S	S	*	*			trans	87.4	91.9	167.3	-59.6	10.1	0	0	0	115.7
1011	E	30.6	Very low	37.3	Very low	159 Å²	159	121.7 Å²	121.7	74%	0.743	62%	0.618	S	S	*	*				87.3	90.3	75.1	-82.9	176.1	167.8	0	0	110.5
1012	Y	31.5	Very low	37.5	Very low	206 Å²	206	115.5 Å²	115.5	81%	0.808	60%	0.596	S	S	*	*				-143.3	97	129.6	-88.8	-73.4	0	0	0	109.2	S918	S918-Y1012 PolarHBondContact OG-OH 3.36Å; S918-Y1012 VanDerWaalsContact OG-OH 3.13Å
1013	S	29.1	Very low	38	Very low	92 Å²	92	113.6 Å²	113.6	64%	0.643	60%	0.602	S	S	*	*			trans	-57.1	156.2	144	128.6	0	0	0	0	109.2
1014	P	32.7	Very low	38.5	Very low	102 Å²	102	117.2 Å²	117.2	66%	0.662	62%	0.62	S	S	*	*			cis	-140	148.5	41.6	34.5	-14.6	0	0	0	115.4
1015	I	36	Very low	38.9	Very low	149 Å²	149	114 Å²	114	76%	0.764	60%	0.601	S	S	*	*			trans	177.4	65	132.4	-81.7	149.6	0	0	0	103.5	I1017	I1015-I1017 WeakPolarHBondContact CG2-O 3.49Å
1016	Y	38.3	Very low	39.6	Very low	205 Å²	205	115.2 Å²	115.2	80%	0.804	60%	0.6	S	S	*	*				-9.4	116.2	81.7	-102.5	-92	0	0	0	114.6
1017	I	38.2	Very low	40.3	Very low	127 Å²	127	115.6 Å²	115.6	65%	0.651	61%	0.612	S	S	*	*	S	Bend	trans	87.9	68.6	-164.6	-44.9	155.3	0	0	0	109.6	I1015	I1015-I1017 WeakPolarHBondContact CG2-O 3.49Å
1018	Y	39.1	Very low	41.3	Very low	192 Å²	192	116.3 Å²	116.3	75%	0.753	61%	0.612	S	S	*	*	S	Bend		-157.8	12.3	98.1	-104.4	-71.6	0	0	0	114.7	T1021	Y1018-T1021 PolarHBondContact O-OG1 3.21Å
1019	T	36.9	Very low	42.5	Very low	83 Å²	83	114.1 Å²	114.1	51%	0.509	60%	0.599	S	S	.	*			trans	-136	53.3	179.7	49.3	0	0	0	0	117.5	T1021 G1022 A1023	T1019-T1021 WeakPolarHBondContact CG2-OG1 3.34Å; T1019-T1021 PolarHBondContact O-N 2.89Å; T1019-T1021 VanDerWaalsContact O-N 3.11Å; T1019-G1022 VanDerWaalsContact CG2-CA 3.45Å; T1019-G1022 PolarHBondContact O-N 3.41Å; T1019-A1023 PolarHBondContact O-N 2.83Å
1020	I	48.2	Very low	43.6	Very low	142 Å²	142	112 Å²	112	73%	0.728	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn		-55.2	11.4	122.9	-79.7	174.2	0	0	0	112.1	I1024	I1020-I1024 HydrophobicContact CG2-CD1 4.5Å
1021	T	49.2	Very low	45.2	Very low	107 Å²	107	108.9 Å²	108.9	66%	0.656	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.3	14.9	178.5	59.8	0	0	0	0	113	Y1018 T1019	Y1018-T1021 PolarHBondContact O-OG1 3.21Å; T1019-T1021 WeakPolarHBondContact CG2-OG1 3.34Å; T1019-T1021 PolarHBondContact O-N 2.89Å; T1019-T1021 VanDerWaalsContact O-N 3.11Å
