A0A3Q0KPQ6_SCHMA Loading...

Putative histone-lysine n-methyltransferase, setb1

AlphaFold DB , UniProt , Accession A0A3Q0KPQ6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,456 aa.

						>A0A3Q0KPQ6_SCHMA|A0A3Q0KPQ6
MNVLKHEHRVLIDELTESIYDALDSDDIFDVIFAFVESKYQAELKDVNNPKLRLHIIQQRFSLALEECGLIDEIIESFPELNLNARLDKLKKEQSTLQSNILELNGKIDTIVDEMTRLQINSFGRVLRLFDNRVIDLAKDEEEIVVIERPNNRIPESTINHSSAPVWRTLQPAELLLGLQLTPSQPVLYRKTQHTWFPGRVLSCHLPNSDPSTPKSDKDRAKENENAQYTIALDTSSKSKSEICFAVTSSLALAFSASELRQKYPVGARVVSIYRDDTGGIGYYSGLIAEPPSERNNQRYLLFFDDGYTQYSPPNEVYRICHQSKENWKEATESSQEFIKRYLAQYPQRPMVRLKPGQTVETELDGDWMKATVEKVDASLALMKFSRTHSEWIYRGSTRLEPLFSDLLSSQSKSVPTHNQRVEVEYSSVDVPLDSSAKRRKARKSATGNQNTAMSVRALSSGDSHKISNSIHQTNKSLSNYNNEALKTTSKKGSEKNINEQCLSIDPITNLSELESTGTKTSYLDNLFKEFDYKPFESHKCGHYCLKSYRKPSSALSPILCSENPVDYKGLNPLEIPFHCGWLRYLAKYDPPVNNKCNIIYTAPCGRSLRSMHEVERFLDKTNSQLTADLFSFDSTLIINQEFRAEKTLTSIVDLSYGKENVPIPCVNSVDNEVPGYIDYTPQRQPIGNVPLLKDSKFLVCCDCTDNCRDRTKCACQQLTVEASSLTNPNGLVDSQAGYRYRRLSQFTVGGVYECNSNCQCDRRCSNRVVQQGLWVKLQVFKTARKGWGIRALNAIPKGTFICTYAGAIYDEAMAVQEGFDCGDEYQAELDYIETVEKDKEGYESTVEDLNEILNETTVALSDTKKFSDENKTSHISAVTDQQVLSSRSNSTTTSNNTPIDNDKDESESDNRRNTSSATSLVSETTAIDVDENDDVDNNYDDKTSRSSEISSNSSSRNALISTKPLLLNRNYDSSESCLNTDNDLTQISVRIKKKKHKREEKKRQKKGISLPPVYSELTENTTSKISDKYIQNISSMLNTKEIPNDIMHDSPERPRTKHNSPLPYISSDLEETSDLITYPDVQCEDTSQVIPSSVDLCSEMLDPSNLSHVVYSEPGKNENNSSDNTISSIQSQSKNPKVNIIFNGNNNEQIASIRSRCTVQDVIQEISETIIQTKTSLKKPETIELSNISNQLSHPSLNHTPSNVLVSKTQKKMKKFEMSKHYKPMKPKVQVNLHPVVEKEDTSTPHFHSMFNKISKYSNQVKLKNKSKKSRSKSSSTNSSTNELYNRKSEYKKIWSNRAASLPRSFRLLHNAKQLLRESDFSRIPVVRLCPLENDIKQEDHDIEMKNVIMNSDDAKSSNDDSKPKFEFPVEVKEDVKNEQCDSSTNTGDSKKDLNILKVGTLENDSQSETIGDTLKVTSISANSPSPKHQGSLKLRLRRVSSTSSFKAVRPTFHQ
					

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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	43.6	Very low	58.3	Low	177 Å²	177	124.3 Å²	124.3	87%	0.872	61%	0.606	S	S	*	*				0	-89.6	0	-83.9	-62.4	-173.8	0	0	110.7	V3 L4 K5	M1-V3 PolarHBondContact O-N 3.27Å; M1-L4 PolarHBondContact O-N 2.92Å; M1-K5 PolarHBondContact O-N 3.39Å
2	N	52.6	Low	58.9	Low	135 Å²	135	122.2 Å²	122.2	72%	0.722	60%	0.597	S	S	*	*	H	α-helix	trans	-66.5	-35.8	-172.3	-69.3	7.4	0	0	0	114.2	K5 H6	N2-K5 PolarHBondContact O-N 3.32Å; N2-H6 PolarHBondContact O-N 3.37Å
3	V	50.5	Low	59.7	Low	103 Å²	103	119.3 Å²	119.3	62%	0.624	59%	0.586	S	S	*	*	H	α-helix	trans	-60.7	-56.1	173.5	-176.9	0	0	0	0	110.6	M1 K5 H6 E7	M1-V3 PolarHBondContact O-N 3.27Å; V3-K5 PolarHBondContact O-N 3.06Å; V3-K5 VanDerWaalsContact O-N 3.12Å; V3-H6 WeakPolarHBondContact O-CA 3.24Å; V3-H6 WeakPolarHBondContact O-CB 3.36Å; V3-H6 PolarHBondContact O-N 3.12Å; V3-E7 HydrophobicContact CG1-CG 4.34Å; V3-E7 PolarHBondContact O-N 2.95Å
4	L	47.5	Very low	60.5	Low	108 Å²	108	119.1 Å²	119.1	57%	0.565	58%	0.584	S	S	*	*	H	α-helix	trans	-52.1	-33.1	172	-77.3	163.7	0	0	0	114.7	M1 E7 H8	M1-L4 PolarHBondContact O-N 2.92Å; L4-E7 VanDerWaalsContact CA-OE2 3.24Å; L4-E7 WeakPolarHBondContact CA-OE2 3.48Å; L4-E7 PolarHBondContact N-OE2 3.43Å; L4-H8 WeakPolarHBondContact O-CB 3.32Å; L4-H8 PolarHBondContact O-N 3.18Å; L4-H8 VanDerWaalsContact O-N 3.12Å
5	K	55.4	Low	60.4	Low	151 Å²	151	114.9 Å²	114.9	66%	0.657	56%	0.564	S	S	*	*	H	α-helix	trans	-73.7	-26.7	173.6	-81.7	-168.7	171.3	-169.4	0	113.3	M1 N2 V3 R9	M1-K5 PolarHBondContact O-N 3.39Å; N2-K5 PolarHBondContact O-N 3.32Å; V3-K5 PolarHBondContact O-N 3.06Å; V3-K5 VanDerWaalsContact O-N 3.12Å; K5-R9 PolarHBondContact O-N 2.8Å
6	H	65.6	Low	60.4	Low	129 Å²	129	111.6 Å²	111.6	60%	0.597	55%	0.552	S	S	*	*	H	α-helix	trans	-81.3	-44.1	176.8	-164.6	-12.4	0	0	0	110.9	N2 V3 R9 V10	N2-H6 PolarHBondContact O-N 3.37Å; V3-H6 WeakPolarHBondContact O-CA 3.24Å; V3-H6 WeakPolarHBondContact O-CB 3.36Å; V3-H6 PolarHBondContact O-N 3.12Å; H6-R9 WeakPolarHBondContact O-CA 3.38Å; H6-R9 WeakPolarHBondContact O-CB 3.43Å; H6-R9 PolarHBondContact O-N 2.99Å; H6-V10 PolarHBondContact O-N 2.98Å
7	E	64.2	Low	60.9	Low	100 Å²	100	113.3 Å²	113.3	47%	0.467	56%	0.559	S	S	.	*	H	α-helix	trans	-58.7	-47.3	174.4	-66.8	162.7	148.7	0	0	110.9	V3 L4 R9 V10 L11	V3-E7 HydrophobicContact CG1-CG 4.34Å; V3-E7 PolarHBondContact O-N 2.95Å; L4-E7 VanDerWaalsContact CA-OE2 3.24Å; L4-E7 WeakPolarHBondContact CA-OE2 3.48Å; L4-E7 PolarHBondContact N-OE2 3.43Å; E7-R9 PolarHBondContact O-N 3.48Å; E7-V10 PolarHBondContact O-N 3.12Å; E7-L11 PolarHBondContact O-N 3.06Å
8	H	58.6	Low	60.9	Low	125 Å²	125	110 Å²	110	58%	0.579	55%	0.549	S	S	*	.	H	α-helix	trans	-61.9	-21	172.5	-102.6	-77.2	0	0	0	114.5	L4 I12	L4-H8 WeakPolarHBondContact O-CB 3.32Å; L4-H8 PolarHBondContact O-N 3.18Å; L4-H8 VanDerWaalsContact O-N 3.12Å; H8-I12 VanDerWaalsContact O-CD1 3.28Å; H8-I12 WeakPolarHBondContact O-CD1 3.46Å; H8-I12 VanDerWaalsContact O-CG1 3.22Å; H8-I12 WeakPolarHBondContact O-CG1 3.49Å; H8-I12 PolarHBondContact O-N 2.84Å
9	R	64.4	Low	60.6	Low	169 Å²	169	108 Å²	108	64%	0.638	54%	0.539	S	S	*	.	H	α-helix	trans	-85.2	-46.6	179.1	-155.7	179.7	-167	-154.1	0.3	110.8	K5 H6 E7 L11 I12 D13	K5-R9 PolarHBondContact O-N 2.8Å; H6-R9 WeakPolarHBondContact O-CA 3.38Å; H6-R9 WeakPolarHBondContact O-CB 3.43Å; H6-R9 PolarHBondContact O-N 2.99Å; E7-R9 PolarHBondContact O-N 3.48Å; R9-L11 VanDerWaalsContact C-N 3.29Å; R9-L11 PolarHBondContact O-N 2.93Å; R9-I12 CarbonylContact O-C 3.59Å; R9-I12 WeakPolarHBondContact O-CA 3.28Å; R9-I12 WeakPolarHBondContact O-CB 3.22Å; R9-I12 PolarHBondContact O-N 3.35Å; R9-D13 PolarHBondContact O-N 3.46Å
10	V	72.2	Confident	60.6	Low	61 Å²	61	110.4 Å²	110.4	37%	0.37	54%	0.543	S	S	.	.	H	α-helix	trans	-55.1	-46.5	172.9	179.3	0	0	0	0	110.5	H6 E7 I12 D13 E14	H6-V10 PolarHBondContact O-N 2.98Å; E7-V10 PolarHBondContact O-N 3.12Å; V10-I12 PolarHBondContact O-N 3.14Å; V10-D13 PolarHBondContact O-N 3.23Å; V10-D13 VanDerWaalsContact O-N 3.14Å; V10-E14 HydrophobicContact CG1-CG 4.12Å; V10-E14 WeakPolarHBondContact O-CB 3.28Å; V10-E14 WeakPolarHBondContact O-CG 3.41Å; V10-E14 PolarHBondContact O-N 2.84Å
11	L	66.4	Low	60.6	Low	109 Å²	109	111.2 Å²	111.2	57%	0.571	55%	0.55	S	S	*	.	H	α-helix	trans	-64.1	-21.8	175.4	-78.1	168.2	0	0	0	114.8	E7 R9 L15	E7-L11 PolarHBondContact O-N 3.06Å; R9-L11 VanDerWaalsContact C-N 3.29Å; R9-L11 PolarHBondContact O-N 2.93Å; L11-L15 VanDerWaalsContact O-CB 3.28Å; L11-L15 WeakPolarHBondContact O-CB 3.36Å
12	I	66.1	Low	61.3	Low	99 Å²	99	105.7 Å²	105.7	51%	0.508	53%	0.532	S	S	.	.	H	α-helix	trans	-83.5	-41.4	172.4	-75.1	168.7	0	0	0	109.9	H8 R9 V10 L15 T16	H8-I12 VanDerWaalsContact O-CD1 3.28Å; H8-I12 WeakPolarHBondContact O-CD1 3.46Å; H8-I12 VanDerWaalsContact O-CG1 3.22Å; H8-I12 WeakPolarHBondContact O-CG1 3.49Å; H8-I12 PolarHBondContact O-N 2.84Å; R9-I12 CarbonylContact O-C 3.59Å; R9-I12 WeakPolarHBondContact O-CA 3.28Å; R9-I12 WeakPolarHBondContact O-CB 3.22Å; R9-I12 PolarHBondContact O-N 3.35Å; V10-I12 PolarHBondContact O-N 3.14Å; I12-L15 PolarHBondContact O-N 3.45Å; I12-T16 WeakPolarHBondContact O-CB 3.43Å; I12-T16 PolarHBondContact O-N 3.1Å; I12-T16 PolarHBondContact O-OG1 2.91Å
13	D	69.4	Low	61.4	Low	85 Å²	85	101.8 Å²	101.8	46%	0.455	51%	0.511	S	S	.	.	H	α-helix	trans	-66.2	-45.4	-178.9	-57.7	-29.9	0	0	0	110.2	R9 V10 T16 E17	R9-D13 PolarHBondContact O-N 3.46Å; V10-D13 PolarHBondContact O-N 3.23Å; V10-D13 VanDerWaalsContact O-N 3.14Å; D13-T16 WeakPolarHBondContact O-CB 3.33Å; D13-T16 PolarHBondContact O-N 3.44Å; D13-E17 PolarHBondContact O-N 3.19Å; D13-E17 VanDerWaalsContact O-N 3.09Å
14	E	70.7	Confident	61.7	Low	117 Å²	117	102.9 Å²	102.9	55%	0.547	51%	0.513	S	S	.	.	H	α-helix	trans	-60.7	-43.5	173.2	-72.2	173.7	159.5	0	0	112.7	V10 T16 E17 S18	V10-E14 HydrophobicContact CG1-CG 4.12Å; V10-E14 WeakPolarHBondContact O-CB 3.28Å; V10-E14 WeakPolarHBondContact O-CG 3.41Å; V10-E14 PolarHBondContact O-N 2.84Å; E14-T16 PolarHBondContact O-N 3.09Å; E14-E17 PolarHBondContact O-N 3.05Å; E14-S18 PolarHBondContact O-N 3.42Å
15	L	59.3	Low	62.1	Low	56 Å²	56	100.5 Å²	100.5	29%	0.293	51%	0.505	S	S	.	.	H	α-helix	trans	-68.9	-28	177.5	-160.3	78.7	0	0	0	111.9	L11 I12 I19 L81	L11-L15 VanDerWaalsContact O-CB 3.28Å; L11-L15 WeakPolarHBondContact O-CB 3.36Å; I12-L15 PolarHBondContact O-N 3.45Å; L15-I19 HydrophobicContact CG-CD1 4.28Å; L15-I19 WeakPolarHBondContact O-CD1 3.27Å; L15-I19 VanDerWaalsContact O-CG1 3.27Å; L15-I19 WeakPolarHBondContact O-CG1 3.45Å; L15-I19 PolarHBondContact O-N 3Å; L15-I19 VanDerWaalsContact O-N 3.14Å; L15-L81 HydrophobicContact CD1-CD1 4.17Å; L15-L81 HydrophobicContact CD1-CD2 3.82Å; L15-L81 HydrophobicContact CD1-CG 4.43Å; L15-L81 HydrophobicContact CD2-CD1 3.85Å; L15-L81 HydrophobicContact CD2-CD2 3.63Å; L15-L81 HydrophobicContact CD2-CG 4.4Å; L15-L81 HydrophobicContact CG-CD2 4.39Å
16	T	60.1	Low	62.2	Low	61 Å²	61	100.4 Å²	100.4	37%	0.374	51%	0.512	S	S	.	.	H	α-helix	trans	-71	-45.4	176.7	-59.3	0	0	0	0	110.4	I12 D13 E14 I19 Y20	I12-T16 WeakPolarHBondContact O-CB 3.43Å; I12-T16 PolarHBondContact O-N 3.1Å; I12-T16 PolarHBondContact O-OG1 2.91Å; D13-T16 WeakPolarHBondContact O-CB 3.33Å; D13-T16 PolarHBondContact O-N 3.44Å; E14-T16 PolarHBondContact O-N 3.09Å; T16-I19 PolarHBondContact O-N 2.82Å; T16-Y20 HydrophobicContact CG2-CD2 3.78Å; T16-Y20 HydrophobicContact CG2-CE2 3.64Å; T16-Y20 VanDerWaalsContact O-CD2 3.27Å; T16-Y20 WeakPolarHBondContact O-CD2 3.27Å; T16-Y20 PolarHBondContact O-N 2.66Å
17	E	68.5	Low	62	Low	141 Å²	141	100.4 Å²	100.4	66%	0.659	52%	0.517	S	S	*	.	H	α-helix	trans	-60.6	-46	171.7	-74.8	-156	147.4	0	0	111.7	D13 E14 I19 Y20 D21	D13-E17 PolarHBondContact O-N 3.19Å; D13-E17 VanDerWaalsContact O-N 3.09Å; E14-E17 PolarHBondContact O-N 3.05Å; E17-I19 PolarHBondContact O-N 3.14Å; E17-I19 VanDerWaalsContact O-N 3.1Å; E17-Y20 CarbonylContact O-C 3.59Å; E17-Y20 PolarHBondContact O-N 2.97Å; E17-D21 PolarHBondContact O-N 3.26Å
18	S	60.7	Low	62	Low	54 Å²	54	98.1 Å²	98.1	38%	0.378	51%	0.507	S	S	.	.	H	α-helix	trans	-62.9	-20.2	178.6	-175	0	0	0	0	114.4	E14 A22	E14-S18 PolarHBondContact O-N 3.42Å; S18-A22 WeakPolarHBondContact O-CB 3.5Å
19	I	56.2	Low	62.3	Low	72 Å²	72	95.9 Å²	95.9	37%	0.369	50%	0.496	S	S	.	.	H	α-helix	trans	-87.6	-34.8	172.6	-71.3	167.6	0	0	0	110.8	L15 T16 E17 A22 L23	L15-I19 HydrophobicContact CG-CD1 4.28Å; L15-I19 WeakPolarHBondContact O-CD1 3.27Å; L15-I19 VanDerWaalsContact O-CG1 3.27Å; L15-I19 WeakPolarHBondContact O-CG1 3.45Å; L15-I19 PolarHBondContact O-N 3Å; L15-I19 VanDerWaalsContact O-N 3.14Å; T16-I19 PolarHBondContact O-N 2.82Å; E17-I19 PolarHBondContact O-N 3.14Å; E17-I19 VanDerWaalsContact O-N 3.1Å; I19-A22 PolarHBondContact O-N 3.27Å; I19-L23 HydrophobicContact CG2-CD1 3.98Å; I19-L23 WeakPolarHBondContact O-CD1 3.48Å; I19-L23 VanDerWaalsContact O-CG 3.29Å; I19-L23 WeakPolarHBondContact O-CG 3.29Å; I19-L23 PolarHBondContact O-N 3.5Å
20	Y	59.1	Low	62.5	Low	155 Å²	155	93.7 Å²	93.7	61%	0.608	50%	0.497	S	S	*	.	H	α-helix	trans	-64.7	-50.3	171.2	-85.3	-68.7	0	0	0	111.4	T16 E17 A22 L23 D24	T16-Y20 HydrophobicContact CG2-CD2 3.78Å; T16-Y20 HydrophobicContact CG2-CE2 3.64Å; T16-Y20 VanDerWaalsContact O-CD2 3.27Å; T16-Y20 WeakPolarHBondContact O-CD2 3.27Å; T16-Y20 PolarHBondContact O-N 2.66Å; E17-Y20 CarbonylContact O-C 3.59Å; E17-Y20 PolarHBondContact O-N 2.97Å; Y20-A22 PolarHBondContact O-N 2.86Å; Y20-A22 VanDerWaalsContact O-N 3.13Å; Y20-L23 CarbonylContact O-C 3.55Å; Y20-L23 WeakPolarHBondContact O-CA 3.46Å; Y20-L23 PolarHBondContact O-N 2.88Å; Y20-D24 WeakPolarHBondContact O-CB 3.45Å; Y20-D24 PolarHBondContact O-N 3.13Å
21	D	62.2	Low	62.3	Low	129 Å²	129	95.4 Å²	95.4	69%	0.69	51%	0.507	S	S	*	.	H	α-helix	trans	-54.6	-33.3	176.3	-78.6	0.4	0	0	0	112.9	E17	E17-D21 PolarHBondContact O-N 3.26Å
22	A	58.6	Low	62.4	Low	60 Å²	60	90.4 Å²	90.4	50%	0.496	48%	0.481	S	S	.	.	H	α-helix	trans	-79.9	-14.9	177.6	0	0	0	0	0	113.9	S18 I19 Y20	S18-A22 WeakPolarHBondContact O-CB 3.5Å; I19-A22 PolarHBondContact O-N 3.27Å; Y20-A22 PolarHBondContact O-N 2.86Å; Y20-A22 VanDerWaalsContact O-N 3.13Å
23	L	54.8	Low	62.9	Low	54 Å²	54	88.8 Å²	88.8	28%	0.283	47%	0.47	S	S	.	.	H	α-helix	trans	-105.7	-15.6	177.1	-68.6	171.1	0	0	0	112.9	I19 Y20 S25 I28 F29	I19-L23 HydrophobicContact CG2-CD1 3.98Å; I19-L23 WeakPolarHBondContact O-CD1 3.48Å; I19-L23 VanDerWaalsContact O-CG 3.29Å; I19-L23 WeakPolarHBondContact O-CG 3.29Å; I19-L23 PolarHBondContact O-N 3.5Å; Y20-L23 CarbonylContact O-C 3.55Å; Y20-L23 WeakPolarHBondContact O-CA 3.46Å; Y20-L23 PolarHBondContact O-N 2.88Å; L23-S25 PolarHBondContact O-N 3.19Å; L23-I28 HydrophobicContact CD2-CG2 4.22Å; L23-F29 HydrophobicContact CB-CE2 4.05Å; L23-F29 HydrophobicContact CB-CZ 4.46Å; L23-F29 WeakPolarHBondContact O-CE2 3.27Å
24	D	55.2	Low	63.3	Low	126 Å²	126	87.5 Å²	87.5	67%	0.674	47%	0.471	S	S	*	.			trans	-79.5	14.1	-178	-142.4	44.7	0	0	0	113.6	Y20 D26	Y20-D24 WeakPolarHBondContact O-CB 3.45Å; Y20-D24 PolarHBondContact O-N 3.13Å; D24-D26 PolarHBondContact O-N 3.33Å
25	S	57.4	Low	63.6	Low	57 Å²	57	85.1 Å²	85.1	40%	0.399	46%	0.459	S	S	.	.	S	Bend	trans	-75	109.4	160.1	62.5	0	0	0	0	108.7	L23 D27 I28	L23-S25 PolarHBondContact O-N 3.19Å; S25-D27 PolarHBondContact O-N 3.17Å; S25-I28 PolarHBondContact O-N 3.19Å; S25-I28 VanDerWaalsContact OG-CD1 3.27Å; S25-I28 WeakPolarHBondContact OG-CD1 3.25Å; S25-I28 WeakPolarHBondContact OG-CG1 3.36Å
26	D	57	Low	64.5	Low	150 Å²	150	82.5 Å²	82.5	80%	0.802	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-40.9	-38.4	-171.5	-70.5	-66.4	0	0	0	114.7	D24 I28	D24-D26 PolarHBondContact O-N 3.33Å; D26-I28 PolarHBondContact O-N 3.14Å
27	D	61.4	Low	65.6	Low	129 Å²	129	83 Å²	83	69%	0.69	44%	0.443	S	S	*	.	H	α-helix	trans	-64.8	-29.7	-177.9	-64.2	-52	0	0	0	114.8	S25 D30 V31	S25-D27 PolarHBondContact O-N 3.17Å; D27-D30 PolarHBondContact O-N 3.24Å; D27-V31 WeakPolarHBondContact O-CB 3.41Å; D27-V31 VanDerWaalsContact O-CG2 3.28Å; D27-V31 WeakPolarHBondContact O-CG2 3.48Å; D27-V31 PolarHBondContact O-N 3.39Å
28	I	63.1	Low	66.2	Low	52 Å²	52	80.5 Å²	80.5	27%	0.267	44%	0.442	S	S	.	.	H	α-helix	trans	-68.6	-44.3	-170	-76.7	-178.8	0	0	0	112	L23 S25 D26 V31 I32	L23-I28 HydrophobicContact CD2-CG2 4.22Å; S25-I28 PolarHBondContact O-N 3.19Å; S25-I28 VanDerWaalsContact OG-CD1 3.27Å; S25-I28 WeakPolarHBondContact OG-CD1 3.25Å; S25-I28 WeakPolarHBondContact OG-CG1 3.36Å; D26-I28 PolarHBondContact O-N 3.14Å; I28-V31 PolarHBondContact O-N 3.32Å; I28-I32 HydrophobicContact CG2-CD1 3.86Å; I28-I32 WeakPolarHBondContact O-CG1 2.83Å; I28-I32 PolarHBondContact O-N 2.9Å
29	F	65.2	Low	67.2	Low	78 Å²	78	82.7 Å²	82.7	34%	0.342	44%	0.444	S	S	.	.	H	α-helix	trans	-65.4	-42.1	178.1	-81.9	-80.4	0	0	0	111.4	L23 V31 I32 F33 F61	L23-F29 HydrophobicContact CB-CE2 4.05Å; L23-F29 HydrophobicContact CB-CZ 4.46Å; L23-F29 WeakPolarHBondContact O-CE2 3.27Å; F29-V31 PolarHBondContact O-N 2.71Å; F29-I32 PolarHBondContact O-N 2.97Å; F29-F33 WeakPolarHBondContact O-CB 3.27Å; F29-F33 VanDerWaalsContact O-CD2 3.32Å; F29-F33 WeakPolarHBondContact O-CD2 3.49Å; F29-F33 PolarHBondContact O-N 3.24Å; F29-F61 HydrophobicContact CD1-CE2 4.12Å; F29-F61 AromaticContact CD1-CZ 3.89Å; F29-F61 HydrophobicContact CD1-CZ 3.89Å; F29-F61 HydrophobicContact CE1-CE2 4.32Å; F29-F61 AromaticContact CE1-CZ 3.72Å; F29-F61 HydrophobicContact CE1-CZ 3.72Å
30	D	69.7	Low	68.5	Low	123 Å²	123	81 Å²	81	66%	0.658	43%	0.434	S	S	*	.	H	α-helix	trans	-64.2	-37.9	177	-91	6.4	0	0	0	112.1	D27 A34	D27-D30 PolarHBondContact O-N 3.24Å; D30-A34 WeakPolarHBondContact O-CB 3.47Å; D30-A34 PolarHBondContact O-N 3.2Å
31	V	67.3	Low	69.7	Low	96 Å²	96	80.4 Å²	80.4	58%	0.582	44%	0.436	S	S	*	.	H	α-helix	trans	-62.9	-45.8	173.3	166.7	0	0	0	0	111.8	D27 I28 F29 A34 F35	D27-V31 WeakPolarHBondContact O-CB 3.41Å; D27-V31 VanDerWaalsContact O-CG2 3.28Å; D27-V31 WeakPolarHBondContact O-CG2 3.48Å; D27-V31 PolarHBondContact O-N 3.39Å; I28-V31 PolarHBondContact O-N 3.32Å; F29-V31 PolarHBondContact O-N 2.71Å; V31-A34 PolarHBondContact O-N 3.21Å; V31-F35 WeakPolarHBondContact O-CB 3.28Å; V31-F35 PolarHBondContact O-N 3.33Å
32	I	69.1	Low	70.6	Confident	4 Å²	4	78.3 Å²	78.3	2%	0.021	44%	0.437	C	S	.	.	H	α-helix	trans	-68.8	-41.3	179.4	-62	164.5	0	0	0	110.7	I28 F29 F35 V36 F61 A64 L65 L70	I28-I32 HydrophobicContact CG2-CD1 3.86Å; I28-I32 WeakPolarHBondContact O-CG1 2.83Å; I28-I32 PolarHBondContact O-N 2.9Å; F29-I32 PolarHBondContact O-N 2.97Å; I32-F35 PolarHBondContact O-N 3.4Å; I32-V36 WeakPolarHBondContact O-CG2 3.25Å; I32-V36 PolarHBondContact O-N 2.89Å; I32-F61 HydrophobicContact CB-CE2 3.99Å; I32-F61 HydrophobicContact CB-CZ 4.38Å; I32-F61 HydrophobicContact CD1-CE2 4.42Å; I32-F61 HydrophobicContact CD1-CZ 3.95Å; I32-F61 HydrophobicContact CG2-CD2 3.67Å; I32-F61 HydrophobicContact CG2-CE2 3.4Å; I32-F61 HydrophobicContact CG2-CG 4.38Å; I32-F61 HydrophobicContact CG2-CZ 3.91Å; I32-A64 HydrophobicContact CG2-CB 3.98Å; I32-L65 HydrophobicContact CD1-CD2 3.82Å; I32-L70 HydrophobicContact CD1-CD1 4Å; I32-L70 HydrophobicContact CG1-CD1 4.22Å
33	F	76.2	Confident	71.6	Confident	66 Å²	66	79 Å²	79	29%	0.289	43%	0.43	S	S	.	.	H	α-helix	trans	-61.6	-44.9	174.6	-93.3	-111.5	0	0	0	111.6	F29 F35 V36 E37 L54 I57 F61	F29-F33 WeakPolarHBondContact O-CB 3.27Å; F29-F33 VanDerWaalsContact O-CD2 3.32Å; F29-F33 WeakPolarHBondContact O-CD2 3.49Å; F29-F33 PolarHBondContact O-N 3.24Å; F33-F35 PolarHBondContact O-N 2.76Å; F33-V36 PolarHBondContact O-N 2.92Å; F33-E37 WeakPolarHBondContact O-CB 3.48Å; F33-E37 WeakPolarHBondContact O-CG 3.34Å; F33-E37 PolarHBondContact O-N 3.4Å; F33-L54 HydrophobicContact CE1-CD1 3.82Å; F33-L54 HydrophobicContact CZ-CD1 4.15Å; F33-I57 HydrophobicContact CD1-CG2 3.77Å; F33-I57 HydrophobicContact CE1-CG2 3.66Å; F33-I57 HydrophobicContact CE2-CG2 4.49Å; F33-I57 HydrophobicContact CG-CG2 4.25Å; F33-I57 HydrophobicContact CZ-CG2 4.05Å; F33-F61 HydrophobicContact CD2-CE2 4.19Å; F33-F61 HydrophobicContact CE2-CD2 4.31Å; F33-F61 HydrophobicContact CE2-CE2 4.05Å
34	A	77.3	Confident	73.1	Confident	58 Å²	58	76.5 Å²	76.5	48%	0.479	42%	0.417	S	S	.	.	H	α-helix	trans	-63.9	-38	176.5	0	0	0	0	0	112.4	D30 V31 S38	D30-A34 WeakPolarHBondContact O-CB 3.47Å; D30-A34 PolarHBondContact O-N 3.2Å; V31-A34 PolarHBondContact O-N 3.21Å; A34-S38 WeakPolarHBondContact O-CB 3.24Å; A34-S38 PolarHBondContact O-N 3.01Å
35	F	78.2	Confident	74.4	Confident	67 Å²	67	78.1 Å²	78.1	29%	0.294	42%	0.418	S	S	.	.	H	α-helix	trans	-62.4	-46.5	173.1	-180	-95.9	0	0	0	111.6	V31 I32 F33 S38 K39 A64 E67	V31-F35 WeakPolarHBondContact O-CB 3.28Å; V31-F35 PolarHBondContact O-N 3.33Å; I32-F35 PolarHBondContact O-N 3.4Å; F33-F35 PolarHBondContact O-N 2.76Å; F35-S38 PolarHBondContact O-N 3.49Å; F35-K39 HydrophobicContact CE1-CD 3.94Å; F35-K39 HydrophobicContact CZ-CD 3.94Å; F35-K39 VanDerWaalsContact O-CB 3.24Å; F35-K39 WeakPolarHBondContact O-CB 3.49Å; F35-K39 PolarHBondContact O-N 3.13Å; F35-A64 HydrophobicContact CD1-CB 3.84Å; F35-A64 HydrophobicContact CE1-CB 4.13Å; F35-E67 HydrophobicContact CE1-CB 4.32Å; F35-E67 HydrophobicContact CZ-CB 4.24Å
36	V	78.3	Confident	75.5	Confident	0 Å²	0	81.6 Å²	81.6	0%	0	43%	0.432	C	S	.	.	H	α-helix	trans	-64.7	-45.6	177.4	175.6	0	0	0	0	111.5	I32 F33 S38 K39 Y40 I57 R60 A64	I32-V36 WeakPolarHBondContact O-CG2 3.25Å; I32-V36 PolarHBondContact O-N 2.89Å; F33-V36 PolarHBondContact O-N 2.92Å; V36-S38 VanDerWaalsContact C-N 3.33Å; V36-S38 PolarHBondContact O-N 3.14Å; V36-K39 PolarHBondContact O-N 3.02Å; V36-Y40 HydrophobicContact CG1-CD2 3.93Å; V36-Y40 WeakPolarHBondContact O-CB 3.37Å; V36-Y40 WeakPolarHBondContact O-CD2 3.47Å; V36-Y40 PolarHBondContact O-N 3.05Å; V36-I57 HydrophobicContact CB-CG2 4.35Å; V36-I57 HydrophobicContact CG1-CB 4.13Å; V36-I57 HydrophobicContact CG1-CG1 3.99Å; V36-I57 HydrophobicContact CG1-CG2 3.95Å; V36-R60 HydrophobicContact CG1-CB 3.8Å; V36-R60 HydrophobicContact CG1-CG 4.49Å; V36-R60 HydrophobicContact CG2-CB 4.47Å; V36-A64 HydrophobicContact CG2-CB 3.56Å
37	E	82.3	Confident	76.7	Confident	71 Å²	71	75.7 Å²	75.7	33%	0.332	40%	0.401	S	S	.	.	H	α-helix	trans	-61.3	-39.5	177	-73.9	-119.8	132.8	0	0	112.5	F33 Q41 R53 I57	F33-E37 WeakPolarHBondContact O-CB 3.48Å; F33-E37 WeakPolarHBondContact O-CG 3.34Å; F33-E37 PolarHBondContact O-N 3.4Å; E37-Q41 WeakPolarHBondContact O-CA 3.49Å; E37-Q41 WeakPolarHBondContact O-CB 3.29Å; E37-Q41 PolarHBondContact O-N 3.24Å; E37-R53 IonicContact OE1-CZ 3.62Å; E37-R53 IonicContact OE1-NE 2.73Å; E37-R53 PolarHBondContact OE1-NE 3.25Å; E37-R53 IonicContact OE1-NH2 3.61Å; E37-R53 PolarHBondContact OE1-NH2 3.41Å; E37-R53 IonicContact OE2-NH2 2.73Å; E37-R53 PolarHBondContact OE2-NH2 2.89Å; E37-I57 HydrophobicContact CG-CD1 4.08Å
38	S	81.8	Confident	77.7	Confident	90 Å²	90	76.8 Å²	76.8	63%	0.629	41%	0.408	S	S	*	.	H	α-helix	trans	-69.6	-49.6	177.4	-177.2	0	0	0	0	111.9	A34 F35 V36 Q41	A34-S38 WeakPolarHBondContact O-CB 3.24Å; A34-S38 PolarHBondContact O-N 3.01Å; F35-S38 PolarHBondContact O-N 3.49Å; V36-S38 VanDerWaalsContact C-N 3.33Å; V36-S38 PolarHBondContact O-N 3.14Å; S38-Q41 WeakPolarHBondContact O-CB 3.31Å; S38-Q41 PolarHBondContact O-N 3.47Å
39	K	81.8	Confident	78.7	Confident	99 Å²	99	78.3 Å²	78.3	43%	0.43	42%	0.416	S	S	.	.	H	α-helix	trans	-70.3	-41.4	-175.8	-178.2	163.5	-177.4	165.9	0	113	F35 V36 Q41 E67	F35-K39 HydrophobicContact CE1-CD 3.94Å; F35-K39 HydrophobicContact CZ-CD 3.94Å; F35-K39 VanDerWaalsContact O-CB 3.24Å; F35-K39 WeakPolarHBondContact O-CB 3.49Å; F35-K39 PolarHBondContact O-N 3.13Å; V36-K39 PolarHBondContact O-N 3.02Å; K39-Q41 VanDerWaalsContact C-N 3.32Å; K39-E67 WeakPolarHBondContact CE-OE2 3.35Å; K39-E67 IonicContact NZ-OE1 3.69Å; K39-E67 PolarHBondContact NZ-OE1 3.33Å; K39-E67 IonicContact NZ-OE2 2.78Å; K39-E67 PolarHBondContact NZ-OE2 2.91Å
40	Y	83.4	Confident	79.4	Confident	38 Å²	38	79.3 Å²	79.3	15%	0.149	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	18.8	-179.5	-61.5	-85	0	0	0	112.1	V36 A42 E43 L44 R60	V36-Y40 HydrophobicContact CG1-CD2 3.93Å; V36-Y40 WeakPolarHBondContact O-CB 3.37Å; V36-Y40 WeakPolarHBondContact O-CD2 3.47Å; V36-Y40 PolarHBondContact O-N 3.05Å; Y40-A42 PolarHBondContact O-N 3.44Å; Y40-E43 WeakPolarHBondContact CD1-OE2 3.19Å; Y40-E43 WeakPolarHBondContact O-CA 3.43Å; Y40-E43 WeakPolarHBondContact O-CB 3.32Å; Y40-E43 PolarHBondContact O-N 3.05Å; Y40-L44 WeakPolarHBondContact O-CG 3.28Å; Y40-L44 PolarHBondContact O-N 3.44Å; Y40-R60 HydrophobicContact CD1-CG 4.07Å; Y40-R60 HydrophobicContact CD2-CB 4.07Å; Y40-R60 HydrophobicContact CD2-CG 3.95Å; Y40-R60 HydrophobicContact CE1-CG 4.07Å; Y40-R60 HydrophobicContact CE2-CB 3.84Å; Y40-R60 HydrophobicContact CE2-CG 3.93Å; Y40-R60 HydrophobicContact CG-CG 4.03Å
41	Q	84.4	Confident	79.8	Confident	141 Å²	141	81.9 Å²	81.9	66%	0.659	44%	0.436	S	S	*	.	H	α-helix	trans	-50.9	-37.5	-178.1	-168.5	-174.2	39.7	0	0	113	E37 S38 K39 L44 K45	E37-Q41 WeakPolarHBondContact O-CA 3.49Å; E37-Q41 WeakPolarHBondContact O-CB 3.29Å; E37-Q41 PolarHBondContact O-N 3.24Å; S38-Q41 WeakPolarHBondContact O-CB 3.31Å; S38-Q41 PolarHBondContact O-N 3.47Å; K39-Q41 VanDerWaalsContact C-N 3.32Å; Q41-L44 PolarHBondContact O-N 3.06Å; Q41-K45 WeakPolarHBondContact O-CB 3.49Å; Q41-K45 PolarHBondContact O-N 3.3Å