1022	G	43.5	Very low	46.7	Very low	15 Å²	15	105.1 Å²	105.1	16%	0.155	56%	0.559	C	S	.	*	T	Hydrogen-bonded Turn	trans	-159.4	-18.8	-175.1	0	0	0	0	0	115.3	T1019 G1025 I1026	T1019-G1022 VanDerWaalsContact CG2-CA 3.45Å; T1019-G1022 PolarHBondContact O-N 3.41Å; G1022-G1025 VanDerWaalsContact C-N 3.32Å; G1022-G1025 CarbonylContact O-C 3.57Å; G1022-G1025 WeakPolarHBondContact O-CA 3.31Å; G1022-G1025 PolarHBondContact O-N 3.37Å; G1022-I1026 VanDerWaalsContact O-CB 3.24Å; G1022-I1026 WeakPolarHBondContact O-CB 3.49Å; G1022-I1026 WeakPolarHBondContact O-CD1 3.49Å; G1022-I1026 WeakPolarHBondContact O-CG1 3.43Å; G1022-I1026 PolarHBondContact O-N 3.23Å
1023	A	48.3	Very low	47.8	Very low	62 Å²	62	97.5 Å²	97.5	51%	0.512	53%	0.534	S	S	.	.	H	α-helix	trans	-97.3	-22.6	159.2	0	0	0	0	0	112.3	T1019 S1027	T1019-A1023 PolarHBondContact O-N 2.83Å; A1023-S1027 WeakPolarHBondContact O-CA 3.3Å; A1023-S1027 WeakPolarHBondContact O-CB 3.37Å; A1023-S1027 PolarHBondContact O-N 3.19Å
1024	I	51.1	Low	49.2	Very low	99 Å²	99	101 Å²	101	51%	0.508	54%	0.538	S	S	.	.	H	α-helix	trans	-63	-36.5	148.6	-65.7	-179.7	0	0	0	108.2	I1020 L1028	I1020-I1024 HydrophobicContact CG2-CD1 4.5Å; I1024-L1028 HydrophobicContact CG2-CD1 3.45Å; I1024-L1028 VanDerWaalsContact CG2-CD1 3.45Å; I1024-L1028 WeakPolarHBondContact O-CA 3.36Å; I1024-L1028 WeakPolarHBondContact O-CB 3.36Å; I1024-L1028 VanDerWaalsContact O-CD1 3.24Å; I1024-L1028 WeakPolarHBondContact O-CD1 3.49Å; I1024-L1028 PolarHBondContact O-N 2.92Å
1025	G	51.9	Low	50.4	Low	18 Å²	18	102 Å²	102	19%	0.186	54%	0.538	C	S	.	.	H	α-helix	trans	-66.3	-39	172.6	0	0	0	0	0	114.3	G1022 I1029	G1022-G1025 VanDerWaalsContact C-N 3.32Å; G1022-G1025 CarbonylContact O-C 3.57Å; G1022-G1025 WeakPolarHBondContact O-CA 3.31Å; G1022-G1025 PolarHBondContact O-N 3.37Å; G1025-I1029 WeakPolarHBondContact O-CA 3.37Å; G1025-I1029 WeakPolarHBondContact O-CB 2.92Å; G1025-I1029 WeakPolarHBondContact O-CD1 3.09Å; G1025-I1029 WeakPolarHBondContact O-CG1 3.04Å; G1025-I1029 PolarHBondContact O-N 3.45Å
1026	I	53.6	Low	51.2	Low	101 Å²	101	98.1 Å²	98.1	52%	0.518	52%	0.523	S	S	.	.	H	α-helix	trans	-96.3	-20.4	-175.3	-70.3	161.3	0	0	0	112	G1022 L1030	G1022-I1026 VanDerWaalsContact O-CB 3.24Å; G1022-I1026 WeakPolarHBondContact O-CB 3.49Å; G1022-I1026 WeakPolarHBondContact O-CD1 3.49Å; G1022-I1026 WeakPolarHBondContact O-CG1 3.43Å; G1022-I1026 PolarHBondContact O-N 3.23Å; I1026-L1030 HydrophobicContact CG2-CD1 3.57Å; I1026-L1030 HydrophobicContact CG2-CG 4.14Å; I1026-L1030 WeakPolarHBondContact O-CA 3.35Å; I1026-L1030 WeakPolarHBondContact O-CB 3.45Å; I1026-L1030 VanDerWaalsContact O-CG 3.31Å; I1026-L1030 WeakPolarHBondContact O-CG 3.38Å; I1026-L1030 PolarHBondContact O-N 3.14Å