42	A	81.1	Confident	80.1	Confident	86 Å²	86	81.2 Å²	81.2	71%	0.711	43%	0.429	S	S	*	.	H	α-helix	trans	-68.3	-39.9	176.9	0	0	0	0	0	113.2	Y40	Y40-A42 PolarHBondContact O-N 3.44Å
43	E	79.7	Confident	80.8	Confident	74 Å²	74	84.7 Å²	84.7	35%	0.346	44%	0.441	S	S	.	.	H	α-helix	trans	-69.5	-35.6	174.9	179.9	171.9	-153.9	0	0	111.1	Y40 V47 I56 R60	Y40-E43 WeakPolarHBondContact CD1-OE2 3.19Å; Y40-E43 WeakPolarHBondContact O-CA 3.43Å; Y40-E43 WeakPolarHBondContact O-CB 3.32Å; Y40-E43 PolarHBondContact O-N 3.05Å; E43-V47 WeakPolarHBondContact O-CG2 3.38Å; E43-I56 HydrophobicContact CG-CG2 4.19Å; E43-R60 VanDerWaalsContact CD-NH2 3.33Å; E43-R60 IonicContact OE1-CZ 2.78Å; E43-R60 IonicContact OE1-NE 2.65Å; E43-R60 IonicContact OE1-NH2 3.9Å; E43-R60 PolarHBondContact OE1-NH2 2.98Å; E43-R60 IonicContact OE2-CZ 3.01Å; E43-R60 IonicContact OE2-NE 3.16Å; E43-R60 PolarHBondContact OE2-NE 3.06Å; E43-R60 IonicContact OE2-NH2 3.03Å; E43-R60 PolarHBondContact OE2-NH2 3.28Å; E43-R60 VanDerWaalsContact OE2-NH2 3.16Å
44	L	84.9	Confident	80.9	Confident	2 Å²	2	85.2 Å²	85.2	1%	0.01	45%	0.447	C	S	.	.	H	α-helix	trans	-85.1	-8.4	-177.9	-61.1	169.2	0	0	0	113.9	Y40 Q41 R53 I56 I57	Y40-L44 WeakPolarHBondContact O-CG 3.28Å; Y40-L44 PolarHBondContact O-N 3.44Å; Q41-L44 PolarHBondContact O-N 3.06Å; L44-R53 HydrophobicContact CD2-CG 3.84Å; L44-R53 PolarHBondContact O-NH1 2.91Å; L44-I56 HydrophobicContact CD2-CB 4.05Å; L44-I56 HydrophobicContact CD2-CG2 3.75Å; L44-I57 HydrophobicContact CD1-CG1 4.34Å; L44-I57 HydrophobicContact CD2-CG1 4.26Å
45	K	82.7	Confident	81	Confident	160 Å²	160	86.7 Å²	86.7	70%	0.696	44%	0.444	S	S	*	.	S	Bend	trans	-69.3	-40.1	-174.1	-171.8	176.5	178.3	-174.5	0	113.4	Q41	Q41-K45 WeakPolarHBondContact O-CB 3.49Å; Q41-K45 PolarHBondContact O-N 3.3Å
46	D	80.8	Confident	81	Confident	130 Å²	130	84.5 Å²	84.5	70%	0.695	44%	0.435	S	S	*	.	S	Bend	trans	-94.9	-0.8	-176.4	-57.5	-34.9	0	0	0	112.1	N48	D46-N48 PolarHBondContact O-N 3.39Å; D46-N48 VanDerWaalsContact O-N 3.09Å; D46-N48 PolarHBondContact O-ND2 2.85Å
47	V	82	Confident	81.1	Confident	25 Å²	25	84.7 Å²	84.7	15%	0.152	44%	0.436	C	S	.	.			trans	-87.5	78.1	-176.8	-176.3	0	0	0	0	110.6	E43 N49 L52 R53 I56	E43-V47 WeakPolarHBondContact O-CG2 3.38Å; V47-N49 PolarHBondContact O-N 3.47Å; V47-L52 HydrophobicContact CG1-CB 3.88Å; V47-L52 HydrophobicContact CG1-CD2 4.05Å; V47-L52 HydrophobicContact CG1-CG 3.8Å; V47-R53 HydrophobicContact CG1-CB 4Å; V47-I56 HydrophobicContact CG1-CD1 4.14Å; V47-I56 HydrophobicContact CG2-CD1 3.74Å
48	N	82.6	Confident	80.9	Confident	153 Å²	153	86.8 Å²	86.8	82%	0.818	45%	0.445	S	S	*	.			trans	-69.7	-8.5	179.1	-67.5	-58	0	0	0	114.8	D46	D46-N48 PolarHBondContact O-N 3.39Å; D46-N48 VanDerWaalsContact O-N 3.09Å; D46-N48 PolarHBondContact O-ND2 2.85Å
49	N	83.2	Confident	80.6	Confident	83 Å²	83	87.6 Å²	87.6	44%	0.444	44%	0.44	S	S	.	.			trans	-95.7	114	178.5	178	-17.9	0	0	0	110.1	V47 K51 L52 R53	V47-N49 PolarHBondContact O-N 3.47Å; N49-K51 VanDerWaalsContact C-N 3.29Å; N49-K51 PolarHBondContact O-N 2.85Å; N49-K51 WeakPolarHBondContact OD1-CB 3.49Å; N49-K51 PolarHBondContact OD1-N 2.95Å; N49-L52 HydrophobicContact CB-CB 3.94Å; N49-L52 PolarHBondContact O-N 3.45Å; N49-L52 PolarHBondContact OD1-N 2.92Å; N49-R53 PolarHBondContact O-N 3.26Å
50	P	81.4	Confident	80.6	Confident	99 Å²	99	85.7 Å²	85.7	64%	0.643	43%	0.43	S	S	*	.	H	α-helix	trans	-65.7	-28.1	-174.6	25.7	-34.4	0	0	0	113.7	L54	P50-L54 WeakPolarHBondContact O-CB 3.42Å; P50-L54 PolarHBondContact O-N 2.95Å
51	K	77.4	Confident	80.3	Confident	177 Å²	177	86.1 Å²	86.1	77%	0.77	43%	0.432	S	S	*	.	H	α-helix	trans	-68.6	-39.3	173.1	-67.8	-173.6	176.1	-175.8	0	111.4	N49 H55	N49-K51 VanDerWaalsContact C-N 3.29Å; N49-K51 PolarHBondContact O-N 2.85Å; N49-K51 WeakPolarHBondContact OD1-CB 3.49Å; N49-K51 PolarHBondContact OD1-N 2.95Å; K51-H55 WeakPolarHBondContact O-CB 3.31Å; K51-H55 PolarHBondContact O-N 2.79Å
52	L	73.6	Confident	79.5	Confident	83 Å²	83	83 Å²	83	44%	0.435	43%	0.426	S	S	.	.	H	α-helix	trans	-70.3	-39.1	176.5	-175.1	58.2	0	0	0	111.1	V47 N49 H55 I56	V47-L52 HydrophobicContact CG1-CB 3.88Å; V47-L52 HydrophobicContact CG1-CD2 4.05Å; V47-L52 HydrophobicContact CG1-CG 3.8Å; N49-L52 HydrophobicContact CB-CB 3.94Å; N49-L52 PolarHBondContact O-N 3.45Å; N49-L52 PolarHBondContact OD1-N 2.92Å; L52-H55 PolarHBondContact O-N 2.79Å; L52-I56 HydrophobicContact CG-CD1 4.23Å; L52-I56 WeakPolarHBondContact O-CG1 3.5Å; L52-I56 PolarHBondContact O-N 2.94Å
53	R	84.2	Confident	79.1	Confident	76 Å²	76	81.9 Å²	81.9	29%	0.287	41%	0.408	S	S	.	.	H	α-helix	trans	-58.2	-51.2	173.7	-166.2	-172.6	176.6	98.1	-5.9	111.2	E37 L44 V47 N49 H55 I56 I57	E37-R53 IonicContact OE1-CZ 3.62Å; E37-R53 IonicContact OE1-NE 2.73Å; E37-R53 PolarHBondContact OE1-NE 3.25Å; E37-R53 IonicContact OE1-NH2 3.61Å; E37-R53 PolarHBondContact OE1-NH2 3.41Å; E37-R53 IonicContact OE2-NH2 2.73Å; E37-R53 PolarHBondContact OE2-NH2 2.89Å; L44-R53 HydrophobicContact CD2-CG 3.84Å; L44-R53 PolarHBondContact O-NH1 2.91Å; V47-R53 HydrophobicContact CG1-CB 4Å; N49-R53 PolarHBondContact O-N 3.26Å; R53-H55 VanDerWaalsContact C-N 3.32Å; R53-H55 PolarHBondContact O-N 3.22Å; R53-I56 PolarHBondContact O-N 3.42Å; R53-I57 HydrophobicContact CG-CD1 4.3Å; R53-I57 WeakPolarHBondContact O-CG1 3.29Å; R53-I57 PolarHBondContact O-N 3.18Å
54	L	78.9	Confident	78.7	Confident	78 Å²	78	78.3 Å²	78.3	41%	0.408	39%	0.391	S	S	.	.	H	α-helix	trans	-61.3	-39.3	176	-177.5	62.4	0	0	0	112.1	F33 P50 I57 Q58	F33-L54 HydrophobicContact CE1-CD1 3.82Å; F33-L54 HydrophobicContact CZ-CD1 4.15Å; P50-L54 WeakPolarHBondContact O-CB 3.42Å; P50-L54 PolarHBondContact O-N 2.95Å; L54-I57 PolarHBondContact O-N 3.27Å; L54-Q58 WeakPolarHBondContact O-CB 3.4Å; L54-Q58 VanDerWaalsContact O-CG 3.31Å; L54-Q58 WeakPolarHBondContact O-CG 3.2Å; L54-Q58 PolarHBondContact O-N 3.09Å
55	H	78.3	Confident	78	Confident	88 Å²	88	80.3 Å²	80.3	41%	0.407	40%	0.402	S	S	.	.	H	α-helix	trans	-65.7	-39.2	177.7	-172.4	63.5	0	0	0	112.8	K51 L52 R53 Q58 Q59	K51-H55 WeakPolarHBondContact O-CB 3.31Å; K51-H55 PolarHBondContact O-N 2.79Å; L52-H55 PolarHBondContact O-N 2.79Å; R53-H55 VanDerWaalsContact C-N 3.32Å; R53-H55 PolarHBondContact O-N 3.22Å; H55-Q58 PolarHBondContact O-N 3.49Å; H55-Q59 PolarHBondContact NE2-NE2 2.69Å; H55-Q59 WeakPolarHBondContact O-CG 3.49Å; H55-Q59 PolarHBondContact O-N 2.84Å
56	I	78.4	Confident	77.3	Confident	21 Å²	21	78.9 Å²	78.9	11%	0.108	40%	0.397	C	S	.	.	H	α-helix	trans	-63.3	-46.6	172.7	-67.9	164.8	0	0	0	109.8	E43 L44 V47 L52 R53 Q58 Q59 R60	E43-I56 HydrophobicContact CG-CG2 4.19Å; L44-I56 HydrophobicContact CD2-CB 4.05Å; L44-I56 HydrophobicContact CD2-CG2 3.75Å; V47-I56 HydrophobicContact CG1-CD1 4.14Å; V47-I56 HydrophobicContact CG2-CD1 3.74Å; L52-I56 HydrophobicContact CG-CD1 4.23Å; L52-I56 WeakPolarHBondContact O-CG1 3.5Å; L52-I56 PolarHBondContact O-N 2.94Å; R53-I56 PolarHBondContact O-N 3.42Å; I56-Q58 VanDerWaalsContact C-N 3.31Å; I56-Q58 PolarHBondContact O-N 3.28Å; I56-Q59 PolarHBondContact O-N 3.31Å; I56-Q59 VanDerWaalsContact O-N 3.09Å; I56-R60 HydrophobicContact CG2-CG 4.31Å; I56-R60 WeakPolarHBondContact O-CG 3.3Å; I56-R60 PolarHBondContact O-N 3.11Å
57	I	80.1	Confident	76.7	Confident	5 Å²	5	76.9 Å²	76.9	3%	0.026	38%	0.384	C	S	.	.	H	α-helix	trans	-56.9	-45.4	176.9	-67	163.7	0	0	0	110.9	F33 V36 E37 L44 R53 L54 Q59 R60 F61	F33-I57 HydrophobicContact CD1-CG2 3.77Å; F33-I57 HydrophobicContact CE1-CG2 3.66Å; F33-I57 HydrophobicContact CE2-CG2 4.49Å; F33-I57 HydrophobicContact CG-CG2 4.25Å; F33-I57 HydrophobicContact CZ-CG2 4.05Å; V36-I57 HydrophobicContact CB-CG2 4.35Å; V36-I57 HydrophobicContact CG1-CB 4.13Å; V36-I57 HydrophobicContact CG1-CG1 3.99Å; V36-I57 HydrophobicContact CG1-CG2 3.95Å; E37-I57 HydrophobicContact CG-CD1 4.08Å; L44-I57 HydrophobicContact CD1-CG1 4.34Å; L44-I57 HydrophobicContact CD2-CG1 4.26Å; R53-I57 HydrophobicContact CG-CD1 4.3Å; R53-I57 WeakPolarHBondContact O-CG1 3.29Å; R53-I57 PolarHBondContact O-N 3.18Å; L54-I57 PolarHBondContact O-N 3.27Å; I57-Q59 PolarHBondContact O-N 2.97Å; I57-R60 PolarHBondContact O-N 3.29Å; I57-R60 VanDerWaalsContact O-N 3.14Å; I57-F61 PolarHBondContact O-N 3.47Å
58	Q	77.4	Confident	76	Confident	114 Å²	114	78.2 Å²	78.2	53%	0.533	39%	0.393	S	S	.	.	H	α-helix	trans	-61.3	-39.6	175.2	-73.7	172.5	-19.6	0	0	113.1	L54 H55 I56 R60 F61	L54-Q58 WeakPolarHBondContact O-CB 3.4Å; L54-Q58 VanDerWaalsContact O-CG 3.31Å; L54-Q58 WeakPolarHBondContact O-CG 3.2Å; L54-Q58 PolarHBondContact O-N 3.09Å; H55-Q58 PolarHBondContact O-N 3.49Å; I56-Q58 VanDerWaalsContact C-N 3.31Å; I56-Q58 PolarHBondContact O-N 3.28Å; Q58-R60 VanDerWaalsContact C-N 3.32Å; Q58-R60 PolarHBondContact O-N 3.5Å; Q58-F61 WeakPolarHBondContact O-CB 3.45Å; Q58-F61 PolarHBondContact O-N 3.46Å
59	Q	76.8	Confident	75.1	Confident	108 Å²	108	72.2 Å²	72.2	51%	0.505	37%	0.368	S	S	.	.	H	α-helix	trans	-69.8	-25.7	174.4	-73.3	-166.1	21.9	0	0	113.6	H55 I56 I57	H55-Q59 PolarHBondContact NE2-NE2 2.69Å; H55-Q59 WeakPolarHBondContact O-CG 3.49Å; H55-Q59 PolarHBondContact O-N 2.84Å; I56-Q59 PolarHBondContact O-N 3.31Å; I56-Q59 VanDerWaalsContact O-N 3.09Å; I57-Q59 PolarHBondContact O-N 2.97Å
60	R	80.6	Confident	74.2	Confident	59 Å²	59	70.3 Å²	70.3	22%	0.223	36%	0.358	C	S	.	.	H	α-helix	trans	-89.1	-13.4	176.7	-59.9	-58.2	177	-127.4	-4.3	113.3	V36 Y40 E43 I56 I57 Q58 S62 L63 A64	V36-R60 HydrophobicContact CG1-CB 3.8Å; V36-R60 HydrophobicContact CG1-CG 4.49Å; V36-R60 HydrophobicContact CG2-CB 4.47Å; Y40-R60 HydrophobicContact CD1-CG 4.07Å; Y40-R60 HydrophobicContact CD2-CB 4.07Å; Y40-R60 HydrophobicContact CD2-CG 3.95Å; Y40-R60 HydrophobicContact CE1-CG 4.07Å; Y40-R60 HydrophobicContact CE2-CB 3.84Å; Y40-R60 HydrophobicContact CE2-CG 3.93Å; Y40-R60 HydrophobicContact CG-CG 4.03Å; E43-R60 VanDerWaalsContact CD-NH2 3.33Å; E43-R60 IonicContact OE1-CZ 2.78Å; E43-R60 IonicContact OE1-NE 2.65Å; E43-R60 IonicContact OE1-NH2 3.9Å; E43-R60 PolarHBondContact OE1-NH2 2.98Å; E43-R60 IonicContact OE2-CZ 3.01Å; E43-R60 IonicContact OE2-NE 3.16Å; E43-R60 PolarHBondContact OE2-NE 3.06Å; E43-R60 IonicContact OE2-NH2 3.03Å; E43-R60 PolarHBondContact OE2-NH2 3.28Å; E43-R60 VanDerWaalsContact OE2-NH2 3.16Å; I56-R60 HydrophobicContact CG2-CG 4.31Å; I56-R60 WeakPolarHBondContact O-CG 3.3Å; I56-R60 PolarHBondContact O-N 3.11Å; I57-R60 PolarHBondContact O-N 3.29Å; I57-R60 VanDerWaalsContact O-N 3.14Å; Q58-R60 VanDerWaalsContact C-N 3.32Å; Q58-R60 PolarHBondContact O-N 3.5Å; R60-S62 VanDerWaalsContact C-N 3.34Å; R60-S62 PolarHBondContact O-N 3.27Å; R60-L63 WeakPolarHBondContact O-CB 3.47Å; R60-L63 PolarHBondContact O-N 3.41Å; R60-L63 VanDerWaalsContact O-N 3.11Å; R60-A64 PolarHBondContact O-N 3.14Å
61	F	77.2	Confident	73.4	Confident	46 Å²	46	68.8 Å²	68.8	20%	0.202	34%	0.343	C	S	.	.	H	α-helix	trans	-57.5	-40	-175	-162.5	-90.8	0	0	0	113.7	F29 I32 F33 I57 Q58 A64 L65	F29-F61 HydrophobicContact CD1-CE2 4.12Å; F29-F61 AromaticContact CD1-CZ 3.89Å; F29-F61 HydrophobicContact CD1-CZ 3.89Å; F29-F61 HydrophobicContact CE1-CE2 4.32Å; F29-F61 AromaticContact CE1-CZ 3.72Å; F29-F61 HydrophobicContact CE1-CZ 3.72Å; I32-F61 HydrophobicContact CB-CE2 3.99Å; I32-F61 HydrophobicContact CB-CZ 4.38Å; I32-F61 HydrophobicContact CD1-CE2 4.42Å; I32-F61 HydrophobicContact CD1-CZ 3.95Å; I32-F61 HydrophobicContact CG2-CD2 3.67Å; I32-F61 HydrophobicContact CG2-CE2 3.4Å; I32-F61 HydrophobicContact CG2-CG 4.38Å; I32-F61 HydrophobicContact CG2-CZ 3.91Å; F33-F61 HydrophobicContact CD2-CE2 4.19Å; F33-F61 HydrophobicContact CE2-CD2 4.31Å; F33-F61 HydrophobicContact CE2-CE2 4.05Å; I57-F61 PolarHBondContact O-N 3.47Å; Q58-F61 WeakPolarHBondContact O-CB 3.45Å; Q58-F61 PolarHBondContact O-N 3.46Å; F61-A64 PolarHBondContact O-N 2.95Å; F61-L65 HydrophobicContact CD1-CD1 3.98Å; F61-L65 HydrophobicContact CD1-CG 4.32Å; F61-L65 HydrophobicContact CE1-CD1 3.87Å; F61-L65 HydrophobicContact CE1-CG 4.21Å; F61-L65 PolarHBondContact O-N 2.84Å
62	S	68.9	Low	72.7	Confident	76 Å²	76	65.6 Å²	65.6	53%	0.531	33%	0.334	S	S	.	.	H	α-helix	trans	-68	-36.4	177.5	60.7	0	0	0	0	113.1	R60 L65 E66	R60-S62 VanDerWaalsContact C-N 3.34Å; R60-S62 PolarHBondContact O-N 3.27Å; S62-L65 PolarHBondContact O-N 2.93Å; S62-E66 PolarHBondContact O-N 2.96Å
63	L	72.5	Confident	72.2	Confident	62 Å²	62	67.4 Å²	67.4	33%	0.325	34%	0.341	S	S	.	.	H	α-helix	trans	-67.9	-38.2	173.8	-78.8	156.3	0	0	0	110.7	R60 L65 E66 E67	R60-L63 WeakPolarHBondContact O-CB 3.47Å; R60-L63 PolarHBondContact O-N 3.41Å; R60-L63 VanDerWaalsContact O-N 3.11Å; L63-L65 PolarHBondContact O-N 3.35Å; L63-E66 PolarHBondContact O-N 2.9Å; L63-E67 WeakPolarHBondContact O-CB 3.46Å; L63-E67 WeakPolarHBondContact O-CG 3.36Å; L63-E67 PolarHBondContact O-N 2.96Å
64	A	71.7	Confident	71.1	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-62.6	-39.8	174.2	0	0	0	0	0	112.5	I32 F35 V36 R60 F61 E67 C68	I32-A64 HydrophobicContact CG2-CB 3.98Å; F35-A64 HydrophobicContact CD1-CB 3.84Å; F35-A64 HydrophobicContact CE1-CB 4.13Å; V36-A64 HydrophobicContact CG2-CB 3.56Å; R60-A64 PolarHBondContact O-N 3.14Å; F61-A64 PolarHBondContact O-N 2.95Å; A64-E67 PolarHBondContact O-N 3.45Å; A64-C68 VanDerWaalsContact O-CB 3.24Å; A64-C68 WeakPolarHBondContact O-CB 3.24Å; A64-C68 PolarHBondContact O-N 3.09Å; A64-C68 PolarHBondContact O-SG 3.29Å
65	L	68.4	Low	70.4	Confident	44 Å²	44	65.6 Å²	65.6	23%	0.23	34%	0.336	C	S	.	.	H	α-helix	trans	-63.6	-39.2	174.1	-71.1	173.1	0	0	0	112.9	I32 F61 S62 L63 L70 I71	I32-L65 HydrophobicContact CD1-CD2 3.82Å; F61-L65 HydrophobicContact CD1-CD1 3.98Å; F61-L65 HydrophobicContact CD1-CG 4.32Å; F61-L65 HydrophobicContact CE1-CD1 3.87Å; F61-L65 HydrophobicContact CE1-CG 4.21Å; F61-L65 PolarHBondContact O-N 2.84Å; S62-L65 PolarHBondContact O-N 2.93Å; L63-L65 PolarHBondContact O-N 3.35Å; L65-L70 HydrophobicContact CD2-CB 4.32Å; L65-L70 HydrophobicContact CD2-CD1 3.86Å; L65-I71 HydrophobicContact CB-CD1 4.4Å; L65-I71 HydrophobicContact CB-CG1 4.36Å
66	E	68.2	Low	69.7	Low	129 Å²	129	69.3 Å²	69.3	60%	0.603	35%	0.354	S	S	*	.	H	α-helix	trans	-64.5	-40.8	172.4	-74.4	178.9	163.8	0	0	111.9	S62 L63 I71	S62-E66 PolarHBondContact O-N 2.96Å; L63-E66 PolarHBondContact O-N 2.9Å; E66-I71 HydrophobicContact CB-CD1 4.29Å; E66-I71 HydrophobicContact CG-CD1 3.54Å
67	E	69.3	Low	69	Low	89 Å²	89	72.2 Å²	72.2	42%	0.416	38%	0.376	S	S	.	.	H	α-helix	trans	-86	-21	-173.2	-67.6	177.9	135.5	0	0	114.6	F35 K39 L63 A64 G69	F35-E67 HydrophobicContact CE1-CB 4.32Å; F35-E67 HydrophobicContact CZ-CB 4.24Å; K39-E67 WeakPolarHBondContact CE-OE2 3.35Å; K39-E67 IonicContact NZ-OE1 3.69Å; K39-E67 PolarHBondContact NZ-OE1 3.33Å; K39-E67 IonicContact NZ-OE2 2.78Å; K39-E67 PolarHBondContact NZ-OE2 2.91Å; L63-E67 WeakPolarHBondContact O-CB 3.46Å; L63-E67 WeakPolarHBondContact O-CG 3.36Å; L63-E67 PolarHBondContact O-N 2.96Å; A64-E67 PolarHBondContact O-N 3.45Å; E67-G69 VanDerWaalsContact C-N 3.35Å
68	C	67.3	Low	68.1	Low	52 Å²	52	74.7 Å²	74.7	35%	0.351	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-5.4	173.8	-71.5	0	0	0	0	113.6	A64 L70	A64-C68 VanDerWaalsContact O-CB 3.24Å; A64-C68 WeakPolarHBondContact O-CB 3.24Å; A64-C68 PolarHBondContact O-N 3.09Å; A64-C68 PolarHBondContact O-SG 3.29Å; C68-L70 HydrophobicContact CB-CD1 4.01Å; C68-L70 HydrophobicContact CB-CG 4.17Å; C68-L70 PolarHBondContact O-N 3.25Å
69	G	62.9	Low	67.4	Low	27 Å²	27	73.7 Å²	73.7	28%	0.278	39%	0.39	S	S	.	.	S	Bend	trans	76.8	-3.2	-179.7	0	0	0	0	0	115.4	E67 I71 D72	E67-G69 VanDerWaalsContact C-N 3.35Å; G69-I71 PolarHBondContact O-N 2.98Å; G69-I71 VanDerWaalsContact O-N 3.09Å; G69-D72 PolarHBondContact O-N 3Å
70	L	64.8	Low	66.9	Low	44 Å²	44	77.6 Å²	77.6	23%	0.23	41%	0.408	C	S	.	.	H	α-helix	trans	-58.2	-25.6	-179.1	-69.8	165.2	0	0	0	113.3	I32 L65 C68 D72 E73 I74	I32-L70 HydrophobicContact CD1-CD1 4Å; I32-L70 HydrophobicContact CG1-CD1 4.22Å; L65-L70 HydrophobicContact CD2-CB 4.32Å; L65-L70 HydrophobicContact CD2-CD1 3.86Å; C68-L70 HydrophobicContact CB-CD1 4.01Å; C68-L70 HydrophobicContact CB-CG 4.17Å; C68-L70 PolarHBondContact O-N 3.25Å; L70-D72 VanDerWaalsContact C-N 3.33Å; L70-E73 PolarHBondContact O-N 3.06Å; L70-I74 WeakPolarHBondContact O-CD1 3.34Å; L70-I74 VanDerWaalsContact O-CG1 3.29Å; L70-I74 WeakPolarHBondContact O-CG1 3.32Å; L70-I74 PolarHBondContact O-N 3.43Å
71	I	64.1	Low	66.1	Low	66 Å²	66	77.9 Å²	77.9	34%	0.338	41%	0.414	S	S	.	.	H	α-helix	trans	-65	-36.1	174.3	-68.3	-179.7	0	0	0	111.9	L65 E66 G69 I74 I75	L65-I71 HydrophobicContact CB-CD1 4.4Å; L65-I71 HydrophobicContact CB-CG1 4.36Å; E66-I71 HydrophobicContact CB-CD1 4.29Å; E66-I71 HydrophobicContact CG-CD1 3.54Å; G69-I71 PolarHBondContact O-N 2.98Å; G69-I71 VanDerWaalsContact O-N 3.09Å; I71-I74 PolarHBondContact O-N 3.42Å; I71-I75 HydrophobicContact CG2-CD1 3.91Å; I71-I75 WeakPolarHBondContact O-CD1 3.44Å; I71-I75 VanDerWaalsContact O-CG1 3.25Å; I71-I75 WeakPolarHBondContact O-CG1 3.35Å; I71-I75 PolarHBondContact O-N 3.31Å
72	D	64.1	Low	65.6	Low	110 Å²	110	80.8 Å²	80.8	59%	0.588	43%	0.431	S	S	*	.	H	α-helix	trans	-71.6	-39.1	177.7	-68.2	-41	0	0	0	110.8	G69 L70 I74 I75 E76	G69-D72 PolarHBondContact O-N 3Å; L70-D72 VanDerWaalsContact C-N 3.33Å; D72-I74 VanDerWaalsContact C-N 3.35Å; D72-I74 PolarHBondContact O-N 2.9Å; D72-I75 PolarHBondContact O-N 3.02Å; D72-I75 VanDerWaalsContact O-N 3.13Å; D72-E76 PolarHBondContact O-N 3.28Å
73	E	61.9	Low	65.6	Low	122 Å²	122	80.5 Å²	80.5	57%	0.57	42%	0.424	S	S	*	.	H	α-helix	trans	-61.9	-39.3	173	-68.6	-170.8	144.4	0	0	112.4	L70 I75 E76 S77	L70-E73 PolarHBondContact O-N 3.06Å; E73-I75 VanDerWaalsContact C-N 3.32Å; E73-I75 PolarHBondContact O-N 2.84Å; E73-E76 PolarHBondContact O-N 3.48Å; E73-S77 VanDerWaalsContact O-CB 3.25Å; E73-S77 WeakPolarHBondContact O-CB 3.44Å; E73-S77 PolarHBondContact O-N 2.93Å; E73-S77 PolarHBondContact O-OG 2.93Å
74	I	62.3	Low	65.5	Low	77 Å²	77	81.6 Å²	81.6	40%	0.395	43%	0.43	S	S	.	.	H	α-helix	trans	-65.5	-35.9	174	-68.7	164.6	0	0	0	111.2	L70 I71 D72 F78	L70-I74 WeakPolarHBondContact O-CD1 3.34Å; L70-I74 VanDerWaalsContact O-CG1 3.29Å; L70-I74 WeakPolarHBondContact O-CG1 3.32Å; L70-I74 PolarHBondContact O-N 3.43Å; I71-I74 PolarHBondContact O-N 3.42Å; D72-I74 VanDerWaalsContact C-N 3.35Å; D72-I74 PolarHBondContact O-N 2.9Å; I74-F78 HydrophobicContact CG2-CD2 4.45Å; I74-F78 PolarHBondContact O-N 3.45Å
75	I	63	Low	65.7	Low	39 Å²	39	84.2 Å²	84.2	20%	0.2	45%	0.451	C	S	.	.	H	α-helix	trans	-70.4	-38.7	176.7	-72.7	166.6	0	0	0	111.6	I71 D72 E73 N84	I71-I75 HydrophobicContact CG2-CD1 3.91Å; I71-I75 WeakPolarHBondContact O-CD1 3.44Å; I71-I75 VanDerWaalsContact O-CG1 3.25Å; I71-I75 WeakPolarHBondContact O-CG1 3.35Å; I71-I75 PolarHBondContact O-N 3.31Å; D72-I75 PolarHBondContact O-N 3.02Å; D72-I75 VanDerWaalsContact O-N 3.13Å; E73-I75 VanDerWaalsContact C-N 3.32Å; E73-I75 PolarHBondContact O-N 2.84Å; I75-N84 VanDerWaalsContact CG2-ND2 3.28Å; I75-N84 WeakPolarHBondContact CG2-ND2 3.39Å
76	E	64.1	Low	66.1	Low	166 Å²	166	90.6 Å²	90.6	78%	0.776	47%	0.472	S	S	*	.	H	α-helix	trans	-72.3	-34.1	175	-69.1	-160.1	155.7	0	0	112.8	D72 E73	D72-E76 PolarHBondContact O-N 3.28Å; E73-E76 PolarHBondContact O-N 3.48Å
77	S	63.6	Low	66.4	Low	81 Å²	81	87.9 Å²	87.9	57%	0.566	46%	0.461	S	S	*	.	H	α-helix	trans	-72	-29.4	-176.8	-62.2	0	0	0	0	114.2	E73 P79	E73-S77 VanDerWaalsContact O-CB 3.25Å; E73-S77 WeakPolarHBondContact O-CB 3.44Å; E73-S77 PolarHBondContact O-N 2.93Å; E73-S77 PolarHBondContact O-OG 2.93Å; S77-P79 VanDerWaalsContact C-CD 3.41Å; S77-P79 WeakPolarHBondContact O-CD 3.36Å
78	F	61.6	Low	66.9	Low	57 Å²	57	88.3 Å²	88.3	25%	0.25	47%	0.466	C	S	.	.			trans	-124.1	60.2	-173.7	-61.8	-80.4	0	0	0	113.9	I74 E80 L81	I74-F78 HydrophobicContact CG2-CD2 4.45Å; I74-F78 PolarHBondContact O-N 3.45Å; F78-E80 PolarHBondContact O-N 3.27Å; F78-L81 HydrophobicContact CB-CD1 3.64Å; F78-L81 HydrophobicContact CB-CG 4.06Å; F78-L81 HydrophobicContact CG-CD1 4.19Å; F78-L81 PolarHBondContact O-N 2.73Å
79	P	62.1	Low	67.6	Low	94 Å²	94	91.8 Å²	91.8	61%	0.61	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-62.6	-28.7	-176.5	26.3	-35	0	0	0	113.3	S77 L81 N82	S77-P79 VanDerWaalsContact C-CD 3.41Å; S77-P79 WeakPolarHBondContact O-CD 3.36Å; P79-L81 VanDerWaalsContact C-N 3.26Å; P79-L81 PolarHBondContact O-N 3.02Å; P79-N82 PolarHBondContact O-N 2.78Å
80	E	66.4	Low	68.4	Low	189 Å²	189	95 Å²	95	88%	0.883	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-65	-27.1	-179.3	-61.7	-162.5	-155.2	0	0	113.5	F78 N82	F78-E80 PolarHBondContact O-N 3.27Å; E80-N82 PolarHBondContact O-N 3.06Å; E80-N82 VanDerWaalsContact O-N 3.17Å
81	L	63.3	Low	69.2	Low	66 Å²	66	97.7 Å²	97.7	35%	0.346	50%	0.496	S	S	.	.	G	3₁₀ helix	trans	-67.7	-13.2	177.5	-67.9	178.5	0	0	0	113.5	L15 F78 P79 L83	L15-L81 HydrophobicContact CD1-CD1 4.17Å; L15-L81 HydrophobicContact CD1-CD2 3.82Å; L15-L81 HydrophobicContact CD1-CG 4.43Å; L15-L81 HydrophobicContact CD2-CD1 3.85Å; L15-L81 HydrophobicContact CD2-CD2 3.63Å; L15-L81 HydrophobicContact CD2-CG 4.4Å; L15-L81 HydrophobicContact CG-CD2 4.39Å; F78-L81 HydrophobicContact CB-CD1 3.64Å; F78-L81 HydrophobicContact CB-CG 4.06Å; F78-L81 HydrophobicContact CG-CD1 4.19Å; F78-L81 PolarHBondContact O-N 2.73Å; P79-L81 VanDerWaalsContact C-N 3.26Å; P79-L81 PolarHBondContact O-N 3.02Å; L81-L83 HydrophobicContact CB-CD1 4.3Å; L81-L83 HydrophobicContact CB-CD2 4.18Å; L81-L83 HydrophobicContact CB-CG 3.74Å; L81-L83 HydrophobicContact CD1-CD1 4.07Å; L81-L83 HydrophobicContact CD1-CG 4.31Å; L81-L83 PolarHBondContact O-N 3.01Å; L81-L83 VanDerWaalsContact O-N 3.14Å
82	N	67.9	Low	70.2	Confident	107 Å²	107	102 Å²	102	57%	0.572	51%	0.512	S	S	*	.			trans	54.7	31.8	-179.7	-115.3	-58.1	0	0	0	112.9	P79 E80 N84 A85 R86	P79-N82 PolarHBondContact O-N 2.78Å; E80-N82 PolarHBondContact O-N 3.06Å; E80-N82 VanDerWaalsContact O-N 3.17Å; N82-N84 VanDerWaalsContact C-N 3.27Å; N82-N84 PolarHBondContact O-N 3.46Å; N82-A85 HydrophobicContact CB-CB 4.39Å; N82-A85 PolarHBondContact O-N 3.14Å; N82-A85 VanDerWaalsContact OD1-CB 3.27Å; N82-A85 WeakPolarHBondContact OD1-CB 3.46Å; N82-R86 PolarHBondContact O-N 2.72Å
83	L	67.2	Low	71.2	Confident	70 Å²	70	101 Å²	101	37%	0.366	50%	0.504	S	S	.	.	H	α-helix	trans	-55.4	-41.7	-174.3	-68.9	173.9	0	0	0	111.8	L81 R86 L87	L81-L83 HydrophobicContact CB-CD1 4.3Å; L81-L83 HydrophobicContact CB-CD2 4.18Å; L81-L83 HydrophobicContact CB-CG 3.74Å; L81-L83 HydrophobicContact CD1-CD1 4.07Å; L81-L83 HydrophobicContact CD1-CG 4.31Å; L81-L83 PolarHBondContact O-N 3.01Å; L81-L83 VanDerWaalsContact O-N 3.14Å; L83-R86 CarbonylContact O-C 3.57Å; L83-R86 PolarHBondContact O-N 3.28Å; L83-L87 VanDerWaalsContact O-CB 3.24Å; L83-L87 WeakPolarHBondContact O-CB 3.16Å; L83-L87 PolarHBondContact O-N 3.4Å
84	N	71.3	Confident	72.2	Confident	85 Å²	85	100.5 Å²	100.5	46%	0.455	50%	0.501	S	S	.	.	H	α-helix	trans	-58.9	-47.7	174.5	-73.8	-34.8	0	0	0	112.7	I75 N82 R86 L87 D88	I75-N84 VanDerWaalsContact CG2-ND2 3.28Å; I75-N84 WeakPolarHBondContact CG2-ND2 3.39Å; N82-N84 VanDerWaalsContact C-N 3.27Å; N82-N84 PolarHBondContact O-N 3.46Å; N84-R86 VanDerWaalsContact C-N 3.27Å; N84-R86 PolarHBondContact O-N 3.1Å; N84-L87 PolarHBondContact O-N 2.94Å; N84-D88 WeakPolarHBondContact O-CB 3.39Å; N84-D88 PolarHBondContact O-N 2.85Å
85	A	76.8	Confident	73.2	Confident	54 Å²	54	100.2 Å²	100.2	45%	0.446	51%	0.506	S	S	.	.	H	α-helix	trans	-64.7	-31.7	177.6	0	0	0	0	0	112.7	N82 K89	N82-A85 HydrophobicContact CB-CB 4.39Å; N82-A85 PolarHBondContact O-N 3.14Å; N82-A85 VanDerWaalsContact OD1-CB 3.27Å; N82-A85 WeakPolarHBondContact OD1-CB 3.46Å; A85-K89 WeakPolarHBondContact O-CB 3.4Å; A85-K89 PolarHBondContact O-N 2.91Å; A85-K89 VanDerWaalsContact O-N 3.14Å
86	R	76.1	Confident	74.3	Confident	178 Å²	178	101.9 Å²	101.9	67%	0.672	52%	0.519	S	S	*	.	H	α-helix	trans	-76.3	-37.4	174.8	-169.3	166.7	-177	140.1	-3.1	112.3	N82 L83 N84 K89 L90	N82-R86 PolarHBondContact O-N 2.72Å; L83-R86 CarbonylContact O-C 3.57Å; L83-R86 PolarHBondContact O-N 3.28Å; N84-R86 VanDerWaalsContact C-N 3.27Å; N84-R86 PolarHBondContact O-N 3.1Å; R86-K89 PolarHBondContact O-N 3.32Å; R86-L90 HydrophobicContact CG-CD1 4.41Å; R86-L90 WeakPolarHBondContact O-CB 3.47Å; R86-L90 WeakPolarHBondContact O-CG 3.42Å; R86-L90 PolarHBondContact O-N 3.25Å
87	L	75.3	Confident	75.3	Confident	72 Å²	72	99.1 Å²	99.1	38%	0.377	51%	0.508	S	S	.	.	H	α-helix	trans	-65.3	-43.9	174.5	179.7	60.3	0	0	0	111	L83 N84 K89 L90 K91	L83-L87 VanDerWaalsContact O-CB 3.24Å; L83-L87 WeakPolarHBondContact O-CB 3.16Å; L83-L87 PolarHBondContact O-N 3.4Å; N84-L87 PolarHBondContact O-N 2.94Å; L87-K89 VanDerWaalsContact C-N 3.34Å; L87-K89 PolarHBondContact O-N 3.13Å; L87-L90 PolarHBondContact O-N 3.34Å; L87-K91 HydrophobicContact CD1-CD 4.44Å; L87-K91 HydrophobicContact CD1-CG 4.43Å; L87-K91 HydrophobicContact CG-CD 4.13Å; L87-K91 WeakPolarHBondContact O-CB 3.28Å; L87-K91 VanDerWaalsContact O-CG 3.29Å; L87-K91 WeakPolarHBondContact O-CG 3.42Å; L87-K91 PolarHBondContact O-N 3.33Å
88	D	78.8	Confident	76.2	Confident	98 Å²	98	100.5 Å²	100.5	52%	0.524	51%	0.506	S	S	.	.	H	α-helix	trans	-64.2	-38.6	174.5	-76.4	-15.3	0	0	0	112.1	N84 K92	N84-D88 WeakPolarHBondContact O-CB 3.39Å; N84-D88 PolarHBondContact O-N 2.85Å; D88-K92 VanDerWaalsContact O-CB 3.31Å; D88-K92 WeakPolarHBondContact O-CB 3.4Å; D88-K92 PolarHBondContact O-N 3.43Å
89	K	82.4	Confident	77.3	Confident	126 Å²	126	101.3 Å²	101.3	55%	0.548	52%	0.519	S	S	.	.	H	α-helix	trans	-61.4	-46.8	171.6	-176.8	-177.2	167	-173.8	0	111.3	A85 R86 L87 K92 E93	A85-K89 WeakPolarHBondContact O-CB 3.4Å; A85-K89 PolarHBondContact O-N 2.91Å; A85-K89 VanDerWaalsContact O-N 3.14Å; R86-K89 PolarHBondContact O-N 3.32Å; L87-K89 VanDerWaalsContact C-N 3.34Å; L87-K89 PolarHBondContact O-N 3.13Å; K89-K92 WeakPolarHBondContact O-CB 3.4Å; K89-K92 PolarHBondContact O-N 2.74Å; K89-E93 WeakPolarHBondContact CE-OE1 3.21Å; K89-E93 IonicContact NZ-OE1 3.53Å; K89-E93 WeakPolarHBondContact O-CG 3.42Å; K89-E93 PolarHBondContact O-N 2.92Å
90	L	80.2	Confident	78.5	Confident	94 Å²	94	100.3 Å²	100.3	49%	0.492	51%	0.508	S	S	.	.	H	α-helix	trans	-66.3	-41.7	179.3	-73.9	170	0	0	0	112.2	R86 L87 K92 E93 Q94	R86-L90 HydrophobicContact CG-CD1 4.41Å; R86-L90 WeakPolarHBondContact O-CB 3.47Å; R86-L90 WeakPolarHBondContact O-CG 3.42Å; R86-L90 PolarHBondContact O-N 3.25Å; L87-L90 PolarHBondContact O-N 3.34Å; L90-K92 VanDerWaalsContact C-N 3.29Å; L90-K92 PolarHBondContact O-N 2.88Å; L90-E93 PolarHBondContact O-N 3.3Å; L90-Q94 VanDerWaalsContact O-CB 3.3Å; L90-Q94 WeakPolarHBondContact O-CB 3.36Å; L90-Q94 PolarHBondContact O-N 3.4Å
91	K	81.1	Confident	79.4	Confident	101 Å²	101	95.9 Å²	95.9	44%	0.439	49%	0.49	S	S	.	.	H	α-helix	trans	-57.2	-42.2	171.2	-74.5	167.9	178.1	167.9	0	111.1	L87 Q94 S95	L87-K91 HydrophobicContact CD1-CD 4.44Å; L87-K91 HydrophobicContact CD1-CG 4.43Å; L87-K91 HydrophobicContact CG-CD 4.13Å; L87-K91 WeakPolarHBondContact O-CB 3.28Å; L87-K91 VanDerWaalsContact O-CG 3.29Å; L87-K91 WeakPolarHBondContact O-CG 3.42Å; L87-K91 PolarHBondContact O-N 3.33Å; K91-Q94 PolarHBondContact O-N 2.87Å; K91-S95 PolarHBondContact O-N 3.13Å; K91-S95 PolarHBondContact O-OG 3.27Å; K91-S95 VanDerWaalsContact O-OG 3.13Å
92	K	85.4	Confident	80.3	Confident	156 Å²	156	99.1 Å²	99.1	68%	0.678	51%	0.506	S	S	*	.	H	α-helix	trans	-67.7	-40.1	176.9	-169.7	174	-176	174.7	0	112.8	D88 K89 L90 T96	D88-K92 VanDerWaalsContact O-CB 3.31Å; D88-K92 WeakPolarHBondContact O-CB 3.4Å; D88-K92 PolarHBondContact O-N 3.43Å; K89-K92 WeakPolarHBondContact O-CB 3.4Å; K89-K92 PolarHBondContact O-N 2.74Å; L90-K92 VanDerWaalsContact C-N 3.29Å; L90-K92 PolarHBondContact O-N 2.88Å; K92-T96 WeakPolarHBondContact O-CB 3.34Å; K92-T96 PolarHBondContact O-N 2.73Å; K92-T96 VanDerWaalsContact O-N 3.1Å; K92-T96 PolarHBondContact O-OG1 2.65Å
93	E	85.4	Confident	81.1	Confident	90 Å²	90	99 Å²	99	42%	0.421	50%	0.503	S	S	.	.	H	α-helix	trans	-66.9	-40.1	173.9	-73.5	176	174.4	0	0	111.3	K89 L90 T96 L97	K89-E93 WeakPolarHBondContact CE-OE1 3.21Å; K89-E93 IonicContact NZ-OE1 3.53Å; K89-E93 WeakPolarHBondContact O-CG 3.42Å; K89-E93 PolarHBondContact O-N 2.92Å; L90-E93 PolarHBondContact O-N 3.3Å; E93-T96 WeakPolarHBondContact O-CB 3.4Å; E93-T96 PolarHBondContact O-N 2.95Å; E93-L97 WeakPolarHBondContact O-CG 3.33Å; E93-L97 PolarHBondContact O-N 2.9Å
94	Q	82.8	Confident	82	Confident	110 Å²	110	100.3 Å²	100.3	51%	0.514	51%	0.51	S	S	.	.	H	α-helix	trans	-60.2	-51.3	174	-178.6	-177.5	9.5	0	0	112	L90 K91 T96 L97 Q98	L90-Q94 VanDerWaalsContact O-CB 3.3Å; L90-Q94 WeakPolarHBondContact O-CB 3.36Å; L90-Q94 PolarHBondContact O-N 3.4Å; K91-Q94 PolarHBondContact O-N 2.87Å; Q94-T96 PolarHBondContact O-N 2.83Å; Q94-L97 PolarHBondContact O-N 3.03Å; Q94-L97 VanDerWaalsContact O-N 3.14Å; Q94-Q98 WeakPolarHBondContact O-CG 3.24Å; Q94-Q98 PolarHBondContact O-N 3.25Å
95	S	83.2	Confident	82.5	Confident	71 Å²	71	100 Å²	100	50%	0.497	51%	0.508	S	S	.	.	H	α-helix	trans	-60.5	-35.3	176.5	-62	0	0	0	0	112.2	K91 S99	K91-S95 PolarHBondContact O-N 3.13Å; K91-S95 PolarHBondContact O-OG 3.27Å; K91-S95 VanDerWaalsContact O-OG 3.13Å; S95-S99 WeakPolarHBondContact O-CB 3.37Å; S95-S99 PolarHBondContact O-N 3.21Å
96	T	86.5	Confident	82.8	Confident	75 Å²	75	99 Å²	99	46%	0.46	50%	0.503	S	S	.	.	H	α-helix	trans	-66.2	-44.6	174.9	-53.8	0	0	0	0	111.1	K92 E93 Q94 S99 N100	K92-T96 WeakPolarHBondContact O-CB 3.34Å; K92-T96 PolarHBondContact O-N 2.73Å; K92-T96 VanDerWaalsContact O-N 3.1Å; K92-T96 PolarHBondContact O-OG1 2.65Å; E93-T96 WeakPolarHBondContact O-CB 3.4Å; E93-T96 PolarHBondContact O-N 2.95Å; Q94-T96 PolarHBondContact O-N 2.83Å; T96-S99 WeakPolarHBondContact O-CB 3.39Å; T96-S99 PolarHBondContact O-N 3.47Å; T96-N100 PolarHBondContact O-N 3.42Å; T96-N100 PolarHBondContact O-ND2 3.46Å; T96-N100 PolarHBondContact O-OD1 2.62Å
97	L	84.5	Confident	83.2	Confident	107 Å²	107	95.2 Å²	95.2	56%	0.56	49%	0.491	S	S	*	.	H	α-helix	trans	-66.6	-39.8	177.2	-72.7	169.5	0	0	0	112.5	E93 Q94 N100 I101	E93-L97 WeakPolarHBondContact O-CG 3.33Å; E93-L97 PolarHBondContact O-N 2.9Å; Q94-L97 PolarHBondContact O-N 3.03Å; Q94-L97 VanDerWaalsContact O-N 3.14Å; L97-N100 PolarHBondContact O-N 3.23Å; L97-I101 VanDerWaalsContact O-CG1 3.31Å; L97-I101 WeakPolarHBondContact O-CG1 3.44Å; L97-I101 PolarHBondContact O-N 3.35Å
98	Q	81.4	Confident	83.5	Confident	111 Å²	111	96.2 Å²	96.2	52%	0.519	50%	0.496	S	S	.	.	H	α-helix	trans	-62	-43	174.3	-74.6	174.9	-28.9	0	0	111.6	Q94 N100 I101 L102	Q94-Q98 WeakPolarHBondContact O-CG 3.24Å; Q94-Q98 PolarHBondContact O-N 3.25Å; Q98-N100 PolarHBondContact O-N 2.98Å; Q98-I101 PolarHBondContact O-N 3.46Å; Q98-L102 PolarHBondContact O-N 2.92Å
99	S	86.1	Confident	83.5	Confident	74 Å²	74	96.4 Å²	96.4	52%	0.517	50%	0.497	S	S	.	.	H	α-helix	trans	-59.1	-45.4	173	-169.4	0	0	0	0	111.8	S95 T96 I101 L102 E103	S95-S99 WeakPolarHBondContact O-CB 3.37Å; S95-S99 PolarHBondContact O-N 3.21Å; T96-S99 WeakPolarHBondContact O-CB 3.39Å; T96-S99 PolarHBondContact O-N 3.47Å; S99-I101 PolarHBondContact O-N 3.32Å; S99-L102 PolarHBondContact O-N 3.42Å; S99-E103 PolarHBondContact O-N 2.87Å
100	N	86.9	Confident	83.4	Confident	72 Å²	72	94.2 Å²	94.2	39%	0.385	49%	0.494	S	S	.	.	H	α-helix	trans	-65.6	-35.8	178.6	-66.1	-12	0	0	0	112.8	T96 L97 Q98 L104	T96-N100 PolarHBondContact O-N 3.42Å; T96-N100 PolarHBondContact O-ND2 3.46Å; T96-N100 PolarHBondContact O-OD1 2.62Å; L97-N100 PolarHBondContact O-N 3.23Å; Q98-N100 PolarHBondContact O-N 2.98Å; N100-L104 WeakPolarHBondContact O-CB 3.5Å; N100-L104 WeakPolarHBondContact O-CG 3.42Å; N100-L104 PolarHBondContact O-N 3.1Å
101	I	84.3	Confident	83.5	Confident	97 Å²	97	94.3 Å²	94.3	50%	0.497	49%	0.494	S	S	.	.	H	α-helix	trans	-67.5	-41.8	175	-71	164.8	0	0	0	110.5	L97 Q98 S99 L104 N105	L97-I101 VanDerWaalsContact O-CG1 3.31Å; L97-I101 WeakPolarHBondContact O-CG1 3.44Å; L97-I101 PolarHBondContact O-N 3.35Å; Q98-I101 PolarHBondContact O-N 3.46Å; S99-I101 PolarHBondContact O-N 3.32Å; I101-L104 PolarHBondContact O-N 2.96Å; I101-N105 PolarHBondContact O-N 3.27Å
102	L	83.4	Confident	83.1	Confident	133 Å²	133	93.4 Å²	93.4	70%	0.696	50%	0.497	S	S	*	.	H	α-helix	trans	-62.2	-43.1	175.8	-163.4	75.8	0	0	0	111.4	Q98 S99 L104 N105 G106	Q98-L102 PolarHBondContact O-N 2.92Å; S99-L102 PolarHBondContact O-N 3.42Å; L102-L104 VanDerWaalsContact C-N 3.35Å; L102-L104 PolarHBondContact O-N 3.49Å; L102-N105 PolarHBondContact O-N 3.02Å; L102-G106 PolarHBondContact O-N 3.29Å; L102-G106 VanDerWaalsContact O-N 3.11Å
103	E	84.9	Confident	82.5	Confident	105 Å²	105	89.4 Å²	89.4	49%	0.491	48%	0.483	S	S	.	.	H	α-helix	trans	-65.8	-34.6	175.9	-159.1	-161.6	156.8	0	0	112.5	S99 K107	S99-E103 PolarHBondContact O-N 2.87Å; E103-K107 WeakPolarHBondContact O-CD 3.5Å; E103-K107 VanDerWaalsContact O-CG 3.27Å; E103-K107 WeakPolarHBondContact O-CG 3.34Å; E103-K107 PolarHBondContact O-N 2.92Å; E103-K107 VanDerWaalsContact OE1-CE 3.26Å; E103-K107 WeakPolarHBondContact OE1-CE 3.21Å; E103-K107 IonicContact OE1-NZ 3.67Å; E103-K107 PolarHBondContact OE1-NZ 2.96Å; E103-K107 IonicContact OE2-NZ 3.53Å
104	L	85	Confident	82	Confident	98 Å²	98	90.8 Å²	90.8	51%	0.513	49%	0.489	S	S	.	.	H	α-helix	trans	-70.7	-42.6	175.2	-83.2	165.3	0	0	0	112.4	N100 I101 L102 K107 I108	N100-L104 WeakPolarHBondContact O-CB 3.5Å; N100-L104 WeakPolarHBondContact O-CG 3.42Å; N100-L104 PolarHBondContact O-N 3.1Å; I101-L104 PolarHBondContact O-N 2.96Å; L102-L104 VanDerWaalsContact C-N 3.35Å; L102-L104 PolarHBondContact O-N 3.49Å; L104-K107 WeakPolarHBondContact O-CB 3.31Å; L104-K107 PolarHBondContact O-N 3.4Å; L104-I108 WeakPolarHBondContact O-CG1 3.32Å; L104-I108 PolarHBondContact O-N 3.36Å
105	N	81.1	Confident	81.4	Confident	79 Å²	79	90.2 Å²	90.2	42%	0.422	49%	0.488	S	S	.	.	H	α-helix	trans	-60.4	-51.3	176.1	-70.5	-11.5	0	0	0	110.5	I101 L102 K107 I108 D109	I101-N105 PolarHBondContact O-N 3.27Å; L102-N105 PolarHBondContact O-N 3.02Å; N105-K107 PolarHBondContact O-N 3.03Å; N105-K107 VanDerWaalsContact O-N 3.09Å; N105-I108 CarbonylContact O-C 3.51Å; N105-I108 WeakPolarHBondContact O-CA 3.44Å; N105-I108 WeakPolarHBondContact O-CB 3.46Å; N105-I108 PolarHBondContact O-N 2.81Å; N105-D109 PolarHBondContact O-N 2.97Å
106	G	84.4	Confident	80.6	Confident	32 Å²	32	89.9 Å²	89.9	33%	0.33	48%	0.483	S	S	.	.	H	α-helix	trans	-59.1	-27.7	177.8	0	0	0	0	0	114.3	L102 T110	L102-G106 PolarHBondContact O-N 3.29Å; L102-G106 VanDerWaalsContact O-N 3.11Å; G106-T110 WeakPolarHBondContact O-CB 3.48Å; G106-T110 PolarHBondContact O-N 3.47Å; G106-T110 VanDerWaalsContact O-N 3.09Å; G106-T110 PolarHBondContact O-OG1 2.63Å
107	K	85.1	Confident	79.6	Confident	98 Å²	98	93 Å²	93	43%	0.426	49%	0.486	S	S	.	.	H	α-helix	trans	-73.7	-39.4	170.8	-73.6	165.6	-173.5	165.5	0	112.7	E103 L104 N105 T110 I111	E103-K107 WeakPolarHBondContact O-CD 3.5Å; E103-K107 VanDerWaalsContact O-CG 3.27Å; E103-K107 WeakPolarHBondContact O-CG 3.34Å; E103-K107 PolarHBondContact O-N 2.92Å; E103-K107 VanDerWaalsContact OE1-CE 3.26Å; E103-K107 WeakPolarHBondContact OE1-CE 3.21Å; E103-K107 IonicContact OE1-NZ 3.67Å; E103-K107 PolarHBondContact OE1-NZ 2.96Å; E103-K107 IonicContact OE2-NZ 3.53Å; L104-K107 WeakPolarHBondContact O-CB 3.31Å; L104-K107 PolarHBondContact O-N 3.4Å; N105-K107 PolarHBondContact O-N 3.03Å; N105-K107 VanDerWaalsContact O-N 3.09Å; K107-T110 PolarHBondContact O-N 3.01Å; K107-I111 WeakPolarHBondContact O-CD1 3.33Å; K107-I111 VanDerWaalsContact O-CG1 3.28Å; K107-I111 WeakPolarHBondContact O-CG1 3.39Å; K107-I111 PolarHBondContact O-N 2.72Å
108	I	81.1	Confident	78.8	Confident	94 Å²	94	93.1 Å²	93.1	48%	0.482	49%	0.487	S	S	.	.	H	α-helix	trans	-62.6	-48.8	174	-69	164.8	0	0	0	109.5	L104 N105 T110 I111 V112	L104-I108 WeakPolarHBondContact O-CG1 3.32Å; L104-I108 PolarHBondContact O-N 3.36Å; N105-I108 CarbonylContact O-C 3.51Å; N105-I108 WeakPolarHBondContact O-CA 3.44Å; N105-I108 WeakPolarHBondContact O-CB 3.46Å; N105-I108 PolarHBondContact O-N 2.81Å; I108-T110 VanDerWaalsContact C-N 3.31Å; I108-T110 PolarHBondContact O-N 3.24Å; I108-I111 PolarHBondContact O-N 3.16Å; I108-V112 HydrophobicContact CG2-CG2 4.36Å; I108-V112 WeakPolarHBondContact O-CG2 3.5Å; I108-V112 PolarHBondContact O-N 3.48Å
109	D	77.5	Confident	77.8	Confident	101 Å²	101	92.1 Å²	92.1	54%	0.54	48%	0.482	S	S	.	.	H	α-helix	trans	-58.5	-44.7	178.9	-55.2	-30.7	0	0	0	110.6	N105 I111 V112 D113	N105-D109 PolarHBondContact O-N 2.97Å; D109-I111 VanDerWaalsContact C-N 3.33Å; D109-I111 PolarHBondContact O-N 2.68Å; D109-V112 PolarHBondContact O-N 2.89Å; D109-D113 WeakPolarHBondContact O-CB 3.22Å; D109-D113 PolarHBondContact O-N 2.89Å
110	T	81.8	Confident	76.4	Confident	81 Å²	81	92.1 Å²	92.1	50%	0.497	48%	0.475	S	S	.	.	H	α-helix	trans	-58.5	-41.1	173.9	-58.8	0	0	0	0	112.4	G106 K107 I108 D113 E114	G106-T110 WeakPolarHBondContact O-CB 3.48Å; G106-T110 PolarHBondContact O-N 3.47Å; G106-T110 VanDerWaalsContact O-N 3.09Å; G106-T110 PolarHBondContact O-OG1 2.63Å; K107-T110 PolarHBondContact O-N 3.01Å; I108-T110 VanDerWaalsContact C-N 3.31Å; I108-T110 PolarHBondContact O-N 3.24Å; T110-D113 PolarHBondContact O-N 3.31Å; T110-E114 WeakPolarHBondContact O-CG 3.48Å; T110-E114 PolarHBondContact O-N 2.78Å
111	I	80.6	Confident	75	Confident	96 Å²	96	94.8 Å²	94.8	49%	0.492	49%	0.489	S	S	.	.	H	α-helix	trans	-71	-39	178.7	-69.8	165.3	0	0	0	111.4	K107 I108 D109 D113 E114 M115	K107-I111 WeakPolarHBondContact O-CD1 3.33Å; K107-I111 VanDerWaalsContact O-CG1 3.28Å; K107-I111 WeakPolarHBondContact O-CG1 3.39Å; K107-I111 PolarHBondContact O-N 2.72Å; I108-I111 PolarHBondContact O-N 3.16Å; D109-I111 VanDerWaalsContact C-N 3.33Å; D109-I111 PolarHBondContact O-N 2.68Å; I111-D113 VanDerWaalsContact C-N 3.32Å; I111-E114 PolarHBondContact O-N 3.06Å; I111-M115 HydrophobicContact CG2-CG 4.41Å; I111-M115 HydrophobicContact CG2-SD 4.14Å; I111-M115 WeakPolarHBondContact O-CB 3.27Å; I111-M115 VanDerWaalsContact O-CG 3.32Å; I111-M115 WeakPolarHBondContact O-CG 3.49Å; I111-M115 PolarHBondContact O-N 3.09Å
112	V	73.9	Confident	73.7	Confident	81 Å²	81	94 Å²	94	49%	0.491	49%	0.492	S	S	.	.	H	α-helix	trans	-63.5	-41	174.6	172.4	0	0	0	0	110.5	I108 D109 M115 T116	I108-V112 HydrophobicContact CG2-CG2 4.36Å; I108-V112 WeakPolarHBondContact O-CG2 3.5Å; I108-V112 PolarHBondContact O-N 3.48Å; D109-V112 PolarHBondContact O-N 2.89Å; V112-M115 PolarHBondContact O-N 3Å; V112-T116 VanDerWaalsContact O-CB 3.3Å; V112-T116 WeakPolarHBondContact O-CB 3.42Å; V112-T116 PolarHBondContact O-N 3.37Å; V112-T116 PolarHBondContact O-OG1 3.5Å
113	D	72.9	Confident	72.2	Confident	73 Å²	73	94.7 Å²	94.7	39%	0.39	49%	0.49	S	S	.	.	H	α-helix	trans	-68	-42.1	177	-157	10.6	0	0	0	111.3	D109 T110 I111 T116 R117	D109-D113 WeakPolarHBondContact O-CB 3.22Å; D109-D113 PolarHBondContact O-N 2.89Å; T110-D113 PolarHBondContact O-N 3.31Å; I111-D113 VanDerWaalsContact C-N 3.32Å; D113-T116 PolarHBondContact O-N 2.91Å; D113-R117 VanDerWaalsContact O-CB 3.3Å; D113-R117 WeakPolarHBondContact O-CB 3.28Å; D113-R117 VanDerWaalsContact O-CD 3.27Å; D113-R117 WeakPolarHBondContact O-CD 3.38Å; D113-R117 WeakPolarHBondContact O-CG 3.26Å; D113-R117 PolarHBondContact O-N 3.47Å; D113-R117 IonicContact OD1-CZ 2.62Å; D113-R117 IonicContact OD1-NE 3.18Å; D113-R117 PolarHBondContact OD1-NE 2.89Å; D113-R117 IonicContact OD1-NH2 3.16Å; D113-R117 IonicContact OD2-CZ 3.91Å; D113-R117 IonicContact OD2-NE 2.68Å; D113-R117 PolarHBondContact OD2-NE 2.98Å; D113-R117 IonicContact OD2-NH2 2.63Å; D113-R117 PolarHBondContact OD2-NH2 3.09Å
114	E	74.9	Confident	70.6	Confident	118 Å²	118	90.3 Å²	90.3	55%	0.551	47%	0.473	S	S	*	.	H	α-helix	trans	-63	-42.7	171	-76.8	-162.8	153.9	0	0	112.9	T110 I111 R117 L118	T110-E114 WeakPolarHBondContact O-CG 3.48Å; T110-E114 PolarHBondContact O-N 2.78Å; I111-E114 PolarHBondContact O-N 3.06Å; E114-R117 PolarHBondContact O-N 3.47Å; E114-L118 VanDerWaalsContact O-CB 3.29Å; E114-L118 WeakPolarHBondContact O-CB 3.4Å; E114-L118 WeakPolarHBondContact O-CG 3.42Å; E114-L118 PolarHBondContact O-N 3.25Å
115	M	70.3	Confident	69.2	Low	99 Å²	99	92.6 Å²	92.6	49%	0.488	48%	0.475	S	S	.	.	H	α-helix	trans	-63.9	-42.5	176.1	-77.9	-178.7	61.6	0	0	111.9	I111 V112 L118 Q119	I111-M115 HydrophobicContact CG2-CG 4.41Å; I111-M115 HydrophobicContact CG2-SD 4.14Å; I111-M115 WeakPolarHBondContact O-CB 3.27Å; I111-M115 VanDerWaalsContact O-CG 3.32Å; I111-M115 WeakPolarHBondContact O-CG 3.49Å; I111-M115 PolarHBondContact O-N 3.09Å; V112-M115 PolarHBondContact O-N 3Å; M115-L118 PolarHBondContact O-N 2.86Å; M115-Q119 WeakPolarHBondContact O-CG 3.27Å; M115-Q119 PolarHBondContact O-N 3.11Å
116	T	66.6	Low	68	Low	63 Å²	63	92.3 Å²	92.3	39%	0.387	48%	0.476	S	S	.	.	H	α-helix	trans	-65.8	-44.5	177.9	-58.3	0	0	0	0	110.7	V112 D113 L118 Q119 I120	V112-T116 VanDerWaalsContact O-CB 3.3Å; V112-T116 WeakPolarHBondContact O-CB 3.42Å; V112-T116 PolarHBondContact O-N 3.37Å; V112-T116 PolarHBondContact O-OG1 3.5Å; D113-T116 PolarHBondContact O-N 2.91Å; T116-L118 VanDerWaalsContact C-N 3.34Å; T116-L118 PolarHBondContact O-N 3.45Å; T116-Q119 PolarHBondContact O-N 3.5Å; T116-I120 HydrophobicContact CG2-CD1 4Å; T116-I120 WeakPolarHBondContact O-CG1 3.4Å; T116-I120 PolarHBondContact O-N 3.04Å
117	R	65.5	Low	66.7	Low	142 Å²	142	93.9 Å²	93.9	54%	0.536	48%	0.476	S	S	.	.	H	α-helix	trans	-61.5	-40.3	172.4	-68.8	163.2	-169.1	-161	-2	111.7	D113 E114 I120 N121	D113-R117 VanDerWaalsContact O-CB 3.3Å; D113-R117 WeakPolarHBondContact O-CB 3.28Å; D113-R117 VanDerWaalsContact O-CD 3.27Å; D113-R117 WeakPolarHBondContact O-CD 3.38Å; D113-R117 WeakPolarHBondContact O-CG 3.26Å; D113-R117 PolarHBondContact O-N 3.47Å; D113-R117 IonicContact OD1-CZ 2.62Å; D113-R117 IonicContact OD1-NE 3.18Å; D113-R117 PolarHBondContact OD1-NE 2.89Å; D113-R117 IonicContact OD1-NH2 3.16Å; D113-R117 IonicContact OD2-CZ 3.91Å; D113-R117 IonicContact OD2-NE 2.68Å; D113-R117 PolarHBondContact OD2-NE 2.98Å; D113-R117 IonicContact OD2-NH2 2.63Å; D113-R117 PolarHBondContact OD2-NH2 3.09Å; E114-R117 PolarHBondContact O-N 3.47Å; R117-I120 PolarHBondContact O-N 3.28Å; R117-N121 WeakPolarHBondContact O-CB 3.32Å; R117-N121 PolarHBondContact O-N 3.5Å; R117-N121 PolarHBondContact O-ND2 3.37Å
118	L	67.5	Low	65.3	Low	108 Å²	108	94.2 Å²	94.2	57%	0.565	48%	0.475	S	S	*	.	H	α-helix	trans	-65	-40.1	175.5	-78.4	167.4	0	0	0	112.1	E114 M115 T116 S122	E114-L118 VanDerWaalsContact O-CB 3.29Å; E114-L118 WeakPolarHBondContact O-CB 3.4Å; E114-L118 WeakPolarHBondContact O-CG 3.42Å; E114-L118 PolarHBondContact O-N 3.25Å; M115-L118 PolarHBondContact O-N 2.86Å; T116-L118 VanDerWaalsContact C-N 3.34Å; T116-L118 PolarHBondContact O-N 3.45Å; L118-S122 WeakPolarHBondContact O-CB 3.46Å; L118-S122 PolarHBondContact O-N 2.91Å; L118-S122 PolarHBondContact O-OG 2.77Å
119	Q	59.8	Low	64.2	Low	91 Å²	91	90.6 Å²	90.6	43%	0.425	46%	0.456	S	S	.	.	H	α-helix	trans	-64.6	-48.2	174	-73.9	-176.8	6.1	0	0	111.7	M115 T116 N121 S122 F123	M115-Q119 WeakPolarHBondContact O-CG 3.27Å; M115-Q119 PolarHBondContact O-N 3.11Å; T116-Q119 PolarHBondContact O-N 3.5Å; Q119-N121 VanDerWaalsContact C-N 3.33Å; Q119-N121 PolarHBondContact O-N 3.03Å; Q119-S122 PolarHBondContact O-N 2.89Å; Q119-S122 VanDerWaalsContact O-N 3.14Å; Q119-F123 PolarHBondContact O-N 3.12Å
120	I	57.5	Low	63.7	Low	74 Å²	74	86 Å²	86	38%	0.379	43%	0.432	S	S	.	.	H	α-helix	trans	-60.1	-43.7	176.9	-67.4	167	0	0	0	110.7	T116 R117 S122 G124	T116-I120 HydrophobicContact CG2-CD1 4Å; T116-I120 WeakPolarHBondContact O-CG1 3.4Å; T116-I120 PolarHBondContact O-N 3.04Å; R117-I120 PolarHBondContact O-N 3.28Å; I120-S122 VanDerWaalsContact C-N 3.32Å; I120-S122 PolarHBondContact O-N 3.37Å; I120-G124 VanDerWaalsContact O-CA 3.26Å; I120-G124 WeakPolarHBondContact O-CA 3.44Å; I120-G124 PolarHBondContact O-N 3.27Å
121	N	57.4	Low	62.6	Low	127 Å²	127	82.4 Å²	82.4	68%	0.679	41%	0.409	S	S	*	.	H	α-helix	trans	-68.1	-26.1	176.9	-74.3	-40.9	0	0	0	113.8	R117 Q119	R117-N121 WeakPolarHBondContact O-CB 3.32Å; R117-N121 PolarHBondContact O-N 3.5Å; R117-N121 PolarHBondContact O-ND2 3.37Å; Q119-N121 VanDerWaalsContact C-N 3.33Å; Q119-N121 PolarHBondContact O-N 3.03Å
122	S	56.1	Low	61.4	Low	80 Å²	80	80.8 Å²	80.8	56%	0.559	40%	0.402	S	S	*	.	H	α-helix	trans	-93.2	-31.1	-177.2	-58	0	0	0	0	113.9	L118 Q119 I120	L118-S122 WeakPolarHBondContact O-CB 3.46Å; L118-S122 PolarHBondContact O-N 2.91Å; L118-S122 PolarHBondContact O-OG 2.77Å; Q119-S122 PolarHBondContact O-N 2.89Å; Q119-S122 VanDerWaalsContact O-N 3.14Å; I120-S122 VanDerWaalsContact C-N 3.32Å; I120-S122 PolarHBondContact O-N 3.37Å
123	F	51.8	Low	60.4	Low	149 Å²	149	80.8 Å²	80.8	65%	0.654	39%	0.393	S	S	*	.	H	α-helix	trans	-128.4	-23.9	-170.6	-55.8	-67.6	0	0	0	114.4	Q119 Y589	Q119-F123 PolarHBondContact O-N 3.12Å; F123-Y589 WeakPolarHBondContact O-CD1 3.36Å
124	G	50.9	Low	59.1	Low	12 Å²	12	83 Å²	83	12%	0.124	41%	0.408	C	S	.	.			trans	77.9	149.1	-173.2	0	0	0	0	0	114.1	I120 D590	I120-G124 VanDerWaalsContact O-CA 3.26Å; I120-G124 WeakPolarHBondContact O-CA 3.44Å; I120-G124 PolarHBondContact O-N 3.27Å; G124-D590 CarbonylContact C-O 3.29Å; G124-D590 WeakPolarHBondContact CA-O 3.37Å
125	R	56.9	Low	57.8	Low	147 Å²	147	80.1 Å²	80.1	56%	0.555	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.1	137.4	169.2	-176.5	178.7	-174.8	177.1	3.2	109.1	L127 Y589 D590	R125-L127 HydrophobicContact CG-CD2 4.3Å; R125-Y589 CarbonylContact O-C 3.59Å; R125-Y589 WeakPolarHBondContact O-CA 3.02Å; R125-D590 HydrophobicContact CB-CB 4.46Å; R125-D590 PolarHBondContact N-O 3.48Å; R125-D590 PolarHBondContact O-N 3.32Å
126	V	55.4	Low	56.2	Low	72 Å²	72	79.3 Å²	79.3	44%	0.436	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	105.6	175.7	-179.3	0	0	0	0	110	A587 K588 Y589	V126-A587 HydrophobicContact CG1-CB 3.81Å; V126-K588 CarbonylContact C-O 3.49Å; V126-K588 WeakPolarHBondContact CA-O 3.22Å; V126-Y589 HydrophobicContact CG2-CD1 3.92Å; V126-Y589 HydrophobicContact CG2-CE1 3.77Å