1027	S	57.5	Low	51.6	Low	89 Å²	89	92.4 Å²	92.4	62%	0.622	51%	0.505	S	S	*	.	H	α-helix	trans	-80	-31.8	162.1	-164.4	0	0	0	0	111.4	A1023 S1031	A1023-S1027 WeakPolarHBondContact O-CA 3.3Å; A1023-S1027 WeakPolarHBondContact O-CB 3.37Å; A1023-S1027 PolarHBondContact O-N 3.19Å; S1027-S1031 WeakPolarHBondContact O-CA 3.44Å; S1027-S1031 WeakPolarHBondContact O-CB 3.4Å; S1027-S1031 PolarHBondContact O-N 3.18Å; S1027-S1031 PolarHBondContact O-OG 2.74Å
1028	L	58	Low	52.4	Low	92 Å²	92	90.2 Å²	90.2	48%	0.482	51%	0.506	S	S	.	.	H	α-helix	trans	-70.1	-41.8	162.4	-93.2	121.6	0	0	0	111.8	I1024 S1031 I1032	I1024-L1028 HydrophobicContact CG2-CD1 3.45Å; I1024-L1028 VanDerWaalsContact CG2-CD1 3.45Å; I1024-L1028 WeakPolarHBondContact O-CA 3.36Å; I1024-L1028 WeakPolarHBondContact O-CB 3.36Å; I1024-L1028 VanDerWaalsContact O-CD1 3.24Å; I1024-L1028 WeakPolarHBondContact O-CD1 3.49Å; I1024-L1028 PolarHBondContact O-N 2.92Å; L1028-S1031 WeakPolarHBondContact CA-OG 3.48Å; L1028-S1031 PolarHBondContact O-N 2.78Å; L1028-S1031 PolarHBondContact O-OG 3.33Å; L1028-I1032 HydrophobicContact CB-CD1 4.25Å; L1028-I1032 HydrophobicContact CD2-CD1 4.07Å; L1028-I1032 WeakPolarHBondContact O-CA 3.43Å; L1028-I1032 WeakPolarHBondContact O-CB 3.43Å; L1028-I1032 VanDerWaalsContact O-CD1 3.24Å; L1028-I1032 WeakPolarHBondContact O-CD1 3.35Å; L1028-I1032 WeakPolarHBondContact O-CG1 3.39Å; L1028-I1032 PolarHBondContact O-N 2.82Å
1029	I	57.9	Low	53	Low	95 Å²	95	84.9 Å²	84.9	49%	0.487	50%	0.496	S	S	.	.	H	α-helix	trans	-74.8	-33.5	-179.3	-70.7	159.7	0	0	0	110.8	G1025 I1032 V1033	G1025-I1029 WeakPolarHBondContact O-CA 3.37Å; G1025-I1029 WeakPolarHBondContact O-CB 2.92Å; G1025-I1029 WeakPolarHBondContact O-CD1 3.09Å; G1025-I1029 WeakPolarHBondContact O-CG1 3.04Å; G1025-I1029 PolarHBondContact O-N 3.45Å; I1029-I1032 CarbonylContact O-C 3.52Å; I1029-I1032 PolarHBondContact O-N 3.11Å; I1029-V1033 HydrophobicContact CG2-CG2 3.96Å; I1029-V1033 WeakPolarHBondContact O-CA 2.99Å; I1029-V1033 WeakPolarHBondContact O-CB 3.25Å; I1029-V1033 WeakPolarHBondContact O-CG2 3.34Å; I1029-V1033 PolarHBondContact O-N 2.96Å
1030	L	55.1	Low	53	Low	96 Å²	96	86.4 Å²	86.4	50%	0.503	51%	0.505	S	S	.	.	H	α-helix	trans	-82.4	-20.9	170.7	-72.2	162.3	0	0	0	112.8	I1026 F1034	I1026-L1030 HydrophobicContact CG2-CD1 3.57Å; I1026-L1030 HydrophobicContact CG2-CG 4.14Å; I1026-L1030 WeakPolarHBondContact O-CA 3.35Å; I1026-L1030 WeakPolarHBondContact O-CB 3.45Å; I1026-L1030 VanDerWaalsContact O-CG 3.31Å; I1026-L1030 WeakPolarHBondContact O-CG 3.38Å; I1026-L1030 PolarHBondContact O-N 3.14Å; L1030-F1034 WeakPolarHBondContact O-CA 3.33Å; L1030-F1034 WeakPolarHBondContact O-CB 3.5Å; L1030-F1034 PolarHBondContact O-N 3.31Å
1031	S	62.9	Low	52.8	Low	55 Å²	55	84.5 Å²	84.5	39%	0.385	50%	0.495	S	S	.	.	H	α-helix	trans	-73.2	-36.4	162.8	74	0	0	0	0	111.2	S1027 L1028 L1035	S1027-S1031 WeakPolarHBondContact O-CA 3.44Å; S1027-S1031 WeakPolarHBondContact O-CB 3.4Å; S1027-S1031 PolarHBondContact O-N 3.18Å; S1027-S1031 PolarHBondContact O-OG 2.74Å; L1028-S1031 WeakPolarHBondContact CA-OG 3.48Å; L1028-S1031 PolarHBondContact O-N 2.78Å; L1028-S1031 PolarHBondContact O-OG 3.33Å; S1031-L1035 WeakPolarHBondContact O-CB 3.28Å; S1031-L1035 WeakPolarHBondContact O-CD1 3.3Å; S1031-L1035 PolarHBondContact O-N 3.31Å
1032	I	62.1	Low	52.2	Low	80 Å²	80	89.7 Å²	89.7	41%	0.41	50%	0.503	S	S	.	.	H	α-helix	trans	-73.5	-27	174.3	-71.5	163.4	0	0	0	111	L1028 I1029 L1035 C1036	L1028-I1032 HydrophobicContact CB-CD1 4.25Å; L1028-I1032 HydrophobicContact CD2-CD1 4.07Å; L1028-I1032 WeakPolarHBondContact O-CA 3.43Å; L1028-I1032 WeakPolarHBondContact O-CB 3.43Å; L1028-I1032 VanDerWaalsContact O-CD1 3.24Å; L1028-I1032 WeakPolarHBondContact O-CD1 3.35Å; L1028-I1032 WeakPolarHBondContact O-CG1 3.39Å; L1028-I1032 PolarHBondContact O-N 2.82Å; I1029-I1032 CarbonylContact O-C 3.52Å; I1029-I1032 PolarHBondContact O-N 3.11Å; I1032-L1035 CarbonylContact O-C 3.57Å; I1032-L1035 WeakPolarHBondContact O-CB 3.44Å; I1032-C1036 WeakPolarHBondContact O-CB 3.46Å; I1032-C1036 PolarHBondContact O-N 3.34Å; I1032-C1036 PolarHBondContact O-SG 3.09Å
1033	V	53.4	Low	51.8	Low	47 Å²	47	97 Å²	97	29%	0.285	53%	0.531	S	S	.	.	H	α-helix	trans	-98.1	-24.8	179.1	174.1	0	0	0	0	111.6	I1029 L1035 C1036 I1037	I1029-V1033 HydrophobicContact CG2-CG2 3.96Å; I1029-V1033 WeakPolarHBondContact O-CA 2.99Å; I1029-V1033 WeakPolarHBondContact O-CB 3.25Å; I1029-V1033 WeakPolarHBondContact O-CG2 3.34Å; I1029-V1033 PolarHBondContact O-N 2.96Å; V1033-L1035 VanDerWaalsContact C-N 3.31Å; V1033-C1036 CarbonylContact O-C 3.43Å; V1033-C1036 PolarHBondContact O-N 3.33Å; V1033-I1037 HydrophobicContact CG1-CB 4.45Å; V1033-I1037 HydrophobicContact CG1-CD1 3.36Å; V1033-I1037 HydrophobicContact CG1-CG1 3.8Å; V1033-I1037 WeakPolarHBondContact O-CA 3.42Å; V1033-I1037 WeakPolarHBondContact O-CB 3.45Å; V1033-I1037 WeakPolarHBondContact O-CG1 3.28Å; V1033-I1037 PolarHBondContact O-N 3Å
1034	F	59.1	Low	50.9	Low	164 Å²	164	104.5 Å²	104.5	72%	0.719	55%	0.547	S	S	*	.	H	α-helix	trans	-69.8	-29.6	154.7	-106.2	-101.8	0	0	0	110.7	L1030 A1038	L1030-F1034 WeakPolarHBondContact O-CA 3.33Å; L1030-F1034 WeakPolarHBondContact O-CB 3.5Å; L1030-F1034 PolarHBondContact O-N 3.31Å; F1034-A1038 WeakPolarHBondContact O-CB 3.41Å; F1034-A1038 PolarHBondContact O-N 3.25Å; F1034-A1038 VanDerWaalsContact O-N 3.08Å