127	L	57.4	Low	54.9	Low	66 Å²	66	79.5 Å²	79.5	35%	0.346	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	119.3	173.3	-57.9	177.2	0	0	0	109.3	R125 A587 K588 D590	R125-L127 HydrophobicContact CG-CD2 4.3Å; L127-A587 CarbonylContact O-C 3.49Å; L127-A587 WeakPolarHBondContact O-CA 3.17Å; L127-K588 PolarHBondContact N-O 2.68Å; L127-K588 PolarHBondContact O-N 2.8Å; L127-D590 HydrophobicContact CD1-CB 4.1Å; L127-D590 HydrophobicContact CG-CB 4.34Å
128	R	55.7	Low	53.5	Low	105 Å²	105	76.4 Å²	76.4	40%	0.396	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	119.1	171.3	-63.6	-176.2	-174.2	-178.2	3.3	109.2	Y533 Y585	R128-Y533 PolarHBondContact NH1-OH 2.67Å; R128-Y585 HydrophobicContact CB-CD1 4.09Å; R128-Y585 HydrophobicContact CB-CG 4.45Å
129	L	57.9	Low	52.2	Low	18 Å²	18	78.6 Å²	78.6	9%	0.094	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	124.1	175.8	-57.8	178.9	0	0	0	110.6	D131 R133 V134 Y585 L586 K588	L129-D131 PolarHBondContact O-N 2.86Å; L129-R133 CarbonylContact C-O 3.55Å; L129-R133 VanDerWaalsContact C-O 3.31Å; L129-R133 WeakPolarHBondContact CA-O 3.47Å; L129-R133 WeakPolarHBondContact CB-O 3.2Å; L129-V134 HydrophobicContact CD2-CB 4.24Å; L129-V134 HydrophobicContact CD2-CG2 3.66Å; L129-Y585 CarbonylContact O-C 3.59Å; L129-Y585 WeakPolarHBondContact O-CA 3.35Å; L129-L586 HydrophobicContact CB-CB 4.38Å; L129-L586 PolarHBondContact N-O 3.2Å; L129-L586 PolarHBondContact O-N 3.15Å; L129-K588 HydrophobicContact CD1-CD 3.69Å; L129-K588 HydrophobicContact CD1-CG 4.44Å
130	F	66	Low	51.1	Low	5 Å²	5	82.2 Å²	82.2	2%	0.022	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	110.2	177.1	-166.5	-84.2	0	0	0	110	N132 R133 I135 F528 F531 F578 L583 Y585	F130-N132 VanDerWaalsContact C-N 3.31Å; F130-N132 PolarHBondContact O-N 2.77Å; F130-R133 PolarHBondContact N-O 3.41Å; F130-R133 WeakPolarHBondContact O-CA 3.47Å; F130-R133 VanDerWaalsContact O-CB 3.27Å; F130-R133 WeakPolarHBondContact O-CB 3.23Å; F130-R133 PolarHBondContact O-N 3.38Å; F130-I135 HydrophobicContact CB-CB 4.19Å; F130-I135 HydrophobicContact CB-CD1 3.63Å; F130-I135 HydrophobicContact CB-CG1 3.88Å; F130-I135 HydrophobicContact CD1-CD1 4.11Å; F130-I135 HydrophobicContact CG-CD1 3.94Å; F130-F528 AromaticContact CD1-CD2 3.79Å; F130-F528 HydrophobicContact CD1-CD2 3.79Å; F130-F528 AromaticContact CD1-CE2 3.91Å; F130-F528 HydrophobicContact CD1-CE2 3.91Å; F130-F528 HydrophobicContact CD1-CG 4.16Å; F130-F528 HydrophobicContact CD1-CZ 4.41Å; F130-F528 HydrophobicContact CE1-CB 4.38Å; F130-F528 AromaticContact CE1-CD1 3.66Å; F130-F528 HydrophobicContact CE1-CD1 3.66Å; F130-F528 AromaticContact CE1-CD2 3.56Å; F130-F528 HydrophobicContact CE1-CD2 3.56Å; F130-F528 AromaticContact CE1-CE1 3.68Å; F130-F528 HydrophobicContact CE1-CE1 3.68Å; F130-F528 AromaticContact CE1-CE2 3.57Å; F130-F528 HydrophobicContact CE1-CE2 3.57Å; F130-F528 AromaticContact CE1-CG 3.61Å; F130-F528 HydrophobicContact CE1-CG 3.61Å; F130-F528 AromaticContact CE1-CZ 3.63Å; F130-F528 HydrophobicContact CE1-CZ 3.63Å; F130-F528 HydrophobicContact CZ-CD1 4.29Å; F130-F528 HydrophobicContact CZ-CE1 4.3Å; F130-F531 HydrophobicContact CZ-CD2 4.02Å; F130-F531 HydrophobicContact CZ-CE2 4.33Å; F130-F578 HydrophobicContact CE1-CE1 4.18Å; F130-F578 HydrophobicContact CE2-CE1 4.34Å; F130-F578 AromaticContact CZ-CD1 3.93Å; F130-F578 HydrophobicContact CZ-CD1 3.93Å; F130-F578 AromaticContact CZ-CE1 3.6Å; F130-F578 HydrophobicContact CZ-CE1 3.6Å; F130-F578 HydrophobicContact CZ-CZ 4.37Å; F130-L583 HydrophobicContact CE2-CB 3.92Å; F130-L583 HydrophobicContact CE2-CD2 3.85Å; F130-L583 HydrophobicContact CE2-CG 4.45Å; F130-L583 HydrophobicContact CZ-CD2 4.33Å; F130-Y585 HydrophobicContact CB-CD1 4.45Å; F130-Y585 HydrophobicContact CB-CE1 4.49Å; F130-Y585 HydrophobicContact CD2-CD1 4.19Å; F130-Y585 AromaticContact CD2-CE1 3.82Å; F130-Y585 HydrophobicContact CD2-CE1 3.82Å
131	D	60	Low	50	Low	5 Å²	5	86.9 Å²	86.9	3%	0.027	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	43.6	51.2	-174.6	-150.1	48.1	0	0	0	114	L129 R133 F528 R584 I638 I639 N640	L129-D131 PolarHBondContact O-N 2.86Å; D131-R133 VanDerWaalsContact C-N 3.27Å; D131-R133 PolarHBondContact O-N 3.34Å; D131-F528 HydrophobicContact CB-CE2 4.19Å; D131-R584 PolarHBondContact N-O 3.04Å; D131-R584 IonicContact OD1-CZ 2.79Å; D131-R584 IonicContact OD1-NH1 3.75Å; D131-R584 PolarHBondContact OD1-NH1 3.38Å; D131-I638 WeakPolarHBondContact OD2-CG2 3.46Å; D131-I639 PolarHBondContact OD1-N 3.47Å; D131-I639 PolarHBondContact OD2-N 3.11Å; D131-N640 PolarHBondContact OD2-N 2.9Å
132	N	54.5	Low	48.8	Very low	62 Å²	62	89.1 Å²	89.1	33%	0.332	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.9	-1.8	-172.6	-82.2	-67.6	0	0	0	117.8	F130 L586 K588	F130-N132 VanDerWaalsContact C-N 3.31Å; F130-N132 PolarHBondContact O-N 2.77Å; N132-L586 VanDerWaalsContact OD1-CD2 3.26Å; N132-L586 WeakPolarHBondContact OD1-CD2 3.32Å; N132-K588 PolarHBondContact OD1-NZ 3.37Å
133	R	53.6	Low	47.4	Very low	81 Å²	81	94.9 Å²	94.9	31%	0.306	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	147.9	171.8	-56.4	171.8	176.2	-130	-6	111	L129 F130 D131 I135 S522 D525 N640	L129-R133 CarbonylContact C-O 3.55Å; L129-R133 VanDerWaalsContact C-O 3.31Å; L129-R133 WeakPolarHBondContact CA-O 3.47Å; L129-R133 WeakPolarHBondContact CB-O 3.2Å; F130-R133 PolarHBondContact N-O 3.41Å; F130-R133 WeakPolarHBondContact O-CA 3.47Å; F130-R133 VanDerWaalsContact O-CB 3.27Å; F130-R133 WeakPolarHBondContact O-CB 3.23Å; F130-R133 PolarHBondContact O-N 3.38Å; D131-R133 VanDerWaalsContact C-N 3.27Å; D131-R133 PolarHBondContact O-N 3.34Å; R133-I135 HydrophobicContact CB-CG1 4.46Å; R133-I135 PolarHBondContact O-N 2.82Å; R133-S522 PolarHBondContact NH2-OG 3.22Å; R133-D525 IonicContact CZ-OD1 3.96Å; R133-D525 IonicContact CZ-OD2 2.67Å; R133-D525 VanDerWaalsContact CZ-OD2 3.24Å; R133-D525 IonicContact NH1-OD1 2.9Å; R133-D525 IonicContact NH1-OD2 2.8Å; R133-D525 PolarHBondContact NH1-OD2 3.38Å; R133-D525 IonicContact NH2-OD1 3.8Å; R133-D525 PolarHBondContact NH2-OD1 3.03Å; R133-D525 IonicContact NH2-OD2 2.76Å; R133-D525 PolarHBondContact NH2-OD2 2.89Å; R133-N640 PolarHBondContact NH2-ND2 3.48Å
134	V	46.2	Very low	46.4	Very low	118 Å²	118	94.2 Å²	94.2	72%	0.715	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.9	110.5	165.6	-175.6	0	0	0	0	107.3	L129	L129-V134 HydrophobicContact CD2-CB 4.24Å; L129-V134 HydrophobicContact CD2-CG2 3.66Å
135	I	46.3	Very low	45.2	Very low	58 Å²	58	99.3 Å²	99.3	30%	0.297	50%	0.499	S	S	.	.			trans	-119	113.2	164.7	-57.1	-172	0	0	0	105.6	F130 R133 L137	F130-I135 HydrophobicContact CB-CB 4.19Å; F130-I135 HydrophobicContact CB-CD1 3.63Å; F130-I135 HydrophobicContact CB-CG1 3.88Å; F130-I135 HydrophobicContact CD1-CD1 4.11Å; F130-I135 HydrophobicContact CG-CD1 3.94Å; R133-I135 HydrophobicContact CB-CG1 4.46Å; R133-I135 PolarHBondContact O-N 2.82Å; I135-L137 HydrophobicContact CG2-CD2 3.92Å; I135-L137 HydrophobicContact CG2-CG 4.14Å; I135-L137 PolarHBondContact O-N 2.7Å
136	D	36.3	Very low	43.9	Very low	82 Å²	82	98.1 Å²	98.1	44%	0.439	51%	0.508	S	S	.	.			trans	-98.3	91.9	-166.2	-165.4	13.1	0	0	0	110	A138 K139	D136-A138 PolarHBondContact O-N 3.29Å; D136-K139 HydrophobicContact CB-CD 4.12Å; D136-K139 HydrophobicContact CB-CG 4.27Å; D136-K139 WeakPolarHBondContact OD2-CE 3.39Å
137	L	40.5	Very low	42.4	Very low	68 Å²	68	102 Å²	102	36%	0.356	52%	0.524	S	S	.	.			trans	-87.9	27.5	-168.8	-62.7	165.3	0	0	0	113.2	I135 Y533 Y585	I135-L137 HydrophobicContact CG2-CD2 3.92Å; I135-L137 HydrophobicContact CG2-CG 4.14Å; I135-L137 PolarHBondContact O-N 2.7Å; L137-Y533 HydrophobicContact CD1-CD2 4.23Å; L137-Y533 HydrophobicContact CD1-CG 4.2Å; L137-Y585 HydrophobicContact CD1-CE1 3.53Å; L137-Y585 VanDerWaalsContact CD1-OH 3.3Å; L137-Y585 WeakPolarHBondContact CD1-OH 3.42Å
138	A	35.7	Very low	41	Very low	76 Å²	76	104.3 Å²	104.3	63%	0.628	53%	0.534	S	S	*	.			trans	-134.1	28.8	-174.6	0	0	0	0	0	111.8	D136	D136-A138 PolarHBondContact O-N 3.29Å
139	K	40.3	Very low	39.6	Very low	154 Å²	154	110.5 Å²	110.5	67%	0.67	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	3.6	-164.5	-85.5	-170.5	163.7	-169.8	0	116.6	D136	D136-K139 HydrophobicContact CB-CD 4.12Å; D136-K139 HydrophobicContact CB-CG 4.27Å; D136-K139 WeakPolarHBondContact OD2-CE 3.39Å
140	D	36.4	Very low	38	Very low	167 Å²	167	115.1 Å²	115.1	89%	0.893	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-9.6	179.9	-61.3	-42.9	0	0	0	113.5
141	E	34.5	Very low	36.1	Very low	172 Å²	172	118.5 Å²	118.5	80%	0.804	61%	0.606	S	S	*	*	S	Bend	trans	-131.9	132.6	176.7	-64.6	-174.1	156.8	0	0	111.5
142	E	33.4	Very low	34.6	Very low	175 Å²	175	124.6 Å²	124.6	82%	0.818	64%	0.639	S	S	*	*			trans	70.5	119.1	178.8	-56.6	-165.9	154.8	0	0	119.4	I144	E142-I144 PolarHBondContact O-N 2.97Å; E142-I144 VanDerWaalsContact O-N 3.12Å
143	E	26.7	Very low	33.5	Very low	201 Å²	201	131 Å²	131	94%	0.939	66%	0.659	S	S	*	*			trans	-68.1	100	164.4	-71.5	-174.2	105.5	0	0	111.2
144	I	29.2	Very low	32.4	Very low	135 Å²	135	132.9 Å²	132.9	69%	0.692	67%	0.674	S	S	*	*			trans	-100.9	108.6	164.3	-61.1	-176.6	0	0	0	109.8	E142 V146	E142-I144 PolarHBondContact O-N 2.97Å; E142-I144 VanDerWaalsContact O-N 3.12Å; I144-V146 PolarHBondContact O-N 3.45Å
145	V	27.4	Very low	31.5	Very low	118 Å²	118	132 Å²	132	72%	0.715	67%	0.67	S	S	*	*			trans	-42.4	129.8	173.8	174.6	0	0	0	0	111.2	I147	V145-I147 VanDerWaalsContact C-N 3.35Å; V145-I147 PolarHBondContact O-N 3.11Å
146	V	27.9	Very low	30.9	Very low	122 Å²	122	138 Å²	138	74%	0.739	70%	0.697	S	S	*	*			trans	-63.5	98	167.2	179.6	0	0	0	0	108.1	I144 E148	I144-V146 PolarHBondContact O-N 3.45Å; V146-E148 HydrophobicContact CG1-CG 4.16Å; V146-E148 PolarHBondContact O-N 3.4Å
147	I	25.2	Very low	30.6	Very low	153 Å²	153	139 Å²	139	79%	0.785	71%	0.71	S	S	*	*			trans	-69.9	85.9	163.5	-57.2	179.9	0	0	0	106.5	V145 R149	V145-I147 VanDerWaalsContact C-N 3.35Å; V145-I147 PolarHBondContact O-N 3.11Å; I147-R149 PolarHBondContact O-N 3.05Å
148	E	27.1	Very low	30.1	Very low	116 Å²	116	141.8 Å²	141.8	54%	0.542	73%	0.731	S	S	.	*	P	Polyproline II helix	trans	-51.2	122.7	161.3	-67.4	-157.9	126.8	0	0	107.8	V146 P150 N151	V146-E148 HydrophobicContact CG1-CG 4.16Å; V146-E148 PolarHBondContact O-N 3.4Å; E148-P150 WeakPolarHBondContact O-CD 3.34Å; E148-N151 PolarHBondContact OE1-ND2 2.87Å; E148-N151 PolarHBondContact OE2-ND2 2.9Å
149	R	26.7	Very low	30.1	Very low	234 Å²	234	143.4 Å²	143.4	88%	0.883	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-60.9	124.3	160.3	-71.2	-176.4	176.9	-179.7	0.5	105.7	I147 N151	I147-R149 PolarHBondContact O-N 3.05Å; R149-N151 PolarHBondContact O-N 3.27Å
150	P	24.3	Very low	29.6	Very low	116 Å²	116	144 Å²	144	75%	0.753	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-46.4	125.8	-161.8	-34.3	35.3	0	0	0	114	E148 N152	E148-P150 WeakPolarHBondContact O-CD 3.34Å; P150-N152 PolarHBondContact O-N 3.28Å
151	N	26.6	Very low	29.3	Very low	75 Å²	75	144.6 Å²	144.6	40%	0.401	74%	0.735	S	S	.	*			trans	-64.9	72.9	-177.2	-101.3	-62.1	0	0	0	112.4	E148 R149 R153	E148-N151 PolarHBondContact OE1-ND2 2.87Å; E148-N151 PolarHBondContact OE2-ND2 2.9Å; R149-N151 PolarHBondContact O-N 3.27Å; N151-R153 PolarHBondContact OD1-NE 3.38Å; N151-R153 PolarHBondContact OD1-NH2 3.09Å
152	N	28.6	Very low	29.1	Very low	134 Å²	134	139.5 Å²	139.5	72%	0.717	72%	0.718	S	S	*	*			trans	-105.8	71.1	163.6	-90.7	-31.2	0	0	0	108.9	P150 I154	P150-N152 PolarHBondContact O-N 3.28Å; N152-I154 PolarHBondContact O-N 3.03Å
153	R	29.9	Very low	29.2	Very low	196 Å²	196	133.5 Å²	133.5	74%	0.74	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-66.6	126.6	179	-58.4	178.9	-173.8	-176.3	0.6	110.2	N151	N151-R153 PolarHBondContact OD1-NE 3.38Å; N151-R153 PolarHBondContact OD1-NH2 3.09Å
154	I	30.9	Very low	30	Very low	121 Å²	121	126.9 Å²	126.9	62%	0.621	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-83.4	126.3	147.7	-59.4	177.2	0	0	0	105.1	N152 E156 T182	N152-I154 PolarHBondContact O-N 3.03Å; I154-E156 PolarHBondContact O-N 3.35Å; I154-T182 HydrophobicContact CD1-CG2 4.1Å; I154-T182 HydrophobicContact CG1-CG2 4.34Å
155	P	28.7	Very low	30.7	Very low	98 Å²	98	124.8 Å²	124.8	64%	0.636	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-59.5	124.3	-173.8	-26.8	35.4	0	0	0	113.2	S157	P155-S157 PolarHBondContact O-N 3.04Å; P155-S157 VanDerWaalsContact O-N 3.16Å
156	E	32.4	Very low	32.1	Very low	184 Å²	184	123.7 Å²	123.7	86%	0.86	66%	0.664	S	S	*	*			trans	-81.2	15.6	-176	-62	-176.4	118.6	0	0	113.9	I154 T158	I154-E156 PolarHBondContact O-N 3.35Å; E156-T158 PolarHBondContact O-N 3.22Å
157	S	29.4	Very low	34.5	Very low	103 Å²	103	121.9 Å²	121.9	72%	0.72	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	36.9	-169.5	58.7	0	0	0	0	115	P155	P155-S157 PolarHBondContact O-N 3.04Å; P155-S157 VanDerWaalsContact O-N 3.16Å
158	T	31.9	Very low	37.4	Very low	128 Å²	128	121.7 Å²	121.7	79%	0.785	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-156.7	13.9	177.5	-22.1	0	0	0	0	115.5	E156	E156-T158 PolarHBondContact O-N 3.22Å
159	I	34.1	Very low	40.3	Very low	109 Å²	109	119.9 Å²	119.9	56%	0.559	63%	0.63	S	S	*	*			trans	-126.5	93.9	179.3	-51.1	-177.2	0	0	0	111.3	H161	I159-H161 WeakPolarHBondContact CG2-NE2 3.17Å; I159-H161 PolarHBondContact O-N 2.71Å
160	N	30.1	Very low	43.1	Very low	166 Å²	166	109 Å²	109	89%	0.888	59%	0.59	S	S	*	*			trans	-66.8	101.6	171.7	-75	-9.8	0	0	0	110.5	S162	N160-S162 PolarHBondContact O-N 2.63Å; N160-S162 VanDerWaalsContact O-N 3.11Å
161	H	31.1	Very low	45.9	Very low	180 Å²	180	108.9 Å²	108.9	83%	0.833	58%	0.579	S	S	*	*			trans	-83.3	81.3	174.6	-84.1	-63.6	0	0	0	111.9	I159	I159-H161 WeakPolarHBondContact CG2-NE2 3.17Å; I159-H161 PolarHBondContact O-N 2.71Å
162	S	29.5	Very low	48.6	Very low	65 Å²	65	108.8 Å²	108.8	46%	0.455	58%	0.583	S	S	.	*			trans	-129.4	149.6	170.2	-173.9	0	0	0	0	111.2	N160 T519	N160-S162 PolarHBondContact O-N 2.63Å; N160-S162 VanDerWaalsContact O-N 3.11Å; S162-T519 WeakPolarHBondContact OG-CG2 3.42Å
163	S	35.8	Very low	51.2	Low	50 Å²	50	105.6 Å²	105.6	35%	0.35	58%	0.575	S	S	.	*	S	Bend	trans	62.8	121.2	179	79.6	0	0	0	0	116.9
164	A	42.6	Very low	53.7	Low	62 Å²	62	98.8 Å²	98.8	51%	0.512	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	55.4	165.9	161.6	0	0	0	0	0	119.1	V166	A164-V166 HydrophobicContact CB-CG2 3.85Å; A164-V166 PolarHBondContact O-N 3.46Å
165	P	44.5	Very low	56.3	Low	91 Å²	91	93.3 Å²	93.3	59%	0.591	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	58.9	166.6	34	-35.9	0	0	0	110.8	W167	P165-W167 PolarHBondContact O-N 3.46Å
166	V	56.8	Low	59.1	Low	95 Å²	95	91.5 Å²	91.5	58%	0.576	51%	0.508	S	S	*	.			trans	-65.5	129	-179.3	-175.2	0	0	0	0	110	A164	A164-V166 HydrophobicContact CB-CG2 3.85Å; A164-V166 PolarHBondContact O-N 3.46Å
167	W	79.2	Confident	61.5	Low	84 Å²	84	85.9 Å²	85.9	32%	0.318	48%	0.483	S	S	.	.			trans	-83.8	121.9	169.4	-75.7	70.9	0	0	0	109.3	P165 T169 A257 R261 K263 P314	P165-W167 PolarHBondContact O-N 3.46Å; W167-T169 PolarHBondContact O-N 3.45Å; W167-A257 HydrophobicContact CZ3-CB 4.49Å; W167-A257 VanDerWaalsContact CZ3-O 3.27Å; W167-A257 WeakPolarHBondContact CZ3-O 3.48Å; W167-R261 CarbonylContact C-O 3.5Å; W167-R261 WeakPolarHBondContact CA-O 3.31Å; W167-K263 HydrophobicContact CB-CD 4.07Å; W167-K263 HydrophobicContact CB-CG 4.07Å; W167-K263 HydrophobicContact CD2-CG 4.33Å; W167-K263 HydrophobicContact CE3-CG 3.84Å; W167-K263 HydrophobicContact CG-CG 4.49Å; W167-P314 HydrophobicContact CH2-CB 3.54Å; W167-P314 HydrophobicContact CH2-CG 4.18Å; W167-P314 HydrophobicContact CZ3-CB 4.11Å
168	R	85.5	Confident	64	Low	148 Å²	148	81.6 Å²	81.6	56%	0.558	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.2	111.2	175	-176.5	176.9	178.2	130.5	-5.7	109.6	L170 E174 R261 Q262 K263	R168-L170 PolarHBondContact O-N 3.24Å; R168-E174 IonicContact CZ-OE1 2.84Å; R168-E174 IonicContact NE-OE1 2.69Å; R168-E174 PolarHBondContact NE-OE1 3.36Å; R168-E174 IonicContact NH2-OE1 2.68Å; R168-E174 PolarHBondContact NH2-OE1 2.95Å; R168-R261 PolarHBondContact N-O 2.98Å; R168-Q262 CarbonylContact O-C 3.57Å; R168-Q262 WeakPolarHBondContact O-CA 3.25Å; R168-K263 PolarHBondContact O-N 2.88Å
169	T	86.8	Confident	66.5	Low	78 Å²	78	77.3 Å²	77.3	48%	0.479	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	116.5	168	-56.3	0	0	0	0	109	W167 K263	W167-T169 PolarHBondContact O-N 3.45Å; T169-K263 HydrophobicContact CG2-CB 4.44Å
170	L	85.6	Confident	68.8	Low	6 Å²	6	76.9 Å²	76.9	3%	0.031	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-78.2	133.6	175.8	-71.4	179.2	0	0	0	110.7	R168 E174 L175 Q262 K263 Y264 P265 R319	R168-L170 PolarHBondContact O-N 3.24Å; L170-E174 WeakPolarHBondContact CA-OE2 3.32Å; L170-E174 HydrophobicContact CD2-CB 4.23Å; L170-L175 HydrophobicContact CB-CG 4.47Å; L170-L175 HydrophobicContact CD1-CD2 3.93Å; L170-L175 HydrophobicContact CD1-CG 4.42Å; L170-Q262 HydrophobicContact CD1-CB 4.26Å; L170-Q262 HydrophobicContact CD1-CG 4.13Å; L170-Q262 HydrophobicContact CG-CB 4.41Å; L170-Q262 HydrophobicContact CG-CG 4.19Å; L170-K263 PolarHBondContact N-O 3.37Å; L170-Y264 HydrophobicContact CD1-CD1 4.01Å; L170-Y264 HydrophobicContact CD1-CE1 3.86Å; L170-P265 WeakPolarHBondContact O-CD 3.16Å; L170-R319 VanDerWaalsContact CD1-NH1 3.33Å
171	Q	84.4	Confident	71.5	Confident	114 Å²	114	69.2 Å²	69.2	53%	0.533	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-75.2	148.3	170.6	-58.8	-56.6	-32.2	0	0	110.5	A173 E174 L175	Q171-A173 PolarHBondContact O-N 2.84Å; Q171-E174 HydrophobicContact CB-CG 4.38Å; Q171-E174 PolarHBondContact N-OE2 3.28Å; Q171-E174 PolarHBondContact O-N 3.29Å; Q171-L175 PolarHBondContact O-N 3.19Å
172	P	83.7	Confident	74	Confident	73 Å²	73	62.9 Å²	62.9	47%	0.474	36%	0.356	S	S	.	.	H	α-helix	trans	-53.9	-28.5	174.9	-27.9	35.5	0	0	0	113.8	L175 L176 P265	P172-L175 PolarHBondContact O-N 2.9Å; P172-L176 WeakPolarHBondContact O-CG 3.36Å; P172-L176 PolarHBondContact O-N 2.68Å; P172-P265 HydrophobicContact CG-CB 4.35Å; P172-P265 HydrophobicContact CG-CG 4.06Å
173	A	82	Confident	76.7	Confident	67 Å²	67	62.5 Å²	62.5	55%	0.554	35%	0.352	S	S	*	.	H	α-helix	trans	-67.2	-41.7	174.6	0	0	0	0	0	113.3	Q171 L175 L176 L177	Q171-A173 PolarHBondContact O-N 2.84Å; A173-L175 PolarHBondContact O-N 2.89Å; A173-L176 PolarHBondContact O-N 3.27Å; A173-L177 PolarHBondContact O-N 3.33Å
174	E	83.4	Confident	79	Confident	52 Å²	52	64.4 Å²	64.4	24%	0.243	37%	0.365	C	S	.	.	H	α-helix	trans	-65.8	-26	177	-65.3	174.3	99.2	0	0	112.3	R168 L170 Q171 R319	R168-E174 IonicContact CZ-OE1 2.84Å; R168-E174 IonicContact NE-OE1 2.69Å; R168-E174 PolarHBondContact NE-OE1 3.36Å; R168-E174 IonicContact NH2-OE1 2.68Å; R168-E174 PolarHBondContact NH2-OE1 2.95Å; L170-E174 WeakPolarHBondContact CA-OE2 3.32Å; L170-E174 HydrophobicContact CD2-CB 4.23Å; Q171-E174 HydrophobicContact CB-CG 4.38Å; Q171-E174 PolarHBondContact N-OE2 3.28Å; Q171-E174 PolarHBondContact O-N 3.29Å; E174-R319 PolarHBondContact O-NH2 3.44Å
175	L	85.8	Confident	81.2	Confident	7 Å²	7	64.1 Å²	64.1	4%	0.037	35%	0.354	C	S	.	.	H	α-helix	trans	-74.9	-39.8	174.8	-78.5	177.4	0	0	0	112.2	L170 Q171 P172 A173 L177 G178 P265 A268 Q323	L170-L175 HydrophobicContact CB-CG 4.47Å; L170-L175 HydrophobicContact CD1-CD2 3.93Å; L170-L175 HydrophobicContact CD1-CG 4.42Å; Q171-L175 PolarHBondContact O-N 3.19Å; P172-L175 PolarHBondContact O-N 2.9Å; A173-L175 PolarHBondContact O-N 2.89Å; L175-L177 VanDerWaalsContact C-N 3.27Å; L175-L177 PolarHBondContact O-N 3.03Å; L175-G178 PolarHBondContact O-N 3.35Å; L175-G178 VanDerWaalsContact O-N 3.17Å; L175-P265 HydrophobicContact CD1-CG 3.85Å; L175-A268 HydrophobicContact CD1-CB 3.65Å; L175-Q323 HydrophobicContact CB-CB 4.37Å; L175-Q323 HydrophobicContact CB-CG 4.01Å; L175-Q323 HydrophobicContact CD2-CG 4.33Å; L175-Q323 WeakPolarHBondContact O-CB 3.44Å; L175-Q323 WeakPolarHBondContact O-CG 3.19Å
176	L	86.1	Confident	83.4	Confident	60 Å²	60	61.2 Å²	61.2	31%	0.314	33%	0.334	S	S	.	.	H	α-helix	trans	-69.6	-15.8	-179.5	-69.3	169.5	0	0	0	114.5	P172 A173 G178 Q323 K325	P172-L176 WeakPolarHBondContact O-CG 3.36Å; P172-L176 PolarHBondContact O-N 2.68Å; A173-L176 PolarHBondContact O-N 3.27Å; L176-G178 PolarHBondContact O-N 2.86Å; L176-Q323 WeakPolarHBondContact CD2-O 3.37Å; L176-K325 HydrophobicContact CD1-CG 3.86Å; L176-K325 HydrophobicContact CD2-CG 3.85Å
177	L	82.8	Confident	85.2	Confident	65 Å²	65	56.7 Å²	56.7	34%	0.34	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-17.9	171.9	-66.1	173.3	0	0	0	112.8	A173 L175 D217 N224	A173-L177 PolarHBondContact O-N 3.33Å; L175-L177 VanDerWaalsContact C-N 3.27Å; L175-L177 PolarHBondContact O-N 3.03Å; L177-D217 HydrophobicContact CD2-CB 3.87Å; L177-N224 PolarHBondContact O-ND2 3.05Å
178	G	81.7	Confident	85.9	Confident	13 Å²	13	52.9 Å²	52.9	13%	0.134	29%	0.293	C	S	.	.			trans	73.1	-166.6	-175.2	0	0	0	0	0	114.1	L175 L176 C321	L175-G178 PolarHBondContact O-N 3.35Å; L175-G178 VanDerWaalsContact O-N 3.17Å; L176-G178 PolarHBondContact O-N 2.86Å; G178-C321 CarbonylContact C-O 3.44Å; G178-C321 VanDerWaalsContact C-O 3.31Å; G178-C321 WeakPolarHBondContact CA-O 3.48Å
179	L	85.3	Confident	86.2	Confident	38 Å²	38	47.4 Å²	47.4	20%	0.199	27%	0.272	C	S	.	.			trans	-135.4	128.5	174.9	-69.9	176.9	0	0	0	110	L253 R319 C321	L179-L253 HydrophobicContact CD1-CD1 3.62Å; L179-L253 HydrophobicContact CD1-CD2 4.41Å; L179-L253 HydrophobicContact CD1-CG 3.85Å; L179-R319 HydrophobicContact CD1-CG 4.15Å; L179-C321 HydrophobicContact CB-CB 4.07Å; L179-C321 PolarHBondContact N-O 3Å
180	Q	81.8	Confident	86.4	Confident	101 Å²	101	46.3 Å²	46.3	47%	0.472	26%	0.26	S	S	.	.			trans	-85.8	135.8	165.4	-170.4	179.2	-3.4	0	0	108.7
181	L	86.8	Confident	86.2	Confident	5 Å²	5	50.3 Å²	50.3	3%	0.026	28%	0.277	C	S	.	.			trans	-108.7	146.5	-178.4	-58.9	163.8	0	0	0	111.2	Q185 V187 V201 Y229 L251 L253	L181-Q185 HydrophobicContact CD2-CG 4.18Å; L181-V187 HydrophobicContact CD1-CG1 3.93Å; L181-V187 HydrophobicContact CD2-CG1 4.26Å; L181-V201 HydrophobicContact CB-CG2 4.13Å; L181-V201 HydrophobicContact CD1-CG2 4.22Å; L181-Y229 HydrophobicContact CB-CD1 4.24Å; L181-Y229 HydrophobicContact CB-CE1 3.63Å; L181-Y229 HydrophobicContact CD1-CE1 4.36Å; L181-Y229 HydrophobicContact CG-CE1 4.4Å; L181-Y229 PolarHBondContact N-OH 3.22Å; L181-L251 HydrophobicContact CD1-CB 4.2Å; L181-L251 HydrophobicContact CD1-CD1 3.7Å; L181-L253 HydrophobicContact CD2-CD2 3.65Å
182	T	84.8	Confident	85.8	Confident	47 Å²	47	48.2 Å²	48.2	29%	0.288	27%	0.272	S	S	.	.			trans	-95.1	157.5	175.3	45.5	0	0	0	0	111.8	I154 Q185 V201	I154-T182 HydrophobicContact CD1-CG2 4.1Å; I154-T182 HydrophobicContact CG1-CG2 4.34Å; T182-Q185 WeakPolarHBondContact O-CB 3.33Å; T182-Q185 PolarHBondContact O-N 2.95Å; T182-V201 WeakPolarHBondContact O-CB 3.3Å
183	P	85.5	Confident	85.2	Confident	57 Å²	57	52.3 Å²	52.3	37%	0.37	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	150.3	166.4	-26.1	36.1	0	0	0	112.6	Q185	P183-Q185 PolarHBondContact O-N 2.81Å; P183-Q185 VanDerWaalsContact O-N 3.16Å