1035	L	58	Low	50.3	Low	125 Å²	125	104.5 Å²	104.5	65%	0.654	55%	0.554	S	S	*	*	H	α-helix	trans	-68.8	-29	164.9	-105.7	86.4	0	0	0	112.7	S1031 I1032 V1033 C1039	S1031-L1035 WeakPolarHBondContact O-CB 3.28Å; S1031-L1035 WeakPolarHBondContact O-CD1 3.3Å; S1031-L1035 PolarHBondContact O-N 3.31Å; I1032-L1035 CarbonylContact O-C 3.57Å; I1032-L1035 WeakPolarHBondContact O-CB 3.44Å; V1033-L1035 VanDerWaalsContact C-N 3.31Å; L1035-C1039 WeakPolarHBondContact O-CB 3.44Å; L1035-C1039 PolarHBondContact O-SG 2.91Å
1036	C	51.9	Low	49.2	Very low	67 Å²	67	112.7 Å²	112.7	45%	0.453	58%	0.584	S	S	.	*	H	α-helix	trans	-105.2	-5.7	-176.9	-71.7	0	0	0	0	114.7	I1032 V1033 C1039 T1040	I1032-C1036 WeakPolarHBondContact O-CB 3.46Å; I1032-C1036 PolarHBondContact O-N 3.34Å; I1032-C1036 PolarHBondContact O-SG 3.09Å; V1033-C1036 CarbonylContact O-C 3.43Å; V1033-C1036 PolarHBondContact O-N 3.33Å; C1036-C1039 CarbonylContact O-C 3.57Å; C1036-T1040 PolarHBondContact O-N 3.1Å
1037	I	46.8	Very low	48.1	Very low	85 Å²	85	115.5 Å²	115.5	44%	0.436	60%	0.599	S	S	.	*	H	α-helix	trans	-122.6	-21.2	177.7	-62.2	-179.3	0	0	0	112.3	V1033 C1039 T1040 I1041	V1033-I1037 HydrophobicContact CG1-CB 4.45Å; V1033-I1037 HydrophobicContact CG1-CD1 3.36Å; V1033-I1037 HydrophobicContact CG1-CG1 3.8Å; V1033-I1037 WeakPolarHBondContact O-CA 3.42Å; V1033-I1037 WeakPolarHBondContact O-CB 3.45Å; V1033-I1037 WeakPolarHBondContact O-CG1 3.28Å; V1033-I1037 PolarHBondContact O-N 3Å; I1037-C1039 PolarHBondContact O-N 2.63Å; I1037-T1040 VanDerWaalsContact C-N 3.33Å; I1037-T1040 VanDerWaalsContact CA-N 3.33Å; I1037-T1040 PolarHBondContact O-N 2.57Å; I1037-I1041 HydrophobicContact CD1-CB 4.34Å; I1037-I1041 WeakPolarHBondContact CD1-O 3.27Å; I1037-I1041 HydrophobicContact CG1-CB 4.11Å; I1037-I1041 WeakPolarHBondContact CG2-O 3.25Å
1038	A	56.8	Low	46.8	Very low	80 Å²	80	120 Å²	120	66%	0.661	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-2.8	139.4	0	0	0	0	0	111.5	F1034	F1034-A1038 WeakPolarHBondContact O-CB 3.41Å; F1034-A1038 PolarHBondContact O-N 3.25Å; F1034-A1038 VanDerWaalsContact O-N 3.08Å
1039	C	50.1	Low	45.5	Very low	81 Å²	81	122 Å²	122	55%	0.547	62%	0.618	S	S	.	*	T	Hydrogen-bonded Turn	trans	-120.6	40.2	157.5	-67.3	0	0	0	0	113.4	L1035 C1036 I1037	L1035-C1039 WeakPolarHBondContact O-CB 3.44Å; L1035-C1039 PolarHBondContact O-SG 2.91Å; C1036-C1039 CarbonylContact O-C 3.57Å; I1037-C1039 PolarHBondContact O-N 2.63Å