184	S	84.7	Confident	84.9	Confident	89 Å²	89	53 Å²	53	62%	0.622	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.4	-8.1	-171.6	-55.5	0	0	0	0	117	V201	S184-V201 WeakPolarHBondContact CA-O 3.44Å; S184-V201 PolarHBondContact N-O 3.03Å
185	Q	88.2	Confident	84.8	Confident	57 Å²	57	52 Å²	52	27%	0.266	27%	0.274	S	S	.	.			trans	-62	130.7	-179.4	-170.7	69.9	-17.9	0	0	111.3	L181 T182 P183 R200 V201	L181-Q185 HydrophobicContact CD2-CG 4.18Å; T182-Q185 WeakPolarHBondContact O-CB 3.33Å; T182-Q185 PolarHBondContact O-N 2.95Å; P183-Q185 PolarHBondContact O-N 2.81Å; P183-Q185 VanDerWaalsContact O-N 3.16Å; Q185-R200 WeakPolarHBondContact O-CA 3.1Å; Q185-V201 HydrophobicContact CB-CG2 4.38Å; Q185-V201 PolarHBondContact O-N 2.67Å
186	P	91.6	Very high	85.1	Confident	29 Å²	29	52 Å²	52	19%	0.188	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	134.7	179.3	33.6	-35.4	0	0	0	111.1	A254 F255	P186-A254 HydrophobicContact CB-CB 3.97Å; P186-A254 HydrophobicContact CG-CB 4.48Å; P186-A254 WeakPolarHBondContact O-CB 3.18Å; P186-A254 PolarHBondContact O-N 3.45Å; P186-A254 VanDerWaalsContact O-N 3.15Å; P186-F255 HydrophobicContact CG-CE2 3.68Å; P186-F255 HydrophobicContact CG-CZ 3.73Å
187	V	93.8	Very high	85.2	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	158.5	-171.2	-69.2	0	0	0	0	112.1	L181 G199 V201 I231 L251 A252	L181-V187 HydrophobicContact CD1-CG1 3.93Å; L181-V187 HydrophobicContact CD2-CG1 4.26Å; V187-G199 PolarHBondContact N-O 3.23Å; V187-G199 PolarHBondContact O-N 2.74Å; V187-G199 VanDerWaalsContact O-O 3.13Å; V187-V201 HydrophobicContact CG1-CG2 3.99Å; V187-V201 HydrophobicContact CG2-CG2 4.31Å; V187-I231 HydrophobicContact CG2-CD1 4.19Å; V187-I231 HydrophobicContact CG2-CG2 4.12Å; V187-L251 HydrophobicContact CB-CD2 4.49Å; V187-L251 HydrophobicContact CG2-CD2 4.27Å; V187-A252 CarbonylContact C-O 3.56Å; V187-A252 VanDerWaalsContact CA-O 3.22Å; V187-A252 WeakPolarHBondContact CA-O 3.27Å; V187-A252 WeakPolarHBondContact CB-O 3.37Å
188	L	93.2	Very high	85.6	Confident	4 Å²	4	51.9 Å²	51.9	2%	0.021	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	130.7	159.8	-58.2	173.6	0	0	0	108.3	W196 F197 P198 L251 A252 V271 Y283 Y318	L188-W196 HydrophobicContact CB-CB 4.42Å; L188-W196 HydrophobicContact CB-CE3 4.22Å; L188-F197 CarbonylContact C-O 3.58Å; L188-F197 WeakPolarHBondContact CA-O 3.21Å; L188-P198 HydrophobicContact CD2-CB 4.29Å; L188-L251 WeakPolarHBondContact O-CA 3.33Å; L188-A252 HydrophobicContact CB-CB 4.29Å; L188-A252 PolarHBondContact N-O 3.27Å; L188-A252 PolarHBondContact O-N 2.77Å; L188-V271 HydrophobicContact CD1-CB 4.18Å; L188-V271 HydrophobicContact CD1-CG1 3.98Å; L188-Y283 HydrophobicContact CD1-CD1 3.95Å; L188-Y283 HydrophobicContact CD1-CE1 4.31Å; L188-Y283 HydrophobicContact CD1-CG 4.34Å; L188-Y283 HydrophobicContact CD2-CD2 4.33Å; L188-Y283 HydrophobicContact CD2-CE2 4.35Å; L188-Y283 HydrophobicContact CD2-CG 4.41Å; L188-Y318 HydrophobicContact CD1-CD1 4.2Å; L188-Y318 HydrophobicContact CD1-CD2 4.06Å; L188-Y318 HydrophobicContact CD1-CG 3.85Å
189	Y	92.5	Very high	86	Confident	33 Å²	33	51.3 Å²	51.3	13%	0.129	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	130.3	179.3	168.4	-104.3	0	0	0	111.4	K191 W196 F197 L233 C244 F245 A246 S250 L251	Y189-K191 HydrophobicContact CD1-CB 3.98Å; Y189-K191 HydrophobicContact CE1-CB 3.81Å; Y189-K191 HydrophobicContact CE1-CG 4.18Å; Y189-K191 PolarHBondContact O-N 3.4Å; Y189-W196 CarbonylContact O-C 3.54Å; Y189-W196 VanDerWaalsContact O-CA 3.29Å; Y189-W196 WeakPolarHBondContact O-CA 3.33Å; Y189-F197 PolarHBondContact N-O 3.33Å; Y189-F197 PolarHBondContact O-N 2.74Å; Y189-L233 HydrophobicContact CD1-CD1 4.3Å; Y189-L233 HydrophobicContact CD1-CD2 3.83Å; Y189-L233 HydrophobicContact CG-CD2 4.22Å; Y189-C244 HydrophobicContact CD1-CB 4.34Å; Y189-C244 HydrophobicContact CE1-CB 3.73Å; Y189-C244 HydrophobicContact CE2-CB 4.2Å; Y189-F245 PolarHBondContact OH-O 3.46Å; Y189-A246 HydrophobicContact CD2-CB 3.76Å; Y189-A246 HydrophobicContact CE2-CB 3.64Å; Y189-S250 WeakPolarHBondContact CA-O 3.35Å; Y189-L251 HydrophobicContact CD2-CD2 4.06Å
190	R	90.9	Very high	86.3	Confident	55 Å²	55	55.3 Å²	55.3	21%	0.208	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	96.5	176.4	-176.2	166.4	63.9	-173.3	-4.9	110.5	T192 W196 S249 S250 E330	R190-T192 WeakPolarHBondContact CG-O 3.32Å; R190-W196 HydrophobicContact CB-CD2 3.73Å; R190-W196 HydrophobicContact CB-CE3 3.8Å; R190-W196 HydrophobicContact CB-CG 4.38Å; R190-W196 HydrophobicContact CB-CH2 3.96Å; R190-W196 HydrophobicContact CB-CZ2 3.9Å; R190-W196 HydrophobicContact CB-CZ3 3.91Å; R190-W196 HydrophobicContact CG-CD2 4.35Å; R190-W196 HydrophobicContact CG-CZ2 4.25Å; R190-S249 PolarHBondContact NH2-O 3.44Å; R190-S250 PolarHBondContact N-O 3.42Å; R190-E330 IonicContact CZ-OE2 2.61Å; R190-E330 IonicContact NH1-OE2 3.48Å; R190-E330 PolarHBondContact NH1-OE2 2.89Å; R190-E330 IonicContact NH2-OE2 3.24Å
191	K	80.8	Confident	86.7	Confident	90 Å²	90	50.5 Å²	50.5	39%	0.391	26%	0.256	S	S	.	.			trans	-84.5	-31.1	-178	-173.1	175.3	-177.1	179	0	113.9	Y189 T195 F197 L233 E242	Y189-K191 HydrophobicContact CD1-CB 3.98Å; Y189-K191 HydrophobicContact CE1-CB 3.81Å; Y189-K191 HydrophobicContact CE1-CG 4.18Å; Y189-K191 PolarHBondContact O-N 3.4Å; K191-T195 PolarHBondContact N-O 3.33Å; K191-F197 HydrophobicContact CB-CD2 3.51Å; K191-F197 HydrophobicContact CB-CE2 3.75Å; K191-F197 HydrophobicContact CD-CD2 4.29Å; K191-F197 HydrophobicContact CD-CE2 4.25Å; K191-F197 HydrophobicContact CG-CD2 4.47Å; K191-F197 HydrophobicContact CG-CE2 4.46Å; K191-L233 HydrophobicContact CD-CD1 4.17Å; K191-E242 VanDerWaalsContact CE-OE1 3.29Å; K191-E242 WeakPolarHBondContact CE-OE1 3.42Å; K191-E242 IonicContact NZ-OE1 3.15Å; K191-E242 PolarHBondContact NZ-OE1 2.76Å; K191-E242 IonicContact NZ-OE2 2.68Å; K191-E242 PolarHBondContact NZ-OE2 2.89Å
192	T	76.8	Confident	86.7	Confident	70 Å²	70	54.6 Å²	54.6	43%	0.429	28%	0.277	S	S	.	.	S	Bend	trans	-120.8	177.3	172.1	77.6	0	0	0	0	109.2	R190 H194 T195	R190-T192 WeakPolarHBondContact CG-O 3.32Å; T192-H194 PolarHBondContact O-N 3.36Å; T192-H194 PolarHBondContact OG1-N 2.91Å; T192-T195 WeakPolarHBondContact CG2-OG1 3.46Å; T192-T195 PolarHBondContact OG1-N 2.85Å; T192-T195 PolarHBondContact OG1-OG1 2.84Å
193	Q	71.6	Confident	86.8	Confident	159 Å²	159	53.8 Å²	53.8	74%	0.743	27%	0.274	S	S	*	.	S	Bend	trans	-57.3	-22.3	176.9	-72.6	-179.8	-30	0	0	113.8
194	H	74.3	Confident	86.6	Confident	81 Å²	81	53.2 Å²	53.2	38%	0.375	27%	0.27	S	S	.	.	S	Bend	trans	-126	-33.1	-172.8	-48.9	-56	0	0	0	114.4	T192 Y284	T192-H194 PolarHBondContact O-N 3.36Å; T192-H194 PolarHBondContact OG1-N 2.91Å; H194-Y284 HydrophobicContact CB-CD1 4.01Å; H194-Y284 HydrophobicContact CB-CE1 3.99Å
195	T	82.5	Confident	86.2	Confident	33 Å²	33	54 Å²	54	20%	0.202	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	131.4	-170.7	61.5	0	0	0	0	113.4	K191 T192 F197 Y284	K191-T195 PolarHBondContact N-O 3.33Å; T192-T195 WeakPolarHBondContact CG2-OG1 3.46Å; T192-T195 PolarHBondContact OG1-N 2.85Å; T192-T195 PolarHBondContact OG1-OG1 2.84Å; T195-F197 WeakPolarHBondContact OG1-CE2 3.29Å; T195-Y284 HydrophobicContact CG2-CE1 4.09Å; T195-Y284 HydrophobicContact CG2-CE2 4.26Å
196	W	91.8	Very high	85.2	Confident	6 Å²	6	54.4 Å²	54.4	2%	0.023	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	147.5	178.5	-59.5	68.9	0	0	0	111.7	L188 Y189 R190 S250 A252 V271 Y283 S285 I320	L188-W196 HydrophobicContact CB-CB 4.42Å; L188-W196 HydrophobicContact CB-CE3 4.22Å; Y189-W196 CarbonylContact O-C 3.54Å; Y189-W196 VanDerWaalsContact O-CA 3.29Å; Y189-W196 WeakPolarHBondContact O-CA 3.33Å; R190-W196 HydrophobicContact CB-CD2 3.73Å; R190-W196 HydrophobicContact CB-CE3 3.8Å; R190-W196 HydrophobicContact CB-CG 4.38Å; R190-W196 HydrophobicContact CB-CH2 3.96Å; R190-W196 HydrophobicContact CB-CZ2 3.9Å; R190-W196 HydrophobicContact CB-CZ3 3.91Å; R190-W196 HydrophobicContact CG-CD2 4.35Å; R190-W196 HydrophobicContact CG-CZ2 4.25Å; W196-S250 WeakPolarHBondContact CZ3-O 3.2Å; W196-A252 HydrophobicContact CE3-CB 4.41Å; W196-A252 HydrophobicContact CZ3-CB 4Å; W196-V271 HydrophobicContact CB-CG1 4.02Å; W196-V271 HydrophobicContact CD2-CG1 4.15Å; W196-V271 HydrophobicContact CD2-CG2 3.54Å; W196-V271 HydrophobicContact CE3-CG2 3.71Å; W196-V271 HydrophobicContact CG-CG1 3.79Å; W196-V271 HydrophobicContact CG-CG2 4.09Å; W196-V271 HydrophobicContact CH2-CG2 4.02Å; W196-V271 HydrophobicContact CZ2-CG2 3.84Å; W196-V271 HydrophobicContact CZ3-CG2 3.95Å; W196-Y283 PolarHBondContact N-O 3.27Å; W196-S285 PolarHBondContact NE1-OG 3.12Å; W196-I320 HydrophobicContact CH2-CD1 4.03Å; W196-I320 HydrophobicContact CH2-CG1 3.96Å; W196-I320 HydrophobicContact CH2-CG2 4.22Å; W196-I320 HydrophobicContact CZ2-CD1 3.9Å; W196-I320 HydrophobicContact CZ2-CG1 4.28Å
197	F	88.9	Confident	83.7	Confident	86 Å²	86	56.5 Å²	56.5	38%	0.377	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	143.5	-175.6	-67.4	-95.2	0	0	0	111.6	L188 Y189 K191 T195 L233	L188-F197 CarbonylContact C-O 3.58Å; L188-F197 WeakPolarHBondContact CA-O 3.21Å; Y189-F197 PolarHBondContact N-O 3.33Å; Y189-F197 PolarHBondContact O-N 2.74Å; K191-F197 HydrophobicContact CB-CD2 3.51Å; K191-F197 HydrophobicContact CB-CE2 3.75Å; K191-F197 HydrophobicContact CD-CD2 4.29Å; K191-F197 HydrophobicContact CD-CE2 4.25Å; K191-F197 HydrophobicContact CG-CD2 4.47Å; K191-F197 HydrophobicContact CG-CE2 4.46Å; T195-F197 WeakPolarHBondContact OG1-CE2 3.29Å; F197-L233 HydrophobicContact CB-CD2 4.33Å
198	P	90.6	Very high	81.7	Confident	36 Å²	36	64.5 Å²	64.5	23%	0.234	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	147.4	175.7	28.5	-34.2	0	0	0	112.7	L188 D234	L188-P198 HydrophobicContact CD2-CB 4.29Å; P198-D234 HydrophobicContact CB-CB 4.35Å; P198-D234 HydrophobicContact CG-CB 4.22Å; P198-D234 PolarHBondContact O-N 3.02Å
199	G	89.5	Confident	79.7	Confident	1 Å²	1	66.4 Å²	66.4	1%	0.01	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.5	-169.1	175.8	0	0	0	0	0	112.7	V187 A232	V187-G199 PolarHBondContact N-O 3.23Å; V187-G199 PolarHBondContact O-N 2.74Å; V187-G199 VanDerWaalsContact O-O 3.13Å; G199-A232 CarbonylContact C-O 3.42Å; G199-A232 WeakPolarHBondContact CA-O 3.39Å
200	R	91.1	Very high	77.8	Confident	122 Å²	122	69.2 Å²	69.2	46%	0.46	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	141.9	-176.8	-64	177	-179.9	-88.1	-2.8	111.7	Q185 L202 I231 A232	Q185-R200 WeakPolarHBondContact O-CA 3.1Å; R200-L202 PolarHBondContact O-N 2.66Å; R200-I231 CarbonylContact O-C 3.58Å; R200-I231 WeakPolarHBondContact O-CA 3.47Å; R200-A232 PolarHBondContact N-O 2.92Å; R200-A232 PolarHBondContact O-N 3.25Å
201	V	90.2	Very high	76	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.006	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	127.1	171	-177.6	0	0	0	0	109.6	L181 T182 S184 Q185 V187 S203 Y229 I231	L181-V201 HydrophobicContact CB-CG2 4.13Å; L181-V201 HydrophobicContact CD1-CG2 4.22Å; T182-V201 WeakPolarHBondContact O-CB 3.3Å; S184-V201 WeakPolarHBondContact CA-O 3.44Å; S184-V201 PolarHBondContact N-O 3.03Å; Q185-V201 HydrophobicContact CB-CG2 4.38Å; Q185-V201 PolarHBondContact O-N 2.67Å; V187-V201 HydrophobicContact CG1-CG2 3.99Å; V187-V201 HydrophobicContact CG2-CG2 4.31Å; V201-S203 WeakPolarHBondContact CG1-O 3.27Å; V201-Y229 HydrophobicContact CG1-CD1 3.95Å; V201-I231 HydrophobicContact CB-CD1 4.36Å; V201-I231 HydrophobicContact CG2-CD1 3.85Å
202	L	88	Confident	74.6	Confident	90 Å²	90	73.1 Å²	73.1	47%	0.471	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	-47.5	170.9	-63.2	-178.3	0	0	0	111.2	R200 T230 A232 I243	R200-L202 PolarHBondContact O-N 2.66Å; L202-T230 HydrophobicContact CB-CG2 4.38Å; L202-T230 HydrophobicContact CD1-CG2 4.21Å; L202-T230 PolarHBondContact N-O 3.2Å; L202-A232 HydrophobicContact CD1-CB 4.06Å; L202-A232 HydrophobicContact CD2-CB 3.99Å; L202-A232 HydrophobicContact CG-CB 4.02Å; L202-I243 HydrophobicContact CD1-CD1 4.32Å; L202-I243 HydrophobicContact CD1-CG1 4.34Å; L202-I243 HydrophobicContact CD1-CG2 4.46Å
203	S	85.4	Confident	73.4	Confident	31 Å²	31	73.7 Å²	73.7	22%	0.217	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	159.8	177.8	72.8	0	0	0	0	111.5	V201 H205 Y229 T230	V201-S203 WeakPolarHBondContact CG1-O 3.27Å; S203-H205 PolarHBondContact OG-NE2 3.11Å; S203-Y229 WeakPolarHBondContact O-CA 3.47Å; S203-T230 PolarHBondContact N-O 3.3Å; S203-T230 PolarHBondContact O-N 3.35Å; S203-T230 WeakPolarHBondContact OG-CB 3.44Å; S203-T230 PolarHBondContact OG-OG1 2.87Å
204	C	81.9	Confident	72.4	Confident	45 Å²	45	72.3 Å²	72.3	30%	0.304	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	136	169.6	58.4	0	0	0	0	109.5	Q228 Y229	C204-Q228 CarbonylContact C-O 3.58Å; C204-Q228 WeakPolarHBondContact CA-O 3.41Å; C204-Y229 HydrophobicContact CB-CD1 3.56Å; C204-Y229 HydrophobicContact CB-CE1 3.44Å; C204-Y229 VanDerWaalsContact CB-CE1 3.44Å
205	H	76.8	Confident	71.7	Confident	106 Å²	106	72.1 Å²	72.1	49%	0.491	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	110.3	178	-59.4	-64.2	0	0	0	108.9	S203 Q228	S203-H205 PolarHBondContact OG-NE2 3.11Å; H205-Q228 PolarHBondContact N-O 2.92Å; H205-Q228 PolarHBondContact O-N 3.5Å
206	L	66.8	Low	71	Confident	64 Å²	64	73.2 Å²	73.2	34%	0.335	41%	0.414	S	S	.	.			trans	-85.4	126.1	171.5	-74.3	167	0	0	0	108.9	N208 A227	L206-N208 PolarHBondContact O-N 3.34Å; L206-A227 HydrophobicContact CD2-CB 3.88Å
207	P	59.9	Low	69.2	Low	74 Å²	74	78 Å²	78	48%	0.481	44%	0.441	S	S	.	.	S	Bend	trans	-73.1	109.8	177	27.4	-31.5	0	0	0	111.1	S209 N226	P207-S209 PolarHBondContact O-N 2.86Å; P207-N226 HydrophobicContact CG-CB 3.84Å
208	N	52	Low	68	Low	167 Å²	167	81.8 Å²	81.8	89%	0.893	46%	0.457	S	S	*	.	S	Bend	trans	49	58	166.8	-65.8	-4.1	0	0	0	116.4	L206	L206-N208 PolarHBondContact O-N 3.34Å
209	S	50.6	Low	66.7	Low	44 Å²	44	83.1 Å²	83.1	31%	0.308	46%	0.462	S	S	.	.			trans	-94.7	110.2	170	57.3	0	0	0	0	111.8	P207	P207-S209 PolarHBondContact O-N 2.86Å
210	D	52.6	Low	65.3	Low	92 Å²	92	90 Å²	90	49%	0.492	49%	0.488	S	S	.	.			trans	-63.6	127.1	166.1	-170.4	-38.5	0	0	0	109.7	S212	D210-S212 VanDerWaalsContact C-N 3.28Å; D210-S212 VanDerWaalsContact CG-OG 3.3Å; D210-S212 PolarHBondContact O-N 2.89Å; D210-S212 VanDerWaalsContact OD1-CB 3.27Å; D210-S212 WeakPolarHBondContact OD1-CB 3.33Å; D210-S212 PolarHBondContact OD1-N 2.86Å; D210-S212 PolarHBondContact OD1-OG 3.41Å
211	P	53.3	Low	63.9	Low	133 Å²	133	85.5 Å²	85.5	86%	0.864	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-16.2	179	-20	33.5	0	0	0	115.1
212	S	52.3	Low	62.8	Low	94 Å²	94	91.1 Å²	91.1	66%	0.657	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-13.4	-167.9	67.5	0	0	0	0	115.3	D210	D210-S212 VanDerWaalsContact C-N 3.28Å; D210-S212 VanDerWaalsContact CG-OG 3.3Å; D210-S212 PolarHBondContact O-N 2.89Å; D210-S212 VanDerWaalsContact OD1-CB 3.27Å; D210-S212 WeakPolarHBondContact OD1-CB 3.33Å; D210-S212 PolarHBondContact OD1-N 2.86Å; D210-S212 PolarHBondContact OD1-OG 3.41Å
213	T	52	Low	61.6	Low	82 Å²	82	89.6 Å²	89.6	50%	0.503	49%	0.491	S	S	.	.	S	Bend	trans	-107.5	126	-172	13.3	0	0	0	0	112.9	K215	T213-K215 WeakPolarHBondContact O-CG 3.3Å
214	P	50.5	Low	60.6	Low	131 Å²	131	88.7 Å²	88.7	85%	0.851	48%	0.484	S	S	*	.			trans	-71	130.6	170.6	29.4	-33.2	0	0	0	110.4
215	K	59.3	Low	59.9	Low	76 Å²	76	91.2 Å²	91.2	33%	0.33	49%	0.491	S	S	.	.			trans	-110.2	150.8	-170.4	-59.4	-179.8	-165.7	178.4	0	111.8	T213 D219 E223	T213-K215 WeakPolarHBondContact O-CG 3.3Å; K215-D219 HydrophobicContact CB-CB 4.27Å; K215-E223 WeakPolarHBondContact CD-OE1 3Å; K215-E223 WeakPolarHBondContact CD-OE2 3.34Å; K215-E223 WeakPolarHBondContact CE-OE1 3.12Å; K215-E223 IonicContact NZ-OE1 2.77Å; K215-E223 PolarHBondContact NZ-OE1 3.01Å; K215-E223 IonicContact NZ-OE2 2.74Å; K215-E223 PolarHBondContact NZ-OE2 2.59Å
216	S	68.5	Low	59.6	Low	56 Å²	56	90.6 Å²	90.6	39%	0.392	49%	0.491	S	S	.	.			trans	-76.8	159.6	174.4	85.1	0	0	0	0	111.6	K218 D219 R220	S216-K218 PolarHBondContact O-N 3.14Å; S216-K218 VanDerWaalsContact O-N 3.1Å; S216-K218 PolarHBondContact OG-N 3.42Å; S216-D219 WeakPolarHBondContact CB-OD2 3.44Å; S216-D219 PolarHBondContact N-OD2 2.92Å; S216-D219 PolarHBondContact O-N 2.88Å; S216-D219 PolarHBondContact OG-OD2 3.49Å; S216-R220 PolarHBondContact O-N 2.61Å
217	D	52.9	Low	60.1	Low	108 Å²	108	87.6 Å²	87.6	58%	0.578	48%	0.476	S	S	*	.	H	α-helix	trans	-53.6	-31.5	175.1	-67.5	-43.3	0	0	0	113.2	L177 D219 A221	L177-D217 HydrophobicContact CD2-CB 3.87Å; D217-D219 VanDerWaalsContact C-N 3.35Å; D217-A221 WeakPolarHBondContact O-CB 3.19Å; D217-A221 PolarHBondContact O-N 3.41Å
218	K	63.2	Low	61.2	Low	164 Å²	164	89.7 Å²	89.7	71%	0.713	48%	0.479	S	S	*	.	H	α-helix	trans	-68.9	-34.3	177.1	-66.1	177.9	-179.2	171.4	0	112.4	S216 K222	S216-K218 PolarHBondContact O-N 3.14Å; S216-K218 VanDerWaalsContact O-N 3.1Å; S216-K218 PolarHBondContact OG-N 3.42Å; K218-K222 WeakPolarHBondContact O-CG 3.45Å; K218-K222 PolarHBondContact O-N 3.06Å
219	D	64.4	Low	63	Low	64 Å²	64	81.8 Å²	81.8	34%	0.342	44%	0.437	S	S	.	.	H	α-helix	trans	-82	-40.7	-178.4	-50.5	-52.8	0	0	0	109.4	K215 S216 D217 A221 K222 E223	K215-D219 HydrophobicContact CB-CB 4.27Å; S216-D219 WeakPolarHBondContact CB-OD2 3.44Å; S216-D219 PolarHBondContact N-OD2 2.92Å; S216-D219 PolarHBondContact O-N 2.88Å; S216-D219 PolarHBondContact OG-OD2 3.49Å; D217-D219 VanDerWaalsContact C-N 3.35Å; D219-A221 VanDerWaalsContact C-N 3.31Å; D219-A221 PolarHBondContact O-N 2.93Å; D219-K222 WeakPolarHBondContact O-CB 3.37Å; D219-K222 PolarHBondContact O-N 3.03Å; D219-K222 VanDerWaalsContact O-N 3.12Å; D219-E223 WeakPolarHBondContact O-CG 3.35Å; D219-E223 PolarHBondContact O-N 2.8Å
220	R	60	Low	64.8	Low	147 Å²	147	80.6 Å²	80.6	56%	0.555	43%	0.428	S	S	*	.	H	α-helix	trans	-58.2	-40.3	171.9	-166.5	177.3	-173.3	-177.3	2.9	112.6	S216 E223 N224	S216-R220 PolarHBondContact O-N 2.61Å; R220-E223 PolarHBondContact O-N 3.29Å; R220-N224 PolarHBondContact O-N 2.94Å
221	A	61.2	Low	66.5	Low	27 Å²	27	76.2 Å²	76.2	22%	0.223	40%	0.404	C	S	.	.	H	α-helix	trans	-63.2	-42.4	174.3	0	0	0	0	0	112.4	D217 D219 N224 E225	D217-A221 WeakPolarHBondContact O-CB 3.19Å; D217-A221 PolarHBondContact O-N 3.41Å; D219-A221 VanDerWaalsContact C-N 3.31Å; D219-A221 PolarHBondContact O-N 2.93Å; A221-N224 PolarHBondContact O-N 3.14Å; A221-E225 WeakPolarHBondContact O-CB 3.47Å; A221-E225 PolarHBondContact O-N 2.66Å
222	K	66.3	Low	68.2	Low	119 Å²	119	70.8 Å²	70.8	52%	0.517	37%	0.371	S	S	.	.	H	α-helix	trans	-66.7	-37.9	175.5	-72	171	178	175.1	0	113.1	K218 D219 E225 N226	K218-K222 WeakPolarHBondContact O-CG 3.45Å; K218-K222 PolarHBondContact O-N 3.06Å; D219-K222 WeakPolarHBondContact O-CB 3.37Å; D219-K222 PolarHBondContact O-N 3.03Å; D219-K222 VanDerWaalsContact O-N 3.12Å; K222-E225 PolarHBondContact O-N 2.79Å; K222-N226 PolarHBondContact O-N 3.12Å; K222-N226 VanDerWaalsContact O-N 3.17Å; K222-N226 PolarHBondContact O-ND2 2.97Å
223	E	63.7	Low	69.8	Low	57 Å²	57	66.8 Å²	66.8	27%	0.266	34%	0.342	S	S	.	.	H	α-helix	trans	-67	-40.7	177.1	-71.8	-174.8	167.9	0	0	110.8	K215 D219 R220 E225 N226 A227	K215-E223 WeakPolarHBondContact CD-OE1 3Å; K215-E223 WeakPolarHBondContact CD-OE2 3.34Å; K215-E223 WeakPolarHBondContact CE-OE1 3.12Å; K215-E223 IonicContact NZ-OE1 2.77Å; K215-E223 PolarHBondContact NZ-OE1 3.01Å; K215-E223 IonicContact NZ-OE2 2.74Å; K215-E223 PolarHBondContact NZ-OE2 2.59Å; D219-E223 WeakPolarHBondContact O-CG 3.35Å; D219-E223 PolarHBondContact O-N 2.8Å; R220-E223 PolarHBondContact O-N 3.29Å; E223-E225 PolarHBondContact O-N 2.69Å; E223-N226 PolarHBondContact O-N 3.23Å; E223-A227 PolarHBondContact O-N 3.17Å; E223-A227 VanDerWaalsContact O-N 3.13Å
224	N	65	Low	71.1	Confident	12 Å²	12	67.2 Å²	67.2	6%	0.064	34%	0.341	C	S	.	.	H	α-helix	trans	-62.6	-38.9	171.3	-78	-19.5	0	0	0	112.8	L177 R220 A221 N226 A227 T248	L177-N224 PolarHBondContact O-ND2 3.05Å; R220-N224 PolarHBondContact O-N 2.94Å; A221-N224 PolarHBondContact O-N 3.14Å; N224-N226 VanDerWaalsContact C-N 3.32Å; N224-N226 PolarHBondContact O-N 3.25Å; N224-A227 PolarHBondContact O-N 2.8Å; N224-T248 WeakPolarHBondContact O-CG2 3.25Å; N224-T248 PolarHBondContact O-OG1 2.81Å
225	E	66.2	Low	71.7	Confident	98 Å²	98	63.2 Å²	63.2	46%	0.458	31%	0.314	S	S	.	.	H	α-helix	trans	-63.5	-35.5	178	-174.5	172.2	-163.5	0	0	112.7	A221 K222 E223 H322	A221-E225 WeakPolarHBondContact O-CB 3.47Å; A221-E225 PolarHBondContact O-N 2.66Å; K222-E225 PolarHBondContact O-N 2.79Å; E223-E225 PolarHBondContact O-N 2.69Å; E225-H322 IonicContact OE1-CE1 3.08Å
226	N	70.8	Confident	71.3	Confident	93 Å²	93	63.4 Å²	63.4	50%	0.497	33%	0.325	S	S	.	.	H	α-helix	trans	-94.6	-0.2	-179	-67.1	-78	0	0	0	114.4	P207 K222 E223 N224 Q228	P207-N226 HydrophobicContact CG-CB 3.84Å; K222-N226 PolarHBondContact O-N 3.12Å; K222-N226 VanDerWaalsContact O-N 3.17Å; K222-N226 PolarHBondContact O-ND2 2.97Å; E223-N226 PolarHBondContact O-N 3.23Å; N224-N226 VanDerWaalsContact C-N 3.32Å; N224-N226 PolarHBondContact O-N 3.25Å; N226-Q228 PolarHBondContact O-N 3.32Å
227	A	76.9	Confident	70.4	Confident	1 Å²	1	63.4 Å²	63.4	1%	0.008	33%	0.325	C	S	.	.			trans	-66.4	123.3	179.6	0	0	0	0	0	111.6	L206 E223 N224 Y229	L206-A227 HydrophobicContact CD2-CB 3.88Å; E223-A227 PolarHBondContact O-N 3.17Å; E223-A227 VanDerWaalsContact O-N 3.13Å; N224-A227 PolarHBondContact O-N 2.8Å; A227-Y229 HydrophobicContact CB-CE2 3.64Å; A227-Y229 WeakPolarHBondContact O-CD2 3.22Å; A227-Y229 WeakPolarHBondContact O-CE2 3.26Å
228	Q	84.6	Confident	70.4	Confident	118 Å²	118	64.4 Å²	64.4	55%	0.551	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.7	139.9	177.6	-64.5	-175.3	-2.8	0	0	110.7	C204 H205 N226	C204-Q228 CarbonylContact C-O 3.58Å; C204-Q228 WeakPolarHBondContact CA-O 3.41Å; H205-Q228 PolarHBondContact N-O 2.92Å; H205-Q228 PolarHBondContact O-N 3.5Å; N226-Q228 PolarHBondContact O-N 3.32Å
229	Y	87.9	Confident	70	Confident	2 Å²	2	59.3 Å²	59.3	1%	0.008	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	139.6	-179.7	-61.2	-90.5	0	0	0	110.9	L181 V201 S203 C204 A227 F245 A246 T248 L251	L181-Y229 HydrophobicContact CB-CD1 4.24Å; L181-Y229 HydrophobicContact CB-CE1 3.63Å; L181-Y229 HydrophobicContact CD1-CE1 4.36Å; L181-Y229 HydrophobicContact CG-CE1 4.4Å; L181-Y229 PolarHBondContact N-OH 3.22Å; V201-Y229 HydrophobicContact CG1-CD1 3.95Å; S203-Y229 WeakPolarHBondContact O-CA 3.47Å; C204-Y229 HydrophobicContact CB-CD1 3.56Å; C204-Y229 HydrophobicContact CB-CE1 3.44Å; C204-Y229 VanDerWaalsContact CB-CE1 3.44Å; A227-Y229 HydrophobicContact CB-CE2 3.64Å; A227-Y229 WeakPolarHBondContact O-CD2 3.22Å; A227-Y229 WeakPolarHBondContact O-CE2 3.26Å; Y229-F245 WeakPolarHBondContact O-CA 3.49Å; Y229-A246 PolarHBondContact N-O 2.69Å; Y229-A246 PolarHBondContact O-N 3.38Å; Y229-T248 HydrophobicContact CE2-CG2 3.66Å; Y229-L251 HydrophobicContact CD2-CD1 3.6Å; Y229-L251 HydrophobicContact CE2-CD1 4.31Å; Y229-L251 HydrophobicContact CG-CD1 3.81Å
230	T	89.4	Confident	69.3	Low	18 Å²	18	65.6 Å²	65.6	11%	0.11	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	125.3	169.1	-50.2	0	0	0	0	107.9	L202 S203 I243 F245	L202-T230 HydrophobicContact CB-CG2 4.38Å; L202-T230 HydrophobicContact CD1-CG2 4.21Å; L202-T230 PolarHBondContact N-O 3.2Å; S203-T230 PolarHBondContact N-O 3.3Å; S203-T230 PolarHBondContact O-N 3.35Å; S203-T230 WeakPolarHBondContact OG-CB 3.44Å; S203-T230 PolarHBondContact OG-OG1 2.87Å; T230-I243 HydrophobicContact CG2-CG2 3.43Å; T230-I243 VanDerWaalsContact CG2-CG2 3.43Å; T230-F245 HydrophobicContact CG2-CE1 4.21Å
231	I	88.5	Confident	69.4	Low	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	132.4	-173.5	-49.7	-58.4	0	0	0	109.9	V187 R200 V201 L233 I243 C244 A246 L251	V187-I231 HydrophobicContact CG2-CD1 4.19Å; V187-I231 HydrophobicContact CG2-CG2 4.12Å; R200-I231 CarbonylContact O-C 3.58Å; R200-I231 WeakPolarHBondContact O-CA 3.47Å; V201-I231 HydrophobicContact CB-CD1 4.36Å; V201-I231 HydrophobicContact CG2-CD1 3.85Å; I231-L233 HydrophobicContact CG2-CD2 4.27Å; I231-I243 CarbonylContact O-C 3.53Å; I231-I243 WeakPolarHBondContact O-CA 3.45Å; I231-C244 PolarHBondContact N-O 3.39Å; I231-C244 PolarHBondContact O-N 3.4Å; I231-A246 HydrophobicContact CD1-CB 4.42Å; I231-A246 HydrophobicContact CG1-CB 3.73Å; I231-L251 HydrophobicContact CD1-CD1 4.26Å; I231-L251 HydrophobicContact CD1-CD2 3.84Å; I231-L251 HydrophobicContact CG1-CD2 3.96Å
232	A	88.6	Confident	70.2	Confident	19 Å²	19	64.9 Å²	64.9	16%	0.157	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	125.3	163	0	0	0	0	0	109.6	G199 R200 L202	G199-A232 CarbonylContact C-O 3.42Å; G199-A232 WeakPolarHBondContact CA-O 3.39Å; R200-A232 PolarHBondContact N-O 2.92Å; R200-A232 PolarHBondContact O-N 3.25Å; L202-A232 HydrophobicContact CD1-CB 4.06Å; L202-A232 HydrophobicContact CD2-CB 3.99Å; L202-A232 HydrophobicContact CG-CB 4.02Å
233	L	86.4	Confident	70.9	Confident	10 Å²	10	64 Å²	64	5%	0.052	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	141.8	174.3	-64.5	-177.4	0	0	0	112.3	Y189 K191 F197 I231 T235 E242	Y189-L233 HydrophobicContact CD1-CD1 4.3Å; Y189-L233 HydrophobicContact CD1-CD2 3.83Å; Y189-L233 HydrophobicContact CG-CD2 4.22Å; K191-L233 HydrophobicContact CD-CD1 4.17Å; F197-L233 HydrophobicContact CB-CD2 4.33Å; I231-L233 HydrophobicContact CG2-CD2 4.27Å; L233-T235 HydrophobicContact CB-CG2 4.18Å; L233-T235 PolarHBondContact O-N 3.28Å; L233-E242 HydrophobicContact CB-CB 4.37Å; L233-E242 HydrophobicContact CD1-CB 4.35Å; L233-E242 HydrophobicContact CD1-CG 4.44Å; L233-E242 PolarHBondContact N-O 3.01Å
234	D	79.1	Confident	71.9	Confident	92 Å²	92	61.9 Å²	61.9	49%	0.492	33%	0.332	S	S	.	.			trans	-76.2	70	175	-72.2	-18.5	0	0	0	110.1	P198	P198-D234 HydrophobicContact CB-CB 4.35Å; P198-D234 HydrophobicContact CG-CB 4.22Å; P198-D234 PolarHBondContact O-N 3.02Å
235	T	62.1	Low	72.8	Confident	47 Å²	47	68.7 Å²	68.7	29%	0.288	36%	0.361	S	S	.	.			trans	-71.9	164.7	177.4	82	0	0	0	0	111.8	L233 S239 K240 E242	L233-T235 HydrophobicContact CB-CG2 4.18Å; L233-T235 PolarHBondContact O-N 3.28Å; T235-S239 WeakPolarHBondContact CB-OG 3.45Å; T235-S239 WeakPolarHBondContact OG1-CB 3.34Å; T235-S239 PolarHBondContact OG1-O 3.24Å; T235-S239 PolarHBondContact OG1-OG 3.27Å; T235-K240 PolarHBondContact OG1-O 3.06Å; T235-E242 HydrophobicContact CG2-CB 4.07Å
236	S	52.6	Low	73.7	Confident	80 Å²	80	64.3 Å²	64.3	56%	0.559	34%	0.342	S	S	*	.			trans	-59	158.6	176.8	76	0	0	0	0	113	K238 S239	S236-K238 PolarHBondContact O-N 3.44Å; S236-S239 PolarHBondContact N-OG 2.95Å; S236-S239 PolarHBondContact O-N 3.44Å; S236-S239 PolarHBondContact O-OG 2.82Å; S236-S239 PolarHBondContact OG-OG 3.18Å
237	S	49.7	Very low	74.3	Confident	55 Å²	55	62.6 Å²	62.6	39%	0.385	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-4.9	-179.2	57.1	0	0	0	0	116.5	L960 I961	S237-L960 WeakPolarHBondContact CB-O 3.41Å; S237-L960 PolarHBondContact OG-O 3.46Å; S237-I961 WeakPolarHBondContact CB-O 3.06Å
238	K	51	Low	74.6	Confident	130 Å²	130	62.6 Å²	62.6	57%	0.565	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	-5	176.7	-54.8	-157.1	-178.2	-165.6	0	114.2	S236 R957 N958 A959	S236-K238 PolarHBondContact O-N 3.44Å; K238-R957 PolarHBondContact NZ-O 3.32Å; K238-N958 PolarHBondContact NZ-O 3.32Å; K238-A959 HydrophobicContact CD-CB 3.93Å; K238-A959 WeakPolarHBondContact CE-O 3.46Å; K238-A959 HydrophobicContact CG-CB 3.94Å
239	S	54.9	Low	74.7	Confident	56 Å²	56	58.7 Å²	58.7	39%	0.392	32%	0.321	S	S	.	.	S	Bend	trans	-108.6	147.7	-176.4	32.9	0	0	0	0	111.3	T235 S236	T235-S239 WeakPolarHBondContact CB-OG 3.45Å; T235-S239 WeakPolarHBondContact OG1-CB 3.34Å; T235-S239 PolarHBondContact OG1-O 3.24Å; T235-S239 PolarHBondContact OG1-OG 3.27Å; S236-S239 PolarHBondContact N-OG 2.95Å; S236-S239 PolarHBondContact O-N 3.44Å; S236-S239 PolarHBondContact O-OG 2.82Å; S236-S239 PolarHBondContact OG-OG 3.18Å
240	K	51.5	Low	74.7	Confident	197 Å²	197	59.3 Å²	59.3	86%	0.857	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-64.9	141.7	166.1	-69.4	-174.2	177.4	-176.3	0	108.5	T235 E242	T235-K240 PolarHBondContact OG1-O 3.06Å; K240-E242 PolarHBondContact O-N 2.85Å
241	S	60.3	Low	74.9	Confident	81 Å²	81	58.4 Å²	58.4	57%	0.566	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-56.5	122.3	171.1	37.5	0	0	0	0	110.1
242	E	78.4	Confident	75.1	Confident	78 Å²	78	58.4 Å²	58.4	36%	0.364	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-83.6	118.5	179.7	-172.5	176.3	-165.1	0	0	108.6	K191 L233 T235 K240	K191-E242 VanDerWaalsContact CE-OE1 3.29Å; K191-E242 WeakPolarHBondContact CE-OE1 3.42Å; K191-E242 IonicContact NZ-OE1 3.15Å; K191-E242 PolarHBondContact NZ-OE1 2.76Å; K191-E242 IonicContact NZ-OE2 2.68Å; K191-E242 PolarHBondContact NZ-OE2 2.89Å; L233-E242 HydrophobicContact CB-CB 4.37Å; L233-E242 HydrophobicContact CD1-CB 4.35Å; L233-E242 HydrophobicContact CD1-CG 4.44Å; L233-E242 PolarHBondContact N-O 3.01Å; T235-E242 HydrophobicContact CG2-CB 4.07Å; K240-E242 PolarHBondContact O-N 2.85Å
243	I	81.9	Confident	75.4	Confident	100 Å²	100	58.2 Å²	58.2	51%	0.513	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	118.2	178.2	-60.8	177.2	0	0	0	108.4	L202 T230 I231	L202-I243 HydrophobicContact CD1-CD1 4.32Å; L202-I243 HydrophobicContact CD1-CG1 4.34Å; L202-I243 HydrophobicContact CD1-CG2 4.46Å; T230-I243 HydrophobicContact CG2-CG2 3.43Å; T230-I243 VanDerWaalsContact CG2-CG2 3.43Å; I231-I243 CarbonylContact O-C 3.53Å; I231-I243 WeakPolarHBondContact O-CA 3.45Å
244	C	83.8	Confident	75.7	Confident	12 Å²	12	59.2 Å²	59.2	8%	0.081	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	146.9	-178.7	-61.3	0	0	0	0	110.7	Y189 I231	Y189-C244 HydrophobicContact CD1-CB 4.34Å; Y189-C244 HydrophobicContact CE1-CB 3.73Å; Y189-C244 HydrophobicContact CE2-CB 4.2Å; I231-C244 PolarHBondContact N-O 3.39Å; I231-C244 PolarHBondContact O-N 3.4Å
245	F	84.3	Confident	76.3	Confident	155 Å²	155	58.2 Å²	58.2	68%	0.68	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.8	139.8	167.4	-63.6	-81.1	0	0	0	109.6	Y189 Y229 T230	Y189-F245 PolarHBondContact OH-O 3.46Å; Y229-F245 WeakPolarHBondContact O-CA 3.49Å; T230-F245 HydrophobicContact CG2-CE1 4.21Å
246	A	84.3	Confident	77.8	Confident	7 Å²	7	56 Å²	56	6%	0.058	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	151.2	-169.3	0	0	0	0	0	112.1	Y189 Y229 I231 L251	Y189-A246 HydrophobicContact CD2-CB 3.76Å; Y189-A246 HydrophobicContact CE2-CB 3.64Å; Y229-A246 PolarHBondContact N-O 2.69Å; Y229-A246 PolarHBondContact O-N 3.38Å; I231-A246 HydrophobicContact CD1-CB 4.42Å; I231-A246 HydrophobicContact CG1-CB 3.73Å; A246-L251 HydrophobicContact CB-CD1 3.93Å; A246-L251 HydrophobicContact CB-CD2 3.82Å; A246-L251 HydrophobicContact CB-CG 3.9Å
247	V	85.1	Confident	79.7	Confident	57 Å²	57	52.2 Å²	52.2	35%	0.345	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	164.8	167.3	-69.1	0	0	0	0	109.9	S249 S250	V247-S249 WeakPolarHBondContact CG2-OG 3.37Å; V247-S249 PolarHBondContact O-N 2.79Å; V247-S249 VanDerWaalsContact O-N 3.1Å; V247-S250 PolarHBondContact N-OG 3.49Å; V247-S250 WeakPolarHBondContact O-CA 3.47Å; V247-S250 PolarHBondContact O-N 3.17Å; V247-S250 PolarHBondContact O-OG 2.94Å
248	T	83	Confident	81.6	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.006	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-58.2	-26.8	-176	46.9	0	0	0	0	114.8	N224 Y229 S250 L251 H322	N224-T248 WeakPolarHBondContact O-CG2 3.25Å; N224-T248 PolarHBondContact O-OG1 2.81Å; Y229-T248 HydrophobicContact CE2-CG2 3.66Å; T248-S250 VanDerWaalsContact C-N 3.29Å; T248-S250 PolarHBondContact O-N 2.9Å; T248-L251 PolarHBondContact O-N 2.83Å; T248-H322 PolarHBondContact O-N 2.94Å
249	S	85.3	Confident	83.5	Confident	36 Å²	36	51.5 Å²	51.5	25%	0.252	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-76.9	-9.1	173.5	61.3	0	0	0	0	114.6	R190 V247	R190-S249 PolarHBondContact NH2-O 3.44Å; V247-S249 WeakPolarHBondContact CG2-OG 3.37Å; V247-S249 PolarHBondContact O-N 2.79Å; V247-S249 VanDerWaalsContact O-N 3.1Å
250	S	89.1	Confident	85.1	Confident	14 Å²	14	51 Å²	51	10%	0.098	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-103.8	7.8	172	62.2	0	0	0	0	113.4	Y189 R190 W196 V247 T248	Y189-S250 WeakPolarHBondContact CA-O 3.35Å; R190-S250 PolarHBondContact N-O 3.42Å; W196-S250 WeakPolarHBondContact CZ3-O 3.2Å; V247-S250 PolarHBondContact N-OG 3.49Å; V247-S250 WeakPolarHBondContact O-CA 3.47Å; V247-S250 PolarHBondContact O-N 3.17Å; V247-S250 PolarHBondContact O-OG 2.94Å; T248-S250 VanDerWaalsContact C-N 3.29Å; T248-S250 PolarHBondContact O-N 2.9Å
251	L	93	Very high	86.9	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	142.7	-173.7	-64.9	173.1	0	0	0	112.1	L181 V187 L188 Y189 Y229 I231 A246 T248 I320 C321	L181-L251 HydrophobicContact CD1-CB 4.2Å; L181-L251 HydrophobicContact CD1-CD1 3.7Å; V187-L251 HydrophobicContact CB-CD2 4.49Å; V187-L251 HydrophobicContact CG2-CD2 4.27Å; L188-L251 WeakPolarHBondContact O-CA 3.33Å; Y189-L251 HydrophobicContact CD2-CD2 4.06Å; Y229-L251 HydrophobicContact CD2-CD1 3.6Å; Y229-L251 HydrophobicContact CE2-CD1 4.31Å; Y229-L251 HydrophobicContact CG-CD1 3.81Å; I231-L251 HydrophobicContact CD1-CD1 4.26Å; I231-L251 HydrophobicContact CD1-CD2 3.84Å; I231-L251 HydrophobicContact CG1-CD2 3.96Å; A246-L251 HydrophobicContact CB-CD1 3.93Å; A246-L251 HydrophobicContact CB-CD2 3.82Å; A246-L251 HydrophobicContact CB-CG 3.9Å; T248-L251 PolarHBondContact O-N 2.83Å; L251-I320 WeakPolarHBondContact O-CG2 3.31Å; L251-C321 HydrophobicContact CB-CB 4.41Å; L251-C321 WeakPolarHBondContact O-CB 3.38Å; L251-C321 PolarHBondContact O-N 3.5Å
252	A	93.7	Very high	88.3	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	154.5	169.1	0	0	0	0	0	109.9	V187 L188 W196 V271 R319 I320	V187-A252 CarbonylContact C-O 3.56Å; V187-A252 VanDerWaalsContact CA-O 3.22Å; V187-A252 WeakPolarHBondContact CA-O 3.27Å; V187-A252 WeakPolarHBondContact CB-O 3.37Å; L188-A252 HydrophobicContact CB-CB 4.29Å; L188-A252 PolarHBondContact N-O 3.27Å; L188-A252 PolarHBondContact O-N 2.77Å; W196-A252 HydrophobicContact CE3-CB 4.41Å; W196-A252 HydrophobicContact CZ3-CB 4Å; A252-V271 HydrophobicContact CB-CG2 3.7Å; A252-R319 CarbonylContact C-O 3.55Å; A252-R319 VanDerWaalsContact CA-O 3.22Å; A252-R319 WeakPolarHBondContact CA-O 3.38Å; A252-R319 VanDerWaalsContact CB-O 3.32Å; A252-R319 WeakPolarHBondContact CB-O 3.39Å; A252-I320 HydrophobicContact CB-CB 4.46Å; A252-I320 HydrophobicContact CB-CG1 4.05Å
253	L	93.6	Very high	89	Confident	15 Å²	15	45.3 Å²	45.3	8%	0.079	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	135.8	171.4	-67.6	177.3	0	0	0	109.8	L179 L181 F255 L260 R319	L179-L253 HydrophobicContact CD1-CD1 3.62Å; L179-L253 HydrophobicContact CD1-CD2 4.41Å; L179-L253 HydrophobicContact CD1-CG 3.85Å; L181-L253 HydrophobicContact CD2-CD2 3.65Å; L253-F255 PolarHBondContact O-N 2.9Å; L253-F255 VanDerWaalsContact O-N 3.14Å; L253-L260 HydrophobicContact CD1-CD1 3.78Å; L253-L260 HydrophobicContact CD1-CD2 4.17Å; L253-R319 PolarHBondContact N-O 3.03Å
254	A	92.6	Very high	89.5	Confident	31 Å²	31	40.7 Å²	40.7	26%	0.256	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	11.5	171	0	0	0	0	0	113.4	P186	P186-A254 HydrophobicContact CB-CB 3.97Å; P186-A254 HydrophobicContact CG-CB 4.48Å; P186-A254 WeakPolarHBondContact O-CB 3.18Å; P186-A254 PolarHBondContact O-N 3.45Å; P186-A254 VanDerWaalsContact O-N 3.15Å
255	F	91.5	Very high	90	Very high	71 Å²	71	41.4 Å²	41.4	31%	0.311	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	130.2	173.5	-60.5	-76.8	0	0	0	109.7	P186 L253 E259 L260	P186-F255 HydrophobicContact CG-CE2 3.68Å; P186-F255 HydrophobicContact CG-CZ 3.73Å; L253-F255 PolarHBondContact O-N 2.9Å; L253-F255 VanDerWaalsContact O-N 3.14Å; F255-E259 HydrophobicContact CB-CB 4.36Å; F255-L260 HydrophobicContact CB-CD1 4.22Å; F255-L260 HydrophobicContact CB-CD2 3.9Å; F255-L260 HydrophobicContact CB-CG 3.82Å; F255-L260 WeakPolarHBondContact O-CD1 3.3Å
256	S	93.8	Very high	90.4	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.007	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	165.5	179.9	66.3	0	0	0	0	112.8	S258 E259 L260 N315 V317	S256-S258 PolarHBondContact O-N 3.12Å; S256-S258 VanDerWaalsContact O-N 3.17Å; S256-E259 VanDerWaalsContact CB-OE2 3.23Å; S256-E259 WeakPolarHBondContact CB-OE2 3.19Å; S256-E259 PolarHBondContact N-OE2 3.06Å; S256-E259 PolarHBondContact O-N 3.05Å; S256-E259 PolarHBondContact OG-N 2.67Å; S256-E259 PolarHBondContact OG-OE2 2.99Å; S256-L260 WeakPolarHBondContact O-CB 3.19Å; S256-L260 WeakPolarHBondContact O-CG 3.45Å; S256-L260 PolarHBondContact O-N 2.84Å; S256-N315 WeakPolarHBondContact CB-O 3.39Å; S256-V317 CarbonylContact C-O 3.56Å; S256-V317 VanDerWaalsContact CA-O 3.23Å; S256-V317 WeakPolarHBondContact CA-O 3.18Å
257	A	92.2	Very high	90.9	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-33.4	174.1	0	0	0	0	0	111.8	W167 R261 Q262 Y264 Y300 P314 V317	W167-A257 HydrophobicContact CZ3-CB 4.49Å; W167-A257 VanDerWaalsContact CZ3-O 3.27Å; W167-A257 WeakPolarHBondContact CZ3-O 3.48Å; A257-R261 CarbonylContact O-C 3.51Å; A257-R261 VanDerWaalsContact O-CA 3.27Å; A257-R261 WeakPolarHBondContact O-CA 3.23Å; A257-R261 PolarHBondContact O-N 3.3Å; A257-Q262 PolarHBondContact O-N 3.23Å; A257-Y264 HydrophobicContact CB-CD2 4.17Å; A257-Y264 HydrophobicContact CB-CE2 3.49Å; A257-Y264 VanDerWaalsContact CB-CE2 3.49Å; A257-Y300 HydrophobicContact CB-CE2 4.09Å; A257-P314 HydrophobicContact CB-CB 4.44Å; A257-P314 VanDerWaalsContact CB-O 3.3Å; A257-P314 WeakPolarHBondContact CB-O 3.21Å; A257-P314 PolarHBondContact N-O 2.92Å; A257-V317 HydrophobicContact CB-CB 4.5Å; A257-V317 PolarHBondContact N-O 3.44Å
258	S	90.8	Very high	91.3	Very high	52 Å²	52	33.4 Å²	33.4	36%	0.364	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-33.1	176.1	-166.4	0	0	0	0	114.3	S256 P314	S256-S258 PolarHBondContact O-N 3.12Å; S256-S258 VanDerWaalsContact O-N 3.17Å; S258-P314 PolarHBondContact N-O 3.17Å
259	E	90.2	Very high	91.8	Very high	118 Å²	118	33.4 Å²	33.4	55%	0.551	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-40	175.7	-70.9	158.7	113.8	0	0	110.6	F255 S256 R261	F255-E259 HydrophobicContact CB-CB 4.36Å; S256-E259 VanDerWaalsContact CB-OE2 3.23Å; S256-E259 WeakPolarHBondContact CB-OE2 3.19Å; S256-E259 PolarHBondContact N-OE2 3.06Å; S256-E259 PolarHBondContact O-N 3.05Å; S256-E259 PolarHBondContact OG-N 2.67Å; S256-E259 PolarHBondContact OG-OE2 2.99Å; E259-R261 VanDerWaalsContact C-N 3.27Å; E259-R261 PolarHBondContact O-N 2.77Å
260	L	89.4	Confident	92.3	Very high	45 Å²	45	31.8 Å²	31.8	24%	0.236	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-11.7	175.2	-64	172.3	0	0	0	113.7	L253 F255 S256 Q262 Y264 R319	L253-L260 HydrophobicContact CD1-CD1 3.78Å; L253-L260 HydrophobicContact CD1-CD2 4.17Å; F255-L260 HydrophobicContact CB-CD1 4.22Å; F255-L260 HydrophobicContact CB-CD2 3.9Å; F255-L260 HydrophobicContact CB-CG 3.82Å; F255-L260 WeakPolarHBondContact O-CD1 3.3Å; S256-L260 WeakPolarHBondContact O-CB 3.19Å; S256-L260 WeakPolarHBondContact O-CG 3.45Å; S256-L260 PolarHBondContact O-N 2.84Å; L260-Q262 HydrophobicContact CB-CB 4.29Å; L260-Q262 HydrophobicContact CB-CG 4.21Å; L260-Q262 WeakPolarHBondContact O-CG 3.26Å; L260-Q262 PolarHBondContact O-N 3.3Å; L260-Y264 WeakPolarHBondContact CD1-OH 3.49Å; L260-R319 HydrophobicContact CD1-CB 4.48Å
261	R	89	Confident	92.6	Very high	138 Å²	138	31.1 Å²	31.1	52%	0.521	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	33.4	-171.7	-59.6	-175	175.1	-163	-1.2	114	W167 R168 A257 E259	W167-R261 CarbonylContact C-O 3.5Å; W167-R261 WeakPolarHBondContact CA-O 3.31Å; R168-R261 PolarHBondContact N-O 2.98Å; A257-R261 CarbonylContact O-C 3.51Å; A257-R261 VanDerWaalsContact O-CA 3.27Å; A257-R261 WeakPolarHBondContact O-CA 3.23Å; A257-R261 PolarHBondContact O-N 3.3Å; E259-R261 VanDerWaalsContact C-N 3.27Å; E259-R261 PolarHBondContact O-N 2.77Å
262	Q	90.2	Very high	92.7	Very high	35 Å²	35	31.1 Å²	31.1	16%	0.164	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	130.2	-176.8	-77.4	163.6	26.4	0	0	110.6	R168 L170 A257 L260 Y264 Y300	R168-Q262 CarbonylContact O-C 3.57Å; R168-Q262 WeakPolarHBondContact O-CA 3.25Å; L170-Q262 HydrophobicContact CD1-CB 4.26Å; L170-Q262 HydrophobicContact CD1-CG 4.13Å; L170-Q262 HydrophobicContact CG-CB 4.41Å; L170-Q262 HydrophobicContact CG-CG 4.19Å; A257-Q262 PolarHBondContact O-N 3.23Å; L260-Q262 HydrophobicContact CB-CB 4.29Å; L260-Q262 HydrophobicContact CB-CG 4.21Å; L260-Q262 WeakPolarHBondContact O-CG 3.26Å; L260-Q262 PolarHBondContact O-N 3.3Å; Q262-Y264 HydrophobicContact CB-CD1 4.37Å; Q262-Y264 HydrophobicContact CB-CE1 3.58Å; Q262-Y300 PolarHBondContact O-OH 2.82Å
263	K	91.7	Very high	92.6	Very high	63 Å²	63	32.3 Å²	32.3	27%	0.274	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	123.1	167.7	-82	-179.9	-179.5	-172.2	0	109.5	W167 R168 T169 L170 Y300	W167-K263 HydrophobicContact CB-CD 4.07Å; W167-K263 HydrophobicContact CB-CG 4.07Å; W167-K263 HydrophobicContact CD2-CG 4.33Å; W167-K263 HydrophobicContact CE3-CG 3.84Å; W167-K263 HydrophobicContact CG-CG 4.49Å; R168-K263 PolarHBondContact O-N 2.88Å; T169-K263 HydrophobicContact CG2-CB 4.44Å; L170-K263 PolarHBondContact N-O 3.37Å; K263-Y300 WeakPolarHBondContact CA-OH 3.49Å
264	Y	94	Very high	92.3	Very high	4 Å²	4	33.4 Å²	33.4	2%	0.016	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-93.4	135.5	179.8	-53.7	-46.1	0	0	0	111.4	L170 A257 L260 Q262 V270 Y300 V317 R319	L170-Y264 HydrophobicContact CD1-CD1 4.01Å; L170-Y264 HydrophobicContact CD1-CE1 3.86Å; A257-Y264 HydrophobicContact CB-CD2 4.17Å; A257-Y264 HydrophobicContact CB-CE2 3.49Å; A257-Y264 VanDerWaalsContact CB-CE2 3.49Å; L260-Y264 WeakPolarHBondContact CD1-OH 3.49Å; Q262-Y264 HydrophobicContact CB-CD1 4.37Å; Q262-Y264 HydrophobicContact CB-CE1 3.58Å; Y264-V270 HydrophobicContact CD2-CG1 3.92Å; Y264-V270 HydrophobicContact CE2-CG1 4.43Å; Y264-Y300 HydrophobicContact CD2-CE1 4.5Å; Y264-Y300 PolarHBondContact N-OH 3.01Å; Y264-V317 HydrophobicContact CD2-CG1 4.08Å; Y264-V317 HydrophobicContact CE2-CG1 4.2Å; Y264-R319 HydrophobicContact CE1-CB 4.29Å
265	P	93.2	Very high	91.8	Very high	27 Å²	27	37.1 Å²	37.1	18%	0.175	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-76	165.6	179.8	32.4	-35.4	0	0	0	112	L170 P172 L175 G267 A268	L170-P265 WeakPolarHBondContact O-CD 3.16Å; P172-P265 HydrophobicContact CG-CB 4.35Å; P172-P265 HydrophobicContact CG-CG 4.06Å; L175-P265 HydrophobicContact CD1-CG 3.85Å; P265-G267 PolarHBondContact O-N 3.08Å; P265-A268 HydrophobicContact CG-CB 4.3Å; P265-A268 WeakPolarHBondContact O-CB 3.41Å; P265-A268 PolarHBondContact O-N 3.16Å; P265-A268 VanDerWaalsContact O-N 3.11Å
266	V	93.6	Very high	90.9	Very high	32 Å²	32	36.5 Å²	36.5	19%	0.194	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	135.8	173.6	176.2	0	0	0	0	110.3	A268 I288 A289 Y342 L343 Y346	V266-A268 VanDerWaalsContact C-N 3.33Å; V266-I288 CarbonylContact C-O 3.31Å; V266-I288 WeakPolarHBondContact CA-O 3.45Å; V266-A289 WeakPolarHBondContact CG2-O 3.48Å; V266-Y342 HydrophobicContact CG1-CE1 4.07Å; V266-L343 HydrophobicContact CG1-CD2 3.78Å; V266-Y346 HydrophobicContact CB-CD1 4.44Å; V266-Y346 HydrophobicContact CB-CE1 4.28Å; V266-Y346 HydrophobicContact CB-CE2 4.41Å; V266-Y346 HydrophobicContact CG1-CD1 4.4Å; V266-Y346 HydrophobicContact CG1-CD2 4Å; V266-Y346 HydrophobicContact CG1-CE2 4.25Å; V266-Y346 HydrophobicContact CG1-CG 4.1Å; V266-Y346 HydrophobicContact CG2-CD2 4.37Å; V266-Y346 HydrophobicContact CG2-CE1 4.07Å; V266-Y346 HydrophobicContact CG2-CE2 3.78Å
267	G	93.2	Very high	89.7	Confident	15 Å²	15	43 Å²	43	16%	0.155	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.2	-2.8	-172.7	0	0	0	0	0	115.2	P265 L287 I288 N327	P265-G267 PolarHBondContact O-N 3.08Å; G267-L287 VanDerWaalsContact O-CD2 3.27Å; G267-L287 WeakPolarHBondContact O-CD2 3.36Å; G267-I288 PolarHBondContact N-O 2.87Å; G267-N327 PolarHBondContact O-ND2 3.39Å
268	A	94.6	Very high	88.3	Confident	4 Å²	4	49.3 Å²	49.3	3%	0.033	25%	0.25	C	C	.	.			trans	-68	134.8	168.1	0	0	0	0	0	110.8	L175 P265 V266 I288	L175-A268 HydrophobicContact CD1-CB 3.65Å; P265-A268 HydrophobicContact CG-CB 4.3Å; P265-A268 WeakPolarHBondContact O-CB 3.41Å; P265-A268 PolarHBondContact O-N 3.16Å; P265-A268 VanDerWaalsContact O-N 3.11Å; V266-A268 VanDerWaalsContact C-N 3.33Å; A268-I288 HydrophobicContact CB-CG1 4.3Å; A268-I288 PolarHBondContact O-N 3.07Å
269	R	93.8	Very high	86.8	Confident	1 Å²	1	49.7 Å²	49.7	0%	0.004	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	129.9	-179.9	-153.2	167.8	163.4	53.2	12	110	G286 L287 D305 I320 Q323 N327 E330	R269-G286 WeakPolarHBondContact CA-O 3.48Å; R269-L287 HydrophobicContact CB-CD2 4.03Å; R269-L287 HydrophobicContact CG-CD2 4.15Å; R269-D305 IonicContact CZ-OD1 2.72Å; R269-D305 IonicContact CZ-OD2 3.72Å; R269-D305 IonicContact NH1-OD1 2.98Å; R269-D305 PolarHBondContact NH1-OD1 3.39Å; R269-D305 IonicContact NH1-OD2 3.67Å; R269-D305 IonicContact NH2-OD1 3.32Å; R269-D305 PolarHBondContact NH2-OD1 2.59Å; R269-D305 IonicContact NH2-OD2 3.6Å; R269-D305 PolarHBondContact NH2-OD2 3.27Å; R269-I320 HydrophobicContact CB-CD1 4.31Å; R269-I320 HydrophobicContact CG-CD1 3.93Å; R269-Q323 PolarHBondContact O-NE2 2.98Å; R269-N327 HydrophobicContact CB-CB 4.26Å; R269-E330 WeakPolarHBondContact CD-OE1 3.38Å; R269-E330 IonicContact CZ-OE2 2.69Å; R269-E330 IonicContact NE-OE1 2.98Å; R269-E330 PolarHBondContact NE-OE1 2.76Å; R269-E330 IonicContact NE-OE2 3.37Å; R269-E330 PolarHBondContact NE-OE2 3.44Å; R269-E330 VanDerWaalsContact NH2-CB 3.27Å; R269-E330 IonicContact NH2-OE2 3.53Å; R269-E330 PolarHBondContact NH2-OE2 3.24Å