1040	T	38.3	Very low	44.1	Very low	115 Å²	115	125.6 Å²	125.6	71%	0.706	63%	0.63	S	S	*	*			trans	105.9	31	135.3	75.3	0	0	0	0	122.9	C1036 I1037	C1036-T1040 PolarHBondContact O-N 3.1Å; I1037-T1040 VanDerWaalsContact C-N 3.33Å; I1037-T1040 VanDerWaalsContact CA-N 3.33Å; I1037-T1040 PolarHBondContact O-N 2.57Å
1041	I	44.3	Very low	43.1	Very low	101 Å²	101	125.3 Å²	125.3	52%	0.518	64%	0.636	S	S	.	*			trans	-128.4	102.4	179.6	-63.6	172.3	0	0	0	112.5	I1037	I1037-I1041 HydrophobicContact CD1-CB 4.34Å; I1037-I1041 WeakPolarHBondContact CD1-O 3.27Å; I1037-I1041 HydrophobicContact CG1-CB 4.11Å; I1037-I1041 WeakPolarHBondContact CG2-O 3.25Å
1042	W	34.6	Very low	41.6	Very low	217 Å²	217	129 Å²	129	82%	0.822	65%	0.645	S	S	*	*				60.3	139.9	77.9	-93.6	2.1	0	0	0	115.1
1043	K	35.5	Very low	40.3	Very low	168 Å²	168	130.4 Å²	130.4	73%	0.73	65%	0.653	S	S	*	*			trans	83.4	94.6	160.4	-68.6	172.2	176	-175.6	0	115.8
1044	Y	31	Very low	39.1	Very low	220 Å²	220	129.5 Å²	129.5	86%	0.863	65%	0.646	S	S	*	*				64.3	157.6	82.5	-84.1	-99.6	0	0	0	112.9
1045	P	37.3	Very low	37.7	Very low	99 Å²	99	129.2 Å²	129.2	64%	0.643	64%	0.644	S	S	*	*			cis	-140.1	-178.9	-45	37.3	-18.3	0	0	0	113.8
1046	K	30.1	Very low	36.5	Very low	189 Å²	189	130.5 Å²	130.5	82%	0.822	65%	0.647	S	S	*	*			trans	48.5	124.3	144.2	-74.5	175.4	179.4	-177.4	0	120.2
1047	L	29.9	Very low	35.4	Very low	160 Å²	160	132 Å²	132	84%	0.838	65%	0.654	S	S	*	*			trans	-152.4	99.4	138	-95.9	150.1	0	0	0	106.6
1048	K	29.5	Very low	34.6	Very low	185 Å²	185	137.4 Å²	137.4	80%	0.804	68%	0.675	S	S	*	*				45.8	124.5	85.4	-86.9	-170.8	176.4	-177.6	0	112.7
1049	L	30.2	Very low	33.3	Very low	133 Å²	133	138.4 Å²	138.4	70%	0.696	68%	0.676	S	S	*	*			trans	158.2	135.4	145.7	-101.5	78.2	0	0	0	105.2
1050	K	30.4	Very low	32.4	Very low	170 Å²	170	138.5 Å²	138.5	74%	0.739	68%	0.678	S	S	*	*			cis	-172	131.1	22.3	-122	170.4	-171.4	165.8	0	106.6
1051	S	32.3	Very low	32.2	Very low	90 Å²	90	139.3 Å²	139.3	63%	0.629	68%	0.678	S	S	*	*				64	120.4	103.6	80.6	0	0	0	0	117.7
1052	K	31.9	Very low	31.6	Very low	132 Å²	132	140.1 Å²	140.1	57%	0.574	68%	0.683	S	S	*	*			trans	-166.4	107.4	130.2	-112.6	-179.4	173.2	-175	0	107.8	S99	S99-K1052 PolarHBondContact OG-O 3.3Å
1053	I	34.5	Very low	31.5	Very low	111 Å²	111	135.8 Å²	135.8	57%	0.569	68%	0.677	S	S	*	*				67	118.5	75.8	-66.6	163.6	0	0	0	111.4	S99	S99-I1053 WeakPolarHBondContact OG-CA 3.08Å; S99-I1053 PolarHBondContact OG-N 3.28Å
1054	I	28.5	Very low	31.3	Very low	28 Å²	28	135.7 Å²	135.7	14%	0.144	68%	0.679	C	S	.	*			trans	-171	110.2	143.9	-38.9	107.5	0	0	0	106.2	S99 N100 I101	S99-I1054 WeakPolarHBondContact CA-O 3.35Å; S99-I1054 WeakPolarHBondContact CB-O 3.13Å; S99-I1054 WeakPolarHBondContact O-CD1 3.37Å; S99-I1054 PolarHBondContact OG-N 3.29Å; N100-I1054 VanDerWaalsContact C-CB 3.43Å; N100-I1054 VanDerWaalsContact CA-CB 3.43Å; N100-I1054 HydrophobicContact CB-CB 3.93Å; N100-I1054 HydrophobicContact CB-CG1 4.28Å; N100-I1054 HydrophobicContact CB-CG2 3.92Å; N100-I1054 VanDerWaalsContact N-CD1 3.3Å; N100-I1054 WeakPolarHBondContact ND2-CG2 3.07Å; N100-I1054 WeakPolarHBondContact O-CB 3.27Å; N100-I1054 WeakPolarHBondContact O-CD1 3.43Å; N100-I1054 WeakPolarHBondContact O-CG1 3.29Å; N100-I1054 WeakPolarHBondContact O-CG2 3.38Å; I101-I1054 HydrophobicContact CB-CD1 3.62Å; I101-I1054 HydrophobicContact CB-CG1 4.22Å; I101-I1054 HydrophobicContact CD1-CG1 4.45Å; I101-I1054 HydrophobicContact CG1-CD1 3.69Å; I101-I1054 HydrophobicContact CG1-CG1 3.7Å; I101-I1054 HydrophobicContact CG1-CG2 4.47Å
1055	K	30.2	Very low	31.3	Very low	157 Å²	157	131.2 Å²	131.2	68%	0.683	67%	0.668	S	S	*	*				40.1	122.9	95.1	-47	175.2	163.6	-175.4	0	112.8	N100	N100-K1055 PolarHBondContact ND2-O 2.88Å; N100-K1055 PolarHBondContact OD1-O 2.84Å
1056	E	31.6	Very low	30.9	Very low	153 Å²	153	130.8 Å²	130.8	72%	0.715	67%	0.668	S	S	*	*				164.7	143.7	86.9	-81.1	-167.7	159	0	0	102.4
1057	T	29.8	Very low	31	Very low	97 Å²	97	131 Å²	131	60%	0.595	67%	0.669	S	S	*	*			cis	175.3	144.4	12.2	20	0	0	0	0	105.3
1058	K	29.5	Very low	31.1	Very low	200 Å²	200	130.9 Å²	130.9	87%	0.87	67%	0.667	S	S	*	*			trans	66.9	147.5	141.8	-63.3	169.6	179.5	-178.6	0	116.6
1059	S	30.5	Very low	31.2	Very low	100 Å²	100	130.7 Å²	130.7	70%	0.699	67%	0.669	S	S	*	*			cis	-153.1	138.3	17	63.9	0	0	0	0	106.9
1060	S	30.6	Very low	31.2	Very low	83 Å²	83	129.7 Å²	129.7	58%	0.58	67%	0.672	S	S	*	*				73.1	112.1	91.1	110.4	0	0	0	0	111.5
1061	D	33.6	Very low	31.3	Very low	132 Å²	132	128 Å²	128	71%	0.706	68%	0.676	S	S	*	*				115.8	147	100.3	-76.2	-14.3	0	0	0	104.7
1062	D	32.4	Very low	31.1	Very low	118 Å²	118	127.8 Å²	127.8	63%	0.631	68%	0.679	S	S	*	*			cis	-171.9	158.2	9.3	-123.8	-22.5	0	0	0	107.2
1063	N	32	Very low	31	Very low	127 Å²	127	128.4 Å²	128.4	68%	0.679	68%	0.684	S	S	*	*			trans	48.1	127.3	141.3	-69.4	-44.4	0	0	0	120.5
1064	Q	31.8	Very low	30.9	Very low	166 Å²	166	130.5 Å²	130.5	78%	0.776	69%	0.689	S	S	*	*				178.4	117	92.3	-89.5	-160.6	3	0	0	110.8
1065	I	31.9	Very low	31.1	Very low	126 Å²	126	136.4 Å²	136.4	65%	0.646	72%	0.72	S	S	*	*				88.7	100.5	103.6	-67.1	175.8	0	0	0	113.6
1066	S	28.5	Very low	31.3	Very low	90 Å²	90	134.2 Å²	134.2	63%	0.629	72%	0.72	S	S	*	*			trans	22.9	127.1	134.6	66	0	0	0	0	119.7
1067	K	30.9	Very low	31.3	Very low	193 Å²	193	133.9 Å²	133.9	84%	0.839	72%	0.723	S	S	*	*				169.6	153.5	107.8	-93.1	168.6	-179.1	177.5	0	110