270	V	95.3	Very high	85.5	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.006	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	160.8	-171.7	-67.3	0	0	0	0	110.9	Y264 S285 G286 I288 L302 V317 Y318	Y264-V270 HydrophobicContact CD2-CG1 3.92Å; Y264-V270 HydrophobicContact CE2-CG1 4.43Å; V270-S285 WeakPolarHBondContact O-CA 3.35Å; V270-G286 PolarHBondContact N-O 2.96Å; V270-G286 PolarHBondContact O-N 2.74Å; V270-I288 HydrophobicContact CB-CD1 4.47Å; V270-I288 HydrophobicContact CG1-CD1 4.06Å; V270-I288 HydrophobicContact CG1-CG1 4.08Å; V270-I288 HydrophobicContact CG2-CD1 3.59Å; V270-I288 HydrophobicContact CG2-CG1 4.2Å; V270-L302 HydrophobicContact CG2-CD2 3.6Å; V270-L302 HydrophobicContact CG2-CG 4.36Å; V270-V317 HydrophobicContact CB-CG1 3.9Å; V270-V317 HydrophobicContact CG1-CG1 3.85Å; V270-V317 HydrophobicContact CG2-CG1 4.04Å; V270-Y318 WeakPolarHBondContact CA-O 3.3Å; V270-Y318 WeakPolarHBondContact CB-O 3.43Å
271	V	95.4	Very high	85.1	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	141.8	161.9	-168.9	0	0	0	0	107.9	L188 W196 A252 Y283 Y284 Y318 I320	L188-V271 HydrophobicContact CD1-CB 4.18Å; L188-V271 HydrophobicContact CD1-CG1 3.98Å; W196-V271 HydrophobicContact CB-CG1 4.02Å; W196-V271 HydrophobicContact CD2-CG1 4.15Å; W196-V271 HydrophobicContact CD2-CG2 3.54Å; W196-V271 HydrophobicContact CE3-CG2 3.71Å; W196-V271 HydrophobicContact CG-CG1 3.79Å; W196-V271 HydrophobicContact CG-CG2 4.09Å; W196-V271 HydrophobicContact CH2-CG2 4.02Å; W196-V271 HydrophobicContact CZ2-CG2 3.84Å; W196-V271 HydrophobicContact CZ3-CG2 3.95Å; A252-V271 HydrophobicContact CB-CG2 3.7Å; V271-Y283 HydrophobicContact CG1-CD1 4.48Å; V271-Y284 CarbonylContact C-O 3.46Å; V271-Y284 WeakPolarHBondContact CA-O 3.26Å; V271-Y284 WeakPolarHBondContact CG1-O 3.47Å; V271-Y318 PolarHBondContact N-O 3.23Å; V271-Y318 PolarHBondContact O-N 3.06Å; V271-I320 HydrophobicContact CG2-CD1 4.03Å; V271-I320 HydrophobicContact CG2-CG1 3.67Å
272	S	95	Very high	84.8	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	165.4	175.1	-168.1	0	0	0	0	111.9	Y274 Y283 Y284 S312 E316	S272-Y274 PolarHBondContact O-N 3.31Å; S272-Y283 WeakPolarHBondContact O-CA 3.47Å; S272-Y284 PolarHBondContact N-O 3.34Å; S272-Y284 PolarHBondContact O-N 3.47Å; S272-S312 VanDerWaalsContact OG-CB 3.27Å; S272-S312 WeakPolarHBondContact OG-CB 3.26Å; S272-S312 PolarHBondContact OG-OG 3.12Å; S272-E316 WeakPolarHBondContact CA-O 3.42Å; S272-E316 WeakPolarHBondContact CB-O 3.37Å; S272-E316 PolarHBondContact OG-O 3.06Å
273	I	91.6	Very high	84.9	Confident	26 Å²	26	45.4 Å²	45.4	13%	0.133	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	103.6	177.1	-57.7	-172.2	0	0	0	109.3	R275 I281 G282 Y283 Q310 E316	I273-R275 HydrophobicContact CG2-CG 4.43Å; I273-I281 HydrophobicContact CG2-CG2 3.36Å; I273-G282 CarbonylContact C-O 3.51Å; I273-G282 WeakPolarHBondContact CA-O 3.31Å; I273-Y283 HydrophobicContact CD1-CE1 4.21Å; I273-Y283 HydrophobicContact CG1-CD1 4.09Å; I273-Y283 HydrophobicContact CG1-CE1 3.83Å; I273-Q310 PolarHBondContact O-NE2 3.21Å; I273-E316 HydrophobicContact CB-CB 4.33Å; I273-E316 HydrophobicContact CD1-CB 4.17Å; I273-E316 HydrophobicContact CD1-CG 3.94Å; I273-E316 HydrophobicContact CG1-CB 4.13Å; I273-E316 HydrophobicContact CG1-CG 4.43Å; I273-E316 PolarHBondContact N-O 2.76Å
274	Y	86.5	Confident	84.9	Confident	37 Å²	37	45.7 Å²	45.7	15%	0.145	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	147	168.4	-168.3	-83.7	0	0	0	109.8	S272 D276 I281 G282 Y284 F304 D306 Y308	S272-Y274 PolarHBondContact O-N 3.31Å; Y274-D276 HydrophobicContact CE1-CB 4.02Å; Y274-I281 WeakPolarHBondContact O-CA 3.46Å; Y274-G282 PolarHBondContact N-O 3.2Å; Y274-G282 PolarHBondContact O-N 2.91Å; Y274-Y284 HydrophobicContact CD1-CD2 4.44Å; Y274-Y284 HydrophobicContact CD1-CE2 4.31Å; Y274-Y284 HydrophobicContact CD2-CD1 4.48Å; Y274-Y284 HydrophobicContact CD2-CD2 4.39Å; Y274-Y284 HydrophobicContact CD2-CG 4.17Å; Y274-Y284 AromaticContact CG-CD2 3.86Å; Y274-Y284 HydrophobicContact CG-CD2 3.86Å; Y274-Y284 HydrophobicContact CG-CE2 4.19Å; Y274-Y284 HydrophobicContact CG-CG 4.11Å; Y274-F304 HydrophobicContact CD2-CB 4.5Å; Y274-F304 HydrophobicContact CD2-CD1 4.01Å; Y274-F304 AromaticContact CD2-CD2 3.83Å; Y274-F304 HydrophobicContact CD2-CD2 3.83Å; Y274-F304 HydrophobicContact CD2-CE1 4.1Å; Y274-F304 AromaticContact CD2-CE2 3.9Å; Y274-F304 HydrophobicContact CD2-CE2 3.9Å; Y274-F304 AromaticContact CD2-CG 3.88Å; Y274-F304 HydrophobicContact CD2-CG 3.88Å; Y274-F304 HydrophobicContact CD2-CZ 4.04Å; Y274-F304 HydrophobicContact CE2-CD2 4.23Å; Y274-F304 HydrophobicContact CE2-CG 4.3Å; Y274-D306 WeakPolarHBondContact CE2-OD2 3.44Å; Y274-D306 PolarHBondContact OH-OD2 3.48Å; Y274-D306 VanDerWaalsContact OH-OD2 3.14Å; Y274-Y308 AromaticContact CD2-CD1 3.94Å; Y274-Y308 HydrophobicContact CD2-CD1 3.94Å; Y274-Y308 AromaticContact CE2-CD1 3.4Å; Y274-Y308 HydrophobicContact CE2-CD1 3.4Å; Y274-Y308 VanDerWaalsContact CE2-CD1 3.4Å; Y274-Y308 HydrophobicContact CE2-CE1 4.21Å; Y274-Y308 AromaticContact CE2-CG 3.96Å; Y274-Y308 HydrophobicContact CE2-CG 3.96Å; Y274-Y308 AromaticContact CZ-CD1 3.79Å
275	R	83.8	Confident	84.9	Confident	110 Å²	110	45.6 Å²	45.6	42%	0.415	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	115	178.3	-54.8	177.9	-169.2	-171.2	0.4	108.4	I273 G280 E316	I273-R275 HydrophobicContact CG2-CG 4.43Å; R275-G280 WeakPolarHBondContact CA-O 3.33Å; R275-E316 IonicContact CZ-OE2 3.91Å; R275-E316 IonicContact NE-OE2 2.96Å; R275-E316 IonicContact NH2-OE1 3.23Å; R275-E316 PolarHBondContact NH2-OE1 2.81Å; R275-E316 IonicContact NH2-OE2 2.84Å; R275-E316 PolarHBondContact NH2-OE2 2.84Å
276	D	72.6	Confident	84.9	Confident	57 Å²	57	44.3 Å²	44.3	31%	0.305	25%	0.251	S	S	.	.			trans	-87.9	163	178.9	66.3	61.8	0	0	0	112.7	Y274 T278 G279 G280	Y274-D276 HydrophobicContact CE1-CB 4.02Å; D276-T278 PolarHBondContact O-N 2.97Å; D276-T278 VanDerWaalsContact O-N 3.16Å; D276-T278 VanDerWaalsContact OD1-CA 3.23Å; D276-T278 WeakPolarHBondContact OD1-CA 3.48Å; D276-T278 VanDerWaalsContact OD1-CB 3.31Å; D276-T278 WeakPolarHBondContact OD1-CB 3.5Å; D276-T278 PolarHBondContact OD1-N 2.96Å; D276-T278 PolarHBondContact OD1-OG1 2.87Å; D276-G279 PolarHBondContact O-N 2.9Å; D276-G279 PolarHBondContact OD1-N 3.34Å; D276-G280 PolarHBondContact N-O 2.82Å; D276-G280 VanDerWaalsContact N-O 3.1Å; D276-G280 PolarHBondContact OD1-N 3.32Å; D276-G280 WeakPolarHBondContact OD2-CA 3.43Å; D276-G280 PolarHBondContact OD2-N 3.09Å
277	D	67.7	Low	84.9	Confident	137 Å²	137	42.9 Å²	42.9	73%	0.733	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-15.1	179.7	-73.1	-26.1	0	0	0	114	G279	D277-G279 VanDerWaalsContact C-N 3.34Å
278	T	63.8	Low	85.1	Confident	134 Å²	134	42.2 Å²	42.2	82%	0.822	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-5.5	174.5	77.6	0	0	0	0	112.7	D276	D276-T278 PolarHBondContact O-N 2.97Å; D276-T278 VanDerWaalsContact O-N 3.16Å; D276-T278 VanDerWaalsContact OD1-CA 3.23Å; D276-T278 WeakPolarHBondContact OD1-CA 3.48Å; D276-T278 VanDerWaalsContact OD1-CB 3.31Å; D276-T278 WeakPolarHBondContact OD1-CB 3.5Å; D276-T278 PolarHBondContact OD1-N 2.96Å; D276-T278 PolarHBondContact OD1-OG1 2.87Å
279	G	57.8	Low	85.1	Confident	60 Å²	60	42.1 Å²	42.1	62%	0.619	23%	0.234	S	C	*	.	S	Bend	trans	89.1	10.1	-178.5	0	0	0	0	0	114.3	D276 D277	D276-G279 PolarHBondContact O-N 2.9Å; D276-G279 PolarHBondContact OD1-N 3.34Å; D277-G279 VanDerWaalsContact C-N 3.34Å
280	G	64.2	Low	85.1	Confident	26 Å²	26	42.2 Å²	42.2	27%	0.268	24%	0.235	S	C	.	.			trans	-69.9	148.7	169.8	0	0	0	0	0	111.8	R275 D276	R275-G280 WeakPolarHBondContact CA-O 3.33Å; D276-G280 PolarHBondContact N-O 2.82Å; D276-G280 VanDerWaalsContact N-O 3.1Å; D276-G280 PolarHBondContact OD1-N 3.32Å; D276-G280 WeakPolarHBondContact OD2-CA 3.43Å; D276-G280 PolarHBondContact OD2-N 3.09Å
281	I	80.1	Confident	85	Confident	127 Å²	127	44 Å²	44	65%	0.651	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-136.1	126.9	-174.2	-57.1	-178.7	0	0	0	108.2	I273 Y274	I273-I281 HydrophobicContact CG2-CG2 3.36Å; Y274-I281 WeakPolarHBondContact O-CA 3.46Å
282	G	83.4	Confident	84.8	Confident	22 Å²	22	44.7 Å²	44.7	23%	0.227	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	167.1	-178.3	0	0	0	0	0	113.4	I273 Y274	I273-G282 CarbonylContact C-O 3.51Å; I273-G282 WeakPolarHBondContact CA-O 3.31Å; Y274-G282 PolarHBondContact N-O 3.2Å; Y274-G282 PolarHBondContact O-N 2.91Å
283	Y	91.3	Very high	84.5	Confident	71 Å²	71	46.6 Å²	46.6	28%	0.278	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	119.3	177.7	-63.9	-79.7	0	0	0	110.4	L188 W196 V271 S272 I273 Y318	L188-Y283 HydrophobicContact CD1-CD1 3.95Å; L188-Y283 HydrophobicContact CD1-CE1 4.31Å; L188-Y283 HydrophobicContact CD1-CG 4.34Å; L188-Y283 HydrophobicContact CD2-CD2 4.33Å; L188-Y283 HydrophobicContact CD2-CE2 4.35Å; L188-Y283 HydrophobicContact CD2-CG 4.41Å; W196-Y283 PolarHBondContact N-O 3.27Å; V271-Y283 HydrophobicContact CG1-CD1 4.48Å; S272-Y283 WeakPolarHBondContact O-CA 3.47Å; I273-Y283 HydrophobicContact CD1-CE1 4.21Å; I273-Y283 HydrophobicContact CG1-CD1 4.09Å; I273-Y283 HydrophobicContact CG1-CE1 3.83Å; Y283-Y318 HydrophobicContact CD1-CD2 4.47Å; Y283-Y318 HydrophobicContact CD1-CE2 4.11Å; Y283-Y318 HydrophobicContact CE1-CD2 4.4Å; Y283-Y318 AromaticContact CE1-CE2 3.66Å; Y283-Y318 HydrophobicContact CE1-CE2 3.66Å; Y283-Y318 AromaticContact CE1-CZ 3.97Å
284	Y	92.3	Very high	84.2	Confident	68 Å²	68	53.4 Å²	53.4	27%	0.267	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	150.9	-178	-73.4	-111.6	0	0	0	110.8	H194 T195 V271 S272 Y274	H194-Y284 HydrophobicContact CB-CD1 4.01Å; H194-Y284 HydrophobicContact CB-CE1 3.99Å; T195-Y284 HydrophobicContact CG2-CE1 4.09Å; T195-Y284 HydrophobicContact CG2-CE2 4.26Å; V271-Y284 CarbonylContact C-O 3.46Å; V271-Y284 WeakPolarHBondContact CA-O 3.26Å; V271-Y284 WeakPolarHBondContact CG1-O 3.47Å; S272-Y284 PolarHBondContact N-O 3.34Å; S272-Y284 PolarHBondContact O-N 3.47Å; Y274-Y284 HydrophobicContact CD1-CD2 4.44Å; Y274-Y284 HydrophobicContact CD1-CE2 4.31Å; Y274-Y284 HydrophobicContact CD2-CD1 4.48Å; Y274-Y284 HydrophobicContact CD2-CD2 4.39Å; Y274-Y284 HydrophobicContact CD2-CG 4.17Å; Y274-Y284 AromaticContact CG-CD2 3.86Å; Y274-Y284 HydrophobicContact CG-CD2 3.86Å; Y274-Y284 HydrophobicContact CG-CE2 4.19Å; Y274-Y284 HydrophobicContact CG-CG 4.11Å
285	S	93.5	Very high	84.2	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.014	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	149.8	175.6	36.6	0	0	0	0	112.8	W196 V270 D305	W196-S285 PolarHBondContact NE1-OG 3.12Å; V270-S285 WeakPolarHBondContact O-CA 3.35Å; S285-D305 WeakPolarHBondContact CB-OD2 3.41Å; S285-D305 PolarHBondContact O-N 2.86Å; S285-D305 VanDerWaalsContact O-N 3.11Å; S285-D305 PolarHBondContact OG-OD2 2.78Å
286	G	93.1	Very high	84.5	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.8	-174.2	178.8	0	0	0	0	0	112.5	R269 V270 F303	R269-G286 WeakPolarHBondContact CA-O 3.48Å; V270-G286 PolarHBondContact N-O 2.96Å; V270-G286 PolarHBondContact O-N 2.74Å; G286-F303 CarbonylContact C-O 3.59Å; G286-F303 VanDerWaalsContact CA-O 3.27Å; G286-F303 WeakPolarHBondContact CA-O 3.28Å
287	L	94.7	Very high	85.4	Confident	3 Å²	3	54 Å²	54	2%	0.016	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	136.4	-176.2	-77.5	162.4	0	0	0	111.6	G267 R269 A289 L302 F303 N327 W328 I339	G267-L287 VanDerWaalsContact O-CD2 3.27Å; G267-L287 WeakPolarHBondContact O-CD2 3.36Å; R269-L287 HydrophobicContact CB-CD2 4.03Å; R269-L287 HydrophobicContact CG-CD2 4.15Å; L287-A289 PolarHBondContact O-N 3.28Å; L287-L302 WeakPolarHBondContact O-CA 3.43Å; L287-F303 PolarHBondContact N-O 2.91Å; L287-F303 PolarHBondContact O-N 2.96Å; L287-N327 HydrophobicContact CD2-CB 3.65Å; L287-W328 HydrophobicContact CD1-CB 4.44Å; L287-I339 HydrophobicContact CD1-CD1 4.47Å; L287-I339 HydrophobicContact CD1-CG2 3.64Å
288	I	96.1	Very high	86.6	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	115.7	170.3	-58.2	-50.1	0	0	0	109	V266 G267 A268 V270 Y300 L302 V317	V266-I288 CarbonylContact C-O 3.31Å; V266-I288 WeakPolarHBondContact CA-O 3.45Å; G267-I288 PolarHBondContact N-O 2.87Å; A268-I288 HydrophobicContact CB-CG1 4.3Å; A268-I288 PolarHBondContact O-N 3.07Å; V270-I288 HydrophobicContact CB-CD1 4.47Å; V270-I288 HydrophobicContact CG1-CD1 4.06Å; V270-I288 HydrophobicContact CG1-CG1 4.08Å; V270-I288 HydrophobicContact CG2-CD1 3.59Å; V270-I288 HydrophobicContact CG2-CG1 4.2Å; I288-Y300 HydrophobicContact CD1-CD1 3.55Å; I288-Y300 HydrophobicContact CD1-CE1 4.18Å; I288-Y300 HydrophobicContact CD1-CG 3.99Å; I288-Y300 HydrophobicContact CG1-CD1 4.11Å; I288-Y300 HydrophobicContact CG1-CE1 4.41Å; I288-Y300 HydrophobicContact CG2-CD1 3.84Å; I288-Y300 HydrophobicContact CG2-CE1 4.36Å; I288-L302 HydrophobicContact CD1-CD1 4.35Å; I288-L302 HydrophobicContact CD1-CG 4.14Å; I288-V317 HydrophobicContact CD1-CG1 4.26Å
289	A	95	Very high	88.1	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.008	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-31.2	173.7	0	0	0	0	0	112	V266 L287 L301 F303 Y342	V266-A289 WeakPolarHBondContact CG2-O 3.48Å; L287-A289 PolarHBondContact O-N 3.28Å; A289-L301 HydrophobicContact CB-CB 4.29Å; A289-L301 HydrophobicContact CB-CD2 4.01Å; A289-L301 HydrophobicContact CB-CG 4.01Å; A289-L301 PolarHBondContact N-O 2.86Å; A289-F303 HydrophobicContact CB-CD1 3.93Å; A289-F303 HydrophobicContact CB-CD2 3.75Å; A289-F303 HydrophobicContact CB-CE1 3.74Å; A289-F303 HydrophobicContact CB-CE2 3.54Å; A289-F303 HydrophobicContact CB-CG 3.95Å; A289-F303 HydrophobicContact CB-CZ 3.55Å; A289-Y342 HydrophobicContact CB-CE1 3.94Å; A289-Y342 WeakPolarHBondContact O-CE1 3.41Å; A289-Y342 PolarHBondContact O-OH 3.17Å
290	E	93.9	Very high	89.9	Confident	4 Å²	4	44.5 Å²	44.5	2%	0.019	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	130.3	178.8	-162.7	178.7	89.6	0	0	109.5	N296 Y300 L301 Y311 R349 S379	E290-N296 VanDerWaalsContact OE1-CB 3.31Å; E290-N296 WeakPolarHBondContact OE1-CB 3.22Å; E290-N296 PolarHBondContact OE1-ND2 3.31Å; E290-Y300 CarbonylContact O-C 3.52Å; E290-Y300 WeakPolarHBondContact O-CA 3.23Å; E290-L301 HydrophobicContact CB-CB 3.5Å; E290-L301 VanDerWaalsContact CB-CB 3.5Å; E290-L301 HydrophobicContact CB-CD2 4.3Å; E290-L301 PolarHBondContact N-O 2.86Å; E290-L301 PolarHBondContact O-N 2.8Å; E290-Y311 WeakPolarHBondContact OE1-CE1 3.23Å; E290-Y311 PolarHBondContact OE1-OH 2.76Å; E290-R349 IonicContact OE2-CZ 2.71Å; E290-R349 IonicContact OE2-NH1 2.71Å; E290-R349 PolarHBondContact OE2-NH1 3.27Å; E290-R349 IonicContact OE2-NH2 2.8Å; E290-R349 PolarHBondContact OE2-NH2 3.43Å; E290-S379 PolarHBondContact OE2-OG 3.33Å
291	P	93.2	Very high	91.5	Very high	38 Å²	38	43.2 Å²	43.2	25%	0.247	21%	0.211	C	C	.	.			trans	-80	167.5	176.5	34.5	-35.1	0	0	0	111.6	S293 N296	P291-S293 PolarHBondContact O-N 2.78Å; P291-N296 PolarHBondContact O-ND2 3.16Å
292	P	91.7	Very high	92.2	Very high	15 Å²	15	37.2 Å²	37.2	10%	0.097	18%	0.18	C	C	.	.			trans	-56.5	125	176.9	-27.8	37.3	0	0	0	112.4	Q298 Y300 P314	P292-Q298 HydrophobicContact CB-CB 4.43Å; P292-Y300 VanDerWaalsContact CD-CE1 3.47Å; P292-Y300 HydrophobicContact CG-CD1 4.25Å; P292-Y300 HydrophobicContact CG-CD2 3.91Å; P292-Y300 HydrophobicContact CG-CE1 4.1Å; P292-Y300 HydrophobicContact CG-CE2 3.73Å; P292-Y300 HydrophobicContact CG-CG 4.18Å; P292-P314 HydrophobicContact CG-CG 4.18Å
293	S	88.1	Confident	92.7	Very high	39 Å²	39	36.4 Å²	36.4	27%	0.273	17%	0.171	S	C	.	.			trans	-145	163.6	177.3	70.5	0	0	0	0	110.4	P291 R295 N296 N297 Q298	P291-S293 PolarHBondContact O-N 2.78Å; S293-R295 VanDerWaalsContact C-N 3.3Å; S293-R295 PolarHBondContact O-N 3.1Å; S293-N296 PolarHBondContact N-ND2 3.05Å; S293-N296 PolarHBondContact N-OD1 3.23Å; S293-N296 PolarHBondContact O-N 2.76Å; S293-N296 PolarHBondContact O-OD1 2.87Å; S293-N296 VanDerWaalsContact OG-CG 3.24Å; S293-N296 PolarHBondContact OG-N 2.8Å; S293-N296 PolarHBondContact OG-ND2 3.45Å; S293-N297 PolarHBondContact O-N 2.93Å; S293-Q298 PolarHBondContact O-N 3.5Å
294	E	84.7	Confident	92.8	Very high	170 Å²	170	33.1 Å²	33.1	79%	0.794	16%	0.158	S	C	*	.	G	3₁₀ helix	trans	-62.3	-40.7	176.7	-66.5	173.4	179.3	0	0	111.3	N296 N297	E294-N296 PolarHBondContact O-N 3.45Å; E294-N297 PolarHBondContact O-N 2.72Å
295	R	86.7	Confident	92.8	Very high	119 Å²	119	30.3 Å²	30.3	45%	0.449	15%	0.147	S	C	.	.	G	3₁₀ helix	trans	-54.3	-28.6	176.2	-170.4	178.4	-172.3	-176.7	5.3	113.4	S293 A378	S293-R295 VanDerWaalsContact C-N 3.3Å; S293-R295 PolarHBondContact O-N 3.1Å; R295-A378 WeakPolarHBondContact O-CB 3.35Å
296	N	91.8	Very high	92.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-108.8	12.7	178.9	67	39.6	0	0	0	115	E290 P291 S293 E294 Q298 R299 Y311 A378	E290-N296 VanDerWaalsContact OE1-CB 3.31Å; E290-N296 WeakPolarHBondContact OE1-CB 3.22Å; E290-N296 PolarHBondContact OE1-ND2 3.31Å; P291-N296 PolarHBondContact O-ND2 3.16Å; S293-N296 PolarHBondContact N-ND2 3.05Å; S293-N296 PolarHBondContact N-OD1 3.23Å; S293-N296 PolarHBondContact O-N 2.76Å; S293-N296 PolarHBondContact O-OD1 2.87Å; S293-N296 VanDerWaalsContact OG-CG 3.24Å; S293-N296 PolarHBondContact OG-N 2.8Å; S293-N296 PolarHBondContact OG-ND2 3.45Å; E294-N296 PolarHBondContact O-N 3.45Å; N296-Q298 VanDerWaalsContact C-N 3.33Å; N296-Q298 PolarHBondContact OD1-N 3.21Å; N296-R299 PolarHBondContact ND2-O 3.11Å; N296-R299 VanDerWaalsContact O-CZ 3.27Å; N296-R299 PolarHBondContact O-NE 2.93Å; N296-R299 PolarHBondContact O-NH2 3.31Å; N296-R299 PolarHBondContact OD1-N 3.03Å; N296-R299 PolarHBondContact OD1-O 3.28Å; N296-Y311 HydrophobicContact CB-CD1 4.22Å; N296-Y311 HydrophobicContact CB-CE1 3.45Å; N296-Y311 VanDerWaalsContact CB-CE1 3.45Å; N296-A378 HydrophobicContact CB-CB 3.97Å
297	N	91.3	Very high	92	Very high	96 Å²	96	35.1 Å²	35.1	51%	0.513	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	41.8	-176.4	-44.9	-54.6	0	0	0	112.5	S293 E294 R299	S293-N297 PolarHBondContact O-N 2.93Å; E294-N297 PolarHBondContact O-N 2.72Å; N297-R299 VanDerWaalsContact C-N 3.33Å; N297-R299 PolarHBondContact ND2-NH2 3.23Å; N297-R299 PolarHBondContact O-N 3.09Å
298	Q	91.7	Very high	91.7	Very high	86 Å²	86	37.1 Å²	37.1	40%	0.402	19%	0.189	S	C	.	.	S	Bend	trans	57.2	36.3	177.7	-55.6	-66.9	-14.3	0	0	114.6	P292 S293 N296 P314	P292-Q298 HydrophobicContact CB-CB 4.43Å; S293-Q298 PolarHBondContact O-N 3.5Å; N296-Q298 VanDerWaalsContact C-N 3.33Å; N296-Q298 PolarHBondContact OD1-N 3.21Å; Q298-P314 WeakPolarHBondContact O-CD 3.39Å; Q298-P314 WeakPolarHBondContact O-CG 3.34Å
299	R	95.6	Very high	91.5	Very high	46 Å²	46	37.7 Å²	37.7	17%	0.174	19%	0.192	C	C	.	.			trans	-109.7	148.5	177.2	-66.5	168.6	-60.8	167.9	1.5	110.9	N296 N297 Y311 P313 D377	N296-R299 PolarHBondContact ND2-O 3.11Å; N296-R299 VanDerWaalsContact O-CZ 3.27Å; N296-R299 PolarHBondContact O-NE 2.93Å; N296-R299 PolarHBondContact O-NH2 3.31Å; N296-R299 PolarHBondContact OD1-N 3.03Å; N296-R299 PolarHBondContact OD1-O 3.28Å; N297-R299 VanDerWaalsContact C-N 3.33Å; N297-R299 PolarHBondContact ND2-NH2 3.23Å; N297-R299 PolarHBondContact O-N 3.09Å; R299-Y311 HydrophobicContact CB-CD1 3.8Å; R299-Y311 HydrophobicContact CB-CG 4.3Å; R299-P313 HydrophobicContact CG-CB 4.48Å; R299-D377 IonicContact CZ-OD1 2.59Å; R299-D377 IonicContact CZ-OD2 3.2Å; R299-D377 IonicContact NH1-OD1 2.92Å; R299-D377 IonicContact NH1-OD2 2.76Å; R299-D377 PolarHBondContact NH1-OD2 3.24Å; R299-D377 VanDerWaalsContact NH1-OD2 3.08Å; R299-D377 IonicContact NH2-OD1 3.37Å; R299-D377 PolarHBondContact NH2-OD1 3.49Å; R299-D377 IonicContact NH2-OD2 2.72Å
300	Y	96.3	Very high	91.4	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	133.3	165.3	-71.5	-85.7	0	0	0	109.5	A257 Q262 K263 Y264 I288 E290 P292 Y311 S312 P314 V317	A257-Y300 HydrophobicContact CB-CE2 4.09Å; Q262-Y300 PolarHBondContact O-OH 2.82Å; K263-Y300 WeakPolarHBondContact CA-OH 3.49Å; Y264-Y300 HydrophobicContact CD2-CE1 4.5Å; Y264-Y300 PolarHBondContact N-OH 3.01Å; I288-Y300 HydrophobicContact CD1-CD1 3.55Å; I288-Y300 HydrophobicContact CD1-CE1 4.18Å; I288-Y300 HydrophobicContact CD1-CG 3.99Å; I288-Y300 HydrophobicContact CG1-CD1 4.11Å; I288-Y300 HydrophobicContact CG1-CE1 4.41Å; I288-Y300 HydrophobicContact CG2-CD1 3.84Å; I288-Y300 HydrophobicContact CG2-CE1 4.36Å; E290-Y300 CarbonylContact O-C 3.52Å; E290-Y300 WeakPolarHBondContact O-CA 3.23Å; P292-Y300 VanDerWaalsContact CD-CE1 3.47Å; P292-Y300 HydrophobicContact CG-CD1 4.25Å; P292-Y300 HydrophobicContact CG-CD2 3.91Å; P292-Y300 HydrophobicContact CG-CE1 4.1Å; P292-Y300 HydrophobicContact CG-CE2 3.73Å; P292-Y300 HydrophobicContact CG-CG 4.18Å; Y300-Y311 CarbonylContact O-C 3.33Å; Y300-Y311 VanDerWaalsContact O-CA 3.28Å; Y300-Y311 WeakPolarHBondContact O-CA 3.39Å; Y300-S312 PolarHBondContact N-O 3.3Å; Y300-S312 PolarHBondContact O-N 2.94Å; Y300-P314 HydrophobicContact CD2-CB 4.45Å; Y300-P314 HydrophobicContact CD2-CG 4.3Å; Y300-P314 HydrophobicContact CE2-CB 3.98Å; Y300-P314 HydrophobicContact CE2-CG 4.1Å; Y300-V317 HydrophobicContact CD2-CB 4.25Å; Y300-V317 HydrophobicContact CD2-CG1 4.39Å; Y300-V317 HydrophobicContact CD2-CG2 3.85Å; Y300-V317 HydrophobicContact CE2-CB 4.46Å; Y300-V317 HydrophobicContact CE2-CG1 4.48Å; Y300-V317 HydrophobicContact CG-CG2 4.31Å
301	L	96.4	Very high	91.5	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	126.9	159.9	-176.7	62.1	0	0	0	108.1	A289 E290 F303 Y311 L380 Y394	A289-L301 HydrophobicContact CB-CB 4.29Å; A289-L301 HydrophobicContact CB-CD2 4.01Å; A289-L301 HydrophobicContact CB-CG 4.01Å; A289-L301 PolarHBondContact N-O 2.86Å; E290-L301 HydrophobicContact CB-CB 3.5Å; E290-L301 VanDerWaalsContact CB-CB 3.5Å; E290-L301 HydrophobicContact CB-CD2 4.3Å; E290-L301 PolarHBondContact N-O 2.86Å; E290-L301 PolarHBondContact O-N 2.8Å; L301-F303 HydrophobicContact CD2-CE1 4.01Å; L301-F303 HydrophobicContact CG-CE1 4.31Å; L301-Y311 HydrophobicContact CB-CD1 3.97Å; L301-Y311 HydrophobicContact CB-CE1 3.58Å; L301-Y311 HydrophobicContact CD1-CD1 4.28Å; L301-Y311 HydrophobicContact CD1-CD2 4.23Å; L301-Y311 HydrophobicContact CD1-CE1 4.2Å; L301-Y311 HydrophobicContact CD1-CE2 4.14Å; L301-Y311 HydrophobicContact CD1-CG 4.29Å; L301-Y311 HydrophobicContact CG-CE1 4.39Å; L301-L380 HydrophobicContact CD1-CD1 3.89Å; L301-L380 HydrophobicContact CD1-CD2 3.73Å; L301-L380 HydrophobicContact CD1-CG 3.82Å; L301-Y394 HydrophobicContact CD2-CD2 4.13Å; L301-Y394 HydrophobicContact CD2-CE2 4.49Å
302	L	95.4	Very high	91.5	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	142.4	171.7	-72.6	85.2	0	0	0	110.8	V270 L287 I288 F304 T309 Q310 V317	V270-L302 HydrophobicContact CG2-CD2 3.6Å; V270-L302 HydrophobicContact CG2-CG 4.36Å; L287-L302 WeakPolarHBondContact O-CA 3.43Å; I288-L302 HydrophobicContact CD1-CD1 4.35Å; I288-L302 HydrophobicContact CD1-CG 4.14Å; L302-F304 HydrophobicContact CD2-CE1 4.45Å; L302-T309 WeakPolarHBondContact O-CA 3.28Å; L302-Q310 PolarHBondContact N-O 2.95Å; L302-Q310 PolarHBondContact O-N 2.75Å; L302-V317 HydrophobicContact CD1-CG2 4.18Å