1068	I	33.4	Very low	31.6	Very low	158 Å²	158	137.7 Å²	137.7	81%	0.81	73%	0.731	S	S	*	*			trans	124.3	87	161.2	-62.6	158.7	0	0	0	108.8
1069	H	31.4	Very low	31.8	Very low	180 Å²	180	132.9 Å²	132.9	83%	0.833	72%	0.723	S	S	*	*				68.4	124.5	88.1	-107.3	-89.3	0	0	0	114.3
1070	C	29.8	Very low	32.1	Very low	113 Å²	113	137.3 Å²	137.3	76%	0.764	73%	0.73	S	S	*	*			trans	-47.2	164.7	173.2	-62.4	0	0	0	0	115.7
1071	V	31.9	Very low	32.4	Very low	135 Å²	135	140.9 Å²	140.9	82%	0.818	74%	0.742	S	S	*	*			trans	132.7	88.2	151	173.4	0	0	0	0	106.9
1072	A	29.4	Very low	32.7	Very low	85 Å²	85	139.2 Å²	139.2	70%	0.702	74%	0.738	S	S	*	*				42.5	113.6	78.8	0	0	0	0	0	110.7
1073	E	29	Very low	33	Very low	145 Å²	145	140.2 Å²	140.2	68%	0.678	74%	0.743	S	S	*	*				178.5	148.4	62.8	-126.3	-176.8	147.8	0	0	108.3
1074	K	32.5	Very low	33.1	Very low	155 Å²	155	144.9 Å²	144.9	67%	0.674	75%	0.751	S	S	*	*			trans	44	141.4	135.2	-70.4	172.8	-171.4	156.9	0	119.3
1075	L	32.3	Very low	33	Very low	152 Å²	152	151.7 Å²	151.7	80%	0.796	77%	0.772	S	S	*	*				-167.9	117.8	77	-80.9	156.8	0	0	0	108.3
1076	T	34	Very low	33	Very low	111 Å²	111	153 Å²	153	68%	0.681	78%	0.778	S	S	*	*				36.6	105.2	104.6	58.4	0	0	0	0	115
1077	N	32.6	Very low	33.3	Very low	145 Å²	145	156.3 Å²	156.3	78%	0.775	79%	0.786	S	S	*	*				70	132.4	85.9	-135.3	-3	0	0	0	115.4
1078	K	35.3	Very low	33.4	Very low	177 Å²	177	154.3 Å²	154.3	77%	0.77	78%	0.783	S	S	*	*			trans	87.3	101.9	159	-68.3	-179.6	176.8	175.6	0	120.6
1079	S	33.3	Very low	33.4	Very low	100 Å²	100	154.1 Å²	154.1	70%	0.699	78%	0.782	S	S	*	*				40.4	122.7	116.9	66.3	0	0	0	0	121
1080	K	37.8	Very low	33.5	Very low	193 Å²	193	152.4 Å²	152.4	84%	0.839	78%	0.778	S	S	*	*			trans	79.1	100.6	147.2	-69.7	-176.5	176.2	-178	0	118.9
1081	L	37.5	Very low	33.8	Very low	158 Å²	158	155.1 Å²	155.1	83%	0.827	78%	0.779	S	S	*	*				58	145.4	115.1	-88.7	155.8	0	0	0	119.8
1082	P	39.5	Very low	33.9	Very low	96 Å²	96	156.5 Å²	156.5	62%	0.623	78%	0.777	S	S	*	*				-130	176.9	-71	40.1	-25.1	0	0	0	112.9
1083	N	39.1	Very low	34.2	Very low	140 Å²	140	162 Å²	162	75%	0.749	78%	0.782	S	S	*	*			trans	77.4	110.6	153.5	-70.6	-18.8	0	0	0	120.3
1084	R	32.8	Very low	34.7	Very low	225 Å²	225	163.4 Å²	163.4	85%	0.849	79%	0.791	S	S	*	*			trans	52.6	102.8	130.5	-72.8	-178.3	171.8	177.5	-3.2	116.5
1085	Y	29.5	Very low	34.9	Very low	309 Å²	309	164.2 Å²	164.2	100%	1.212	80%	0.802	S	S	*	*				-143.3	0	94.4	-99.6	-83	0	0	0	109.6

Retrieved 1,085 of 1,085 residues in 927.2 ms (Link to these results)

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