303	F	94.7	Very high	91.7	Very high	6 Å²	6	37.5 Å²	37.5	3%	0.026	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	112.5	154.7	-57.5	-26	0	0	0	106.6	G286 L287 A289 L301 T309 F338 I339 Y342 Y394	G286-F303 CarbonylContact C-O 3.59Å; G286-F303 VanDerWaalsContact CA-O 3.27Å; G286-F303 WeakPolarHBondContact CA-O 3.28Å; L287-F303 PolarHBondContact N-O 2.91Å; L287-F303 PolarHBondContact O-N 2.96Å; A289-F303 HydrophobicContact CB-CD1 3.93Å; A289-F303 HydrophobicContact CB-CD2 3.75Å; A289-F303 HydrophobicContact CB-CE1 3.74Å; A289-F303 HydrophobicContact CB-CE2 3.54Å; A289-F303 HydrophobicContact CB-CG 3.95Å; A289-F303 HydrophobicContact CB-CZ 3.55Å; L301-F303 HydrophobicContact CD2-CE1 4.01Å; L301-F303 HydrophobicContact CG-CE1 4.31Å; F303-T309 HydrophobicContact CD1-CG2 3.59Å; F303-T309 HydrophobicContact CE1-CG2 3.97Å; F303-F338 AromaticContact CD2-CE1 3.99Å; F303-F338 HydrophobicContact CD2-CE1 3.99Å; F303-F338 AromaticContact CE2-CE1 3.62Å; F303-F338 HydrophobicContact CE2-CE1 3.62Å; F303-F338 HydrophobicContact CE2-CZ 4.1Å; F303-F338 AromaticContact CZ-CE1 3.93Å; F303-F338 HydrophobicContact CZ-CE1 3.93Å; F303-F338 HydrophobicContact CZ-CZ 4.11Å; F303-I339 HydrophobicContact CD2-CG1 4.29Å; F303-Y342 AromaticContact CE2-CD1 3.87Å; F303-Y342 HydrophobicContact CE2-CD1 3.87Å; F303-Y342 AromaticContact CE2-CD2 3.97Å; F303-Y342 HydrophobicContact CE2-CD2 3.97Å; F303-Y342 HydrophobicContact CE2-CE1 4.07Å; F303-Y342 HydrophobicContact CE2-CE2 4.16Å; F303-Y342 AromaticContact CE2-CG 3.82Å; F303-Y342 HydrophobicContact CE2-CG 3.82Å; F303-Y342 HydrophobicContact CZ-CD2 4.21Å; F303-Y342 HydrophobicContact CZ-CE2 4.08Å; F303-Y394 HydrophobicContact CE1-CD2 4.4Å; F303-Y394 HydrophobicContact CE1-CG 4.13Å; F303-Y394 HydrophobicContact CZ-CD1 4.12Å; F303-Y394 HydrophobicContact CZ-CD2 4.38Å; F303-Y394 HydrophobicContact CZ-CE1 4.39Å; F303-Y394 HydrophobicContact CZ-CG 4.13Å
304	F	93.2	Very high	92	Very high	1 Å²	1	36.3 Å²	36.3	0%	0.004	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	162.4	175.3	-74.8	-78.4	0	0	0	110.8	Y274 L302 D306 G307 Y308 Q310	Y274-F304 HydrophobicContact CD2-CB 4.5Å; Y274-F304 HydrophobicContact CD2-CD1 4.01Å; Y274-F304 AromaticContact CD2-CD2 3.83Å; Y274-F304 HydrophobicContact CD2-CD2 3.83Å; Y274-F304 HydrophobicContact CD2-CE1 4.1Å; Y274-F304 AromaticContact CD2-CE2 3.9Å; Y274-F304 HydrophobicContact CD2-CE2 3.9Å; Y274-F304 AromaticContact CD2-CG 3.88Å; Y274-F304 HydrophobicContact CD2-CG 3.88Å; Y274-F304 HydrophobicContact CD2-CZ 4.04Å; Y274-F304 HydrophobicContact CE2-CD2 4.23Å; Y274-F304 HydrophobicContact CE2-CG 4.3Å; L302-F304 HydrophobicContact CD2-CE1 4.45Å; F304-D306 WeakPolarHBondContact CB-OD1 3.46Å; F304-D306 PolarHBondContact O-N 3.21Å; F304-D306 VanDerWaalsContact O-N 3.16Å; F304-G307 PolarHBondContact O-N 2.76Å; F304-Y308 AromaticContact CD2-CD1 3.78Å; F304-Y308 HydrophobicContact CD2-CD1 3.78Å; F304-Y308 HydrophobicContact CE2-CD1 4.09Å; F304-Y308 PolarHBondContact N-O 2.81Å; F304-Q310 HydrophobicContact CE2-CB 3.77Å
305	D	91.2	Very high	92.4	Very high	9 Å²	9	29.3 Å²	29.3	5%	0.048	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-24.1	-175.9	-71.5	-28.1	0	0	0	113.7	R269 S285 T332	R269-D305 IonicContact CZ-OD1 2.72Å; R269-D305 IonicContact CZ-OD2 3.72Å; R269-D305 IonicContact NH1-OD1 2.98Å; R269-D305 PolarHBondContact NH1-OD1 3.39Å; R269-D305 IonicContact NH1-OD2 3.67Å; R269-D305 IonicContact NH2-OD1 3.32Å; R269-D305 PolarHBondContact NH2-OD1 2.59Å; R269-D305 IonicContact NH2-OD2 3.6Å; R269-D305 PolarHBondContact NH2-OD2 3.27Å; S285-D305 WeakPolarHBondContact CB-OD2 3.41Å; S285-D305 PolarHBondContact O-N 2.86Å; S285-D305 VanDerWaalsContact O-N 3.11Å; S285-D305 PolarHBondContact OG-OD2 2.78Å; D305-T332 VanDerWaalsContact O-CB 3.27Å; D305-T332 WeakPolarHBondContact O-CB 3.37Å; D305-T332 VanDerWaalsContact O-CG2 3.24Å; D305-T332 WeakPolarHBondContact O-CG2 3.49Å; D305-T332 PolarHBondContact O-N 3.09Å; D305-T332 PolarHBondContact O-OG1 3.34Å
306	D	86.1	Confident	92.8	Very high	69 Å²	69	25 Å²	25	37%	0.369	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-9.3	175.2	62	-6.3	0	0	0	114.3	Y274 F304 Y308	Y274-D306 WeakPolarHBondContact CE2-OD2 3.44Å; Y274-D306 PolarHBondContact OH-OD2 3.48Å; Y274-D306 VanDerWaalsContact OH-OD2 3.14Å; F304-D306 WeakPolarHBondContact CB-OD1 3.46Å; F304-D306 PolarHBondContact O-N 3.21Å; F304-D306 VanDerWaalsContact O-N 3.16Å; D306-Y308 VanDerWaalsContact OD1-CB 3.31Å; D306-Y308 WeakPolarHBondContact OD1-CB 3.47Å; D306-Y308 PolarHBondContact OD1-N 3.1Å
307	G	84.5	Confident	93	Very high	34 Å²	34	25 Å²	25	35%	0.351	13%	0.131	S	C	.	.	S	Bend	trans	96.5	-4.4	-175.1	0	0	0	0	0	114.7	F304 T309 S335	F304-G307 PolarHBondContact O-N 2.76Å; G307-T309 WeakPolarHBondContact O-CG2 3.3Å; G307-S335 VanDerWaalsContact CA-OG 3.3Å; G307-S335 WeakPolarHBondContact CA-OG 3.37Å; G307-S335 PolarHBondContact N-OG 2.8Å
308	Y	88	Confident	93.2	Very high	46 Å²	46	21.5 Å²	21.5	18%	0.18	11%	0.111	C	C	.	.			trans	-65.7	146.5	175.8	-176.8	-120.7	0	0	0	111.3	Y274 F304 D306 Q310	Y274-Y308 AromaticContact CD2-CD1 3.94Å; Y274-Y308 HydrophobicContact CD2-CD1 3.94Å; Y274-Y308 AromaticContact CE2-CD1 3.4Å; Y274-Y308 HydrophobicContact CE2-CD1 3.4Å; Y274-Y308 VanDerWaalsContact CE2-CD1 3.4Å; Y274-Y308 HydrophobicContact CE2-CE1 4.21Å; Y274-Y308 AromaticContact CE2-CG 3.96Å; Y274-Y308 HydrophobicContact CE2-CG 3.96Å; Y274-Y308 AromaticContact CZ-CD1 3.79Å; F304-Y308 AromaticContact CD2-CD1 3.78Å; F304-Y308 HydrophobicContact CD2-CD1 3.78Å; F304-Y308 HydrophobicContact CE2-CD1 4.09Å; F304-Y308 PolarHBondContact N-O 2.81Å; D306-Y308 VanDerWaalsContact OD1-CB 3.31Å; D306-Y308 WeakPolarHBondContact OD1-CB 3.47Å; D306-Y308 PolarHBondContact OD1-N 3.1Å; Y308-Q310 HydrophobicContact CE1-CB 4.25Å
309	T	91.7	Very high	93.3	Very high	13 Å²	13	18.3 Å²	18.3	8%	0.08	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	123.8	-174.5	77.8	0	0	0	0	112.3	L302 F303 G307 L380 W392	L302-T309 WeakPolarHBondContact O-CA 3.28Å; F303-T309 HydrophobicContact CD1-CG2 3.59Å; F303-T309 HydrophobicContact CE1-CG2 3.97Å; G307-T309 WeakPolarHBondContact O-CG2 3.3Å; T309-L380 VanDerWaalsContact OG1-CD2 3.28Å; T309-L380 WeakPolarHBondContact OG1-CD2 3.49Å; T309-W392 PolarHBondContact OG1-O 2.81Å
310	Q	92.7	Very high	93.3	Very high	21 Å²	21	16.3 Å²	16.3	10%	0.098	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	144.1	-174.2	-167.6	-177.4	-96.5	0	0	111.2	I273 L302 F304 Y308 S312	I273-Q310 PolarHBondContact O-NE2 3.21Å; L302-Q310 PolarHBondContact N-O 2.95Å; L302-Q310 PolarHBondContact O-N 2.75Å; F304-Q310 HydrophobicContact CE2-CB 3.77Å; Y308-Q310 HydrophobicContact CE1-CB 4.25Å; Q310-S312 PolarHBondContact NE2-OG 2.87Å
311	Y	95.8	Very high	93	Very high	20 Å²	20	16.3 Å²	16.3	8%	0.078	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	104.1	163.8	-86.7	-66.9	0	0	0	110.7	E290 N296 R299 Y300 L301 D377 A378 S379 L380	E290-Y311 WeakPolarHBondContact OE1-CE1 3.23Å; E290-Y311 PolarHBondContact OE1-OH 2.76Å; N296-Y311 HydrophobicContact CB-CD1 4.22Å; N296-Y311 HydrophobicContact CB-CE1 3.45Å; N296-Y311 VanDerWaalsContact CB-CE1 3.45Å; R299-Y311 HydrophobicContact CB-CD1 3.8Å; R299-Y311 HydrophobicContact CB-CG 4.3Å; Y300-Y311 CarbonylContact O-C 3.33Å; Y300-Y311 VanDerWaalsContact O-CA 3.28Å; Y300-Y311 WeakPolarHBondContact O-CA 3.39Å; L301-Y311 HydrophobicContact CB-CD1 3.97Å; L301-Y311 HydrophobicContact CB-CE1 3.58Å; L301-Y311 HydrophobicContact CD1-CD1 4.28Å; L301-Y311 HydrophobicContact CD1-CD2 4.23Å; L301-Y311 HydrophobicContact CD1-CE1 4.2Å; L301-Y311 HydrophobicContact CD1-CE2 4.14Å; L301-Y311 HydrophobicContact CD1-CG 4.29Å; L301-Y311 HydrophobicContact CG-CE1 4.39Å; Y311-D377 WeakPolarHBondContact CE2-O 3.4Å; Y311-A378 HydrophobicContact CE2-CB 3.88Å; Y311-A378 VanDerWaalsContact OH-CB 3.27Å; Y311-A378 WeakPolarHBondContact OH-CB 3.36Å; Y311-S379 VanDerWaalsContact OH-CB 3.28Å; Y311-S379 WeakPolarHBondContact OH-CB 3.34Å; Y311-S379 PolarHBondContact OH-N 2.86Å; Y311-S379 VanDerWaalsContact OH-N 3.1Å; Y311-S379 PolarHBondContact OH-OG 3.34Å; Y311-L380 HydrophobicContact CD2-CD1 3.7Å; Y311-L380 HydrophobicContact CD2-CG 3.91Å; Y311-L380 HydrophobicContact CE2-CB 4.32Å; Y311-L380 HydrophobicContact CE2-CD1 4.11Å; Y311-L380 HydrophobicContact CE2-CG 3.78Å
312	S	94.9	Very high	92.7	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	136.1	175	-60.6	0	0	0	0	111.4	S272 Y300 Q310	S272-S312 VanDerWaalsContact OG-CB 3.27Å; S272-S312 WeakPolarHBondContact OG-CB 3.26Å; S272-S312 PolarHBondContact OG-OG 3.12Å; Y300-S312 PolarHBondContact N-O 3.3Å; Y300-S312 PolarHBondContact O-N 2.94Å; Q310-S312 PolarHBondContact NE2-OG 2.87Å
313	P	94.8	Very high	92.4	Very high	12 Å²	12	18.5 Å²	18.5	8%	0.078	10%	0.098	C	C	.	.			trans	-72.4	158.7	174.3	32.4	-36.3	0	0	0	111.9	R299 N315 E316 N971	R299-P313 HydrophobicContact CG-CB 4.48Å; P313-N315 VanDerWaalsContact CB-OD1 3.26Å; P313-N315 WeakPolarHBondContact CB-OD1 3.33Å; P313-N315 WeakPolarHBondContact CG-OD1 3.49Å; P313-N315 PolarHBondContact O-N 3.16Å; P313-E316 HydrophobicContact CG-CB 4.18Å; P313-E316 HydrophobicContact CG-CG 3.83Å; P313-E316 WeakPolarHBondContact CG-OE1 3.3Å; P313-E316 PolarHBondContact O-N 2.77Å; P313-N971 VanDerWaalsContact CB-ND2 3.27Å; P313-N971 WeakPolarHBondContact CB-ND2 3.46Å; P313-N971 WeakPolarHBondContact CG-ND2 3.23Å
314	P	94.8	Very high	92.1	Very high	15 Å²	15	20.4 Å²	20.4	10%	0.097	11%	0.112	C	C	.	.	G	3₁₀ helix	trans	-62.5	-17.7	-173	-27	37.2	0	0	0	116.2	W167 A257 S258 P292 Q298 Y300 E316	W167-P314 HydrophobicContact CH2-CB 3.54Å; W167-P314 HydrophobicContact CH2-CG 4.18Å; W167-P314 HydrophobicContact CZ3-CB 4.11Å; A257-P314 HydrophobicContact CB-CB 4.44Å; A257-P314 VanDerWaalsContact CB-O 3.3Å; A257-P314 WeakPolarHBondContact CB-O 3.21Å; A257-P314 PolarHBondContact N-O 2.92Å; S258-P314 PolarHBondContact N-O 3.17Å; P292-P314 HydrophobicContact CG-CG 4.18Å; Q298-P314 WeakPolarHBondContact O-CD 3.39Å; Q298-P314 WeakPolarHBondContact O-CG 3.34Å; Y300-P314 HydrophobicContact CD2-CB 4.45Å; Y300-P314 HydrophobicContact CD2-CG 4.3Å; Y300-P314 HydrophobicContact CE2-CB 3.98Å; Y300-P314 HydrophobicContact CE2-CG 4.1Å; P314-E316 VanDerWaalsContact C-N 3.31Å
315	N	93.7	Very high	91.7	Very high	23 Å²	23	29 Å²	29	12%	0.123	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-83.9	-2.5	174.2	58	-18.2	0	0	0	113.7	S256 P313 N969	S256-N315 WeakPolarHBondContact CB-O 3.39Å; P313-N315 VanDerWaalsContact CB-OD1 3.26Å; P313-N315 WeakPolarHBondContact CB-OD1 3.33Å; P313-N315 WeakPolarHBondContact CG-OD1 3.49Å; P313-N315 PolarHBondContact O-N 3.16Å; N315-N969 WeakPolarHBondContact ND2-CB 3.29Å; N315-N969 VanDerWaalsContact ND2-CG 3.35Å; N315-N969 PolarHBondContact ND2-ND2 2.61Å
316	E	94	Very high	91.6	Very high	29 Å²	29	32.5 Å²	32.5	14%	0.136	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-119	19.4	178	-61.8	-178.9	-152.9	0	0	112.2	S272 I273 R275 P313 P314	S272-E316 WeakPolarHBondContact CA-O 3.42Å; S272-E316 WeakPolarHBondContact CB-O 3.37Å; S272-E316 PolarHBondContact OG-O 3.06Å; I273-E316 HydrophobicContact CB-CB 4.33Å; I273-E316 HydrophobicContact CD1-CB 4.17Å; I273-E316 HydrophobicContact CD1-CG 3.94Å; I273-E316 HydrophobicContact CG1-CB 4.13Å; I273-E316 HydrophobicContact CG1-CG 4.43Å; I273-E316 PolarHBondContact N-O 2.76Å; R275-E316 IonicContact CZ-OE2 3.91Å; R275-E316 IonicContact NE-OE2 2.96Å; R275-E316 IonicContact NH2-OE1 3.23Å; R275-E316 PolarHBondContact NH2-OE1 2.81Å; R275-E316 IonicContact NH2-OE2 2.84Å; R275-E316 PolarHBondContact NH2-OE2 2.84Å; P313-E316 HydrophobicContact CG-CB 4.18Å; P313-E316 HydrophobicContact CG-CG 3.83Å; P313-E316 WeakPolarHBondContact CG-OE1 3.3Å; P313-E316 PolarHBondContact O-N 2.77Å; P314-E316 VanDerWaalsContact C-N 3.31Å
317	V	96.2	Very high	91.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	128	-178	176.9	0	0	0	0	109.4	S256 A257 Y264 V270 I288 Y300 L302	S256-V317 CarbonylContact C-O 3.56Å; S256-V317 VanDerWaalsContact CA-O 3.23Å; S256-V317 WeakPolarHBondContact CA-O 3.18Å; A257-V317 HydrophobicContact CB-CB 4.5Å; A257-V317 PolarHBondContact N-O 3.44Å; Y264-V317 HydrophobicContact CD2-CG1 4.08Å; Y264-V317 HydrophobicContact CE2-CG1 4.2Å; V270-V317 HydrophobicContact CB-CG1 3.9Å; V270-V317 HydrophobicContact CG1-CG1 3.85Å; V270-V317 HydrophobicContact CG2-CG1 4.04Å; I288-V317 HydrophobicContact CD1-CG1 4.26Å; Y300-V317 HydrophobicContact CD2-CB 4.25Å; Y300-V317 HydrophobicContact CD2-CG1 4.39Å; Y300-V317 HydrophobicContact CD2-CG2 3.85Å; Y300-V317 HydrophobicContact CE2-CB 4.46Å; Y300-V317 HydrophobicContact CE2-CG1 4.48Å; Y300-V317 HydrophobicContact CG-CG2 4.31Å; L302-V317 HydrophobicContact CD1-CG2 4.18Å
318	Y	96.2	Very high	92.2	Very high	22 Å²	22	30 Å²	30	9%	0.086	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	140.5	-168.9	-57.3	-94.2	0	0	0	111.5	L188 V270 V271 Y283	L188-Y318 HydrophobicContact CD1-CD1 4.2Å; L188-Y318 HydrophobicContact CD1-CD2 4.06Å; L188-Y318 HydrophobicContact CD1-CG 3.85Å; V270-Y318 WeakPolarHBondContact CA-O 3.3Å; V270-Y318 WeakPolarHBondContact CB-O 3.43Å; V271-Y318 PolarHBondContact N-O 3.23Å; V271-Y318 PolarHBondContact O-N 3.06Å; Y283-Y318 HydrophobicContact CD1-CD2 4.47Å; Y283-Y318 HydrophobicContact CD1-CE2 4.11Å; Y283-Y318 HydrophobicContact CE1-CD2 4.4Å; Y283-Y318 AromaticContact CE1-CE2 3.66Å; Y283-Y318 HydrophobicContact CE1-CE2 3.66Å; Y283-Y318 AromaticContact CE1-CZ 3.97Å
319	R	94.3	Very high	92.4	Very high	18 Å²	18	32.7 Å²	32.7	7%	0.068	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	118.5	-175.8	177.4	171.7	173.1	178.5	-0.4	112.3	L170 E174 L179 A252 L253 L260 Y264	L170-R319 VanDerWaalsContact CD1-NH1 3.33Å; E174-R319 PolarHBondContact O-NH2 3.44Å; L179-R319 HydrophobicContact CD1-CG 4.15Å; A252-R319 CarbonylContact C-O 3.55Å; A252-R319 VanDerWaalsContact CA-O 3.22Å; A252-R319 WeakPolarHBondContact CA-O 3.38Å; A252-R319 VanDerWaalsContact CB-O 3.32Å; A252-R319 WeakPolarHBondContact CB-O 3.39Å; L253-R319 PolarHBondContact N-O 3.03Å; L260-R319 HydrophobicContact CD1-CB 4.48Å; Y264-R319 HydrophobicContact CE1-CB 4.29Å
320	I	94.2	Very high	92.2	Very high	4 Å²	4	35.2 Å²	35.2	2%	0.021	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	137.5	168	-61.9	171.4	0	0	0	109.4	W196 L251 A252 R269 V271 H322 Q323	W196-I320 HydrophobicContact CH2-CD1 4.03Å; W196-I320 HydrophobicContact CH2-CG1 3.96Å; W196-I320 HydrophobicContact CH2-CG2 4.22Å; W196-I320 HydrophobicContact CZ2-CD1 3.9Å; W196-I320 HydrophobicContact CZ2-CG1 4.28Å; L251-I320 WeakPolarHBondContact O-CG2 3.31Å; A252-I320 HydrophobicContact CB-CB 4.46Å; A252-I320 HydrophobicContact CB-CG1 4.05Å; R269-I320 HydrophobicContact CB-CD1 4.31Å; R269-I320 HydrophobicContact CG-CD1 3.93Å; V271-I320 HydrophobicContact CG2-CD1 4.03Å; V271-I320 HydrophobicContact CG2-CG1 3.67Å; I320-H322 WeakPolarHBondContact CG2-O 3.37Å; I320-Q323 PolarHBondContact O-NE2 3.22Å
321	C	91.4	Very high	91.9	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.007	16%	0.162	C	C	.	.	S	Bend	trans	-75.8	-23.7	-169.5	-64.9	0	0	0	0	114.2	G178 L179 L251	G178-C321 CarbonylContact C-O 3.44Å; G178-C321 VanDerWaalsContact C-O 3.31Å; G178-C321 WeakPolarHBondContact CA-O 3.48Å; L179-C321 HydrophobicContact CB-CB 4.07Å; L179-C321 PolarHBondContact N-O 3Å; L251-C321 HydrophobicContact CB-CB 4.41Å; L251-C321 WeakPolarHBondContact O-CB 3.38Å; L251-C321 PolarHBondContact O-N 3.5Å
322	H	89.2	Confident	91.5	Very high	37 Å²	37	35.6 Å²	35.6	17%	0.171	17%	0.171	C	C	.	.			trans	-112.8	150.6	168.2	173.3	96.9	0	0	0	110.3	E225 T248 I320	E225-H322 IonicContact OE1-CE1 3.08Å; T248-H322 PolarHBondContact O-N 2.94Å; I320-H322 WeakPolarHBondContact CG2-O 3.37Å
323	Q	89.7	Confident	91	Very high	9 Å²	9	43.9 Å²	43.9	4%	0.042	21%	0.21	C	C	.	.			trans	-142	137.1	179.3	-61.7	-78.4	-34.5	0	0	108.9	L175 L176 R269 I320 N327	L175-Q323 HydrophobicContact CB-CB 4.37Å; L175-Q323 HydrophobicContact CB-CG 4.01Å; L175-Q323 HydrophobicContact CD2-CG 4.33Å; L175-Q323 WeakPolarHBondContact O-CB 3.44Å; L175-Q323 WeakPolarHBondContact O-CG 3.19Å; L176-Q323 WeakPolarHBondContact CD2-O 3.37Å; R269-Q323 PolarHBondContact O-NE2 2.98Å; I320-Q323 PolarHBondContact O-NE2 3.22Å; Q323-N327 PolarHBondContact OE1-ND2 3.45Å
324	S	87.7	Confident	90.3	Very high	46 Å²	46	48.2 Å²	48.2	32%	0.322	24%	0.241	S	C	.	.			trans	-107.2	152.7	176.5	177.4	0	0	0	0	111.4	E326 N327	S324-E326 PolarHBondContact O-N 2.82Å; S324-E326 PolarHBondContact OG-N 3.05Å; S324-E326 VanDerWaalsContact OG-N 3.1Å; S324-N327 PolarHBondContact N-OD1 3.08Å; S324-N327 PolarHBondContact O-N 3.35Å; S324-N327 PolarHBondContact O-ND2 3.43Å; S324-N327 PolarHBondContact O-OD1 3.32Å; S324-N327 VanDerWaalsContact O-OD1 3.11Å
325	K	84.4	Confident	89.9	Confident	181 Å²	181	48.1 Å²	48.1	79%	0.787	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-20.1	167.9	-67.7	-175.3	178.9	-177.9	0	112.6	L176	L176-K325 HydrophobicContact CD1-CG 3.86Å; L176-K325 HydrophobicContact CD2-CG 3.85Å
326	E	90.1	Very high	89.7	Confident	82 Å²	82	49.5 Å²	49.5	38%	0.383	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.6	42.3	-179.3	-61.7	-177.5	101.6	0	0	111	S324 W328 K329	S324-E326 PolarHBondContact O-N 2.82Å; S324-E326 PolarHBondContact OG-N 3.05Å; S324-E326 VanDerWaalsContact OG-N 3.1Å; E326-W328 HydrophobicContact CB-CZ2 4.47Å; E326-W328 PolarHBondContact O-N 3.11Å; E326-K329 HydrophobicContact CB-CD 3.86Å; E326-K329 HydrophobicContact CB-CG 4.12Å; E326-K329 VanDerWaalsContact CD-CE 3.41Å; E326-K329 WeakPolarHBondContact O-CB 3.48Å; E326-K329 PolarHBondContact O-N 3.23Å; E326-K329 WeakPolarHBondContact OE1-CE 3.28Å; E326-K329 IonicContact OE1-NZ 2.69Å; E326-K329 PolarHBondContact OE1-NZ 2.89Å; E326-K329 WeakPolarHBondContact OE2-CE 3.3Å; E326-K329 IonicContact OE2-NZ 3.77Å; E326-K329 PolarHBondContact OE2-NZ 2.91Å
327	N	91.1	Very high	89.4	Confident	10 Å²	10	51.5 Å²	51.5	5%	0.053	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-45.8	-23.5	175.5	-82	-21.7	0	0	0	114.9	G267 R269 L287 Q323 S324 K329	G267-N327 PolarHBondContact O-ND2 3.39Å; R269-N327 HydrophobicContact CB-CB 4.26Å; L287-N327 HydrophobicContact CD2-CB 3.65Å; Q323-N327 PolarHBondContact OE1-ND2 3.45Å; S324-N327 PolarHBondContact N-OD1 3.08Å; S324-N327 PolarHBondContact O-N 3.35Å; S324-N327 PolarHBondContact O-ND2 3.43Å; S324-N327 PolarHBondContact O-OD1 3.32Å; S324-N327 VanDerWaalsContact O-OD1 3.11Å; N327-K329 VanDerWaalsContact C-N 3.27Å; N327-K329 PolarHBondContact O-N 2.56Å
328	W	91.6	Very high	89	Confident	42 Å²	42	54.3 Å²	54.3	16%	0.159	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-66.7	-21.1	175.1	61.8	-96.7	0	0	0	114	L287 E326 E330 A331 Q336 I339 K340 L343	L287-W328 HydrophobicContact CD1-CB 4.44Å; E326-W328 HydrophobicContact CB-CZ2 4.47Å; E326-W328 PolarHBondContact O-N 3.11Å; W328-E330 VanDerWaalsContact C-N 3.27Å; W328-E330 PolarHBondContact O-N 2.99Å; W328-A331 PolarHBondContact O-N 3.32Å; W328-Q336 HydrophobicContact CE3-CB 4.04Å; W328-Q336 HydrophobicContact CZ3-CB 4.3Å; W328-Q336 WeakPolarHBondContact O-CG 3.48Å; W328-I339 HydrophobicContact CB-CB 4.38Å; W328-I339 HydrophobicContact CB-CG2 3.67Å; W328-K340 HydrophobicContact CD2-CB 4Å; W328-K340 HydrophobicContact CD2-CD 4.3Å; W328-K340 HydrophobicContact CD2-CG 4.28Å; W328-K340 HydrophobicContact CE3-CB 4.14Å; W328-K340 HydrophobicContact CE3-CD 4.12Å; W328-K340 HydrophobicContact CG-CB 4.29Å; W328-K340 HydrophobicContact CH2-CD 3.73Å; W328-K340 HydrophobicContact CZ2-CD 3.88Å; W328-K340 HydrophobicContact CZ2-CG 4.35Å; W328-K340 HydrophobicContact CZ3-CD 3.85Å; W328-L343 HydrophobicContact CB-CD1 4.28Å
329	K	91.4	Very high	88.8	Confident	101 Å²	101	53.4 Å²	53.4	44%	0.439	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-71.9	-15	178.5	-73	-178.3	174.3	172.5	0	114.5	E326 N327 Q336	E326-K329 HydrophobicContact CB-CD 3.86Å; E326-K329 HydrophobicContact CB-CG 4.12Å; E326-K329 VanDerWaalsContact CD-CE 3.41Å; E326-K329 WeakPolarHBondContact O-CB 3.48Å; E326-K329 PolarHBondContact O-N 3.23Å; E326-K329 WeakPolarHBondContact OE1-CE 3.28Å; E326-K329 IonicContact OE1-NZ 2.69Å; E326-K329 PolarHBondContact OE1-NZ 2.89Å; E326-K329 WeakPolarHBondContact OE2-CE 3.3Å; E326-K329 IonicContact OE2-NZ 3.77Å; E326-K329 PolarHBondContact OE2-NZ 2.91Å; N327-K329 VanDerWaalsContact C-N 3.27Å; N327-K329 PolarHBondContact O-N 2.56Å; K329-Q336 PolarHBondContact O-NE2 2.79Å
330	E	87.2	Confident	88.7	Confident	67 Å²	67	56.6 Å²	56.6	31%	0.313	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-88.7	-8.2	174.9	-74.7	-171.9	-115.3	0	0	113.5	R190 R269 W328	R190-E330 IonicContact CZ-OE2 2.61Å; R190-E330 IonicContact NH1-OE2 3.48Å; R190-E330 PolarHBondContact NH1-OE2 2.89Å; R190-E330 IonicContact NH2-OE2 3.24Å; R269-E330 WeakPolarHBondContact CD-OE1 3.38Å; R269-E330 IonicContact CZ-OE2 2.69Å; R269-E330 IonicContact NE-OE1 2.98Å; R269-E330 PolarHBondContact NE-OE1 2.76Å; R269-E330 IonicContact NE-OE2 3.37Å; R269-E330 PolarHBondContact NE-OE2 3.44Å; R269-E330 VanDerWaalsContact NH2-CB 3.27Å; R269-E330 IonicContact NH2-OE2 3.53Å; R269-E330 PolarHBondContact NH2-OE2 3.24Å; W328-E330 VanDerWaalsContact C-N 3.27Å; W328-E330 PolarHBondContact O-N 2.99Å
331	A	87.5	Confident	88.4	Confident	5 Å²	5	63 Å²	63	4%	0.041	30%	0.302	C	S	.	.	S	Bend	trans	-75.2	161.7	172	0	0	0	0	0	111.1	W328 Q336 I339	W328-A331 PolarHBondContact O-N 3.32Å; A331-Q336 HydrophobicContact CB-CG 4.44Å; A331-Q336 VanDerWaalsContact O-CG 3.32Å; A331-Q336 WeakPolarHBondContact O-CG 3.1Å; A331-Q336 PolarHBondContact O-NE2 3.16Å; A331-I339 HydrophobicContact CB-CD1 3.68Å
332	T	86.5	Confident	88.4	Confident	44 Å²	44	63.7 Å²	63.7	27%	0.27	31%	0.305	S	S	.	.			trans	-55	143.1	172.4	51	0	0	0	0	111.6	D305 S334 S335 Q336	D305-T332 VanDerWaalsContact O-CB 3.27Å; D305-T332 WeakPolarHBondContact O-CB 3.37Å; D305-T332 VanDerWaalsContact O-CG2 3.24Å; D305-T332 WeakPolarHBondContact O-CG2 3.49Å; D305-T332 PolarHBondContact O-N 3.09Å; D305-T332 PolarHBondContact O-OG1 3.34Å; T332-S334 PolarHBondContact O-N 3.15Å; T332-S334 PolarHBondContact OG1-OG 3.3Å; T332-S335 WeakPolarHBondContact O-CA 3.24Å; T332-S335 WeakPolarHBondContact O-CB 3.3Å; T332-S335 PolarHBondContact O-N 3.26Å; T332-S335 PolarHBondContact OG1-OG 2.98Å; T332-S335 VanDerWaalsContact OG1-OG 3.1Å; T332-Q336 WeakPolarHBondContact O-CG 3.3Å; T332-Q336 PolarHBondContact O-N 2.76Å
333	E	84.4	Confident	88.4	Confident	174 Å²	174	64.4 Å²	64.4	81%	0.813	31%	0.31	S	S	*	.	H	α-helix	trans	-54.1	-38.7	-173.1	-171.8	172.6	-170.4	0	0	113.3	S335 Q336	E333-S335 VanDerWaalsContact C-N 3.28Å; E333-S335 PolarHBondContact O-N 3.14Å; E333-Q336 PolarHBondContact O-N 3.2Å
334	S	81.8	Confident	88.4	Confident	103 Å²	103	68 Å²	68	72%	0.72	34%	0.342	S	S	*	.	H	α-helix	trans	-57.4	-36.1	172.2	45.5	0	0	0	0	113.7	T332	T332-S334 PolarHBondContact O-N 3.15Å; T332-S334 PolarHBondContact OG1-OG 3.3Å
335	S	84.7	Confident	88.2	Confident	13 Å²	13	70.3 Å²	70.3	9%	0.091	35%	0.347	C	S	.	.	H	α-helix	trans	-90.1	-26.6	-176.5	-59.4	0	0	0	0	113.3	G307 T332 E333 E337 F338 I339	G307-S335 VanDerWaalsContact CA-OG 3.3Å; G307-S335 WeakPolarHBondContact CA-OG 3.37Å; G307-S335 PolarHBondContact N-OG 2.8Å; T332-S335 WeakPolarHBondContact O-CA 3.24Å; T332-S335 WeakPolarHBondContact O-CB 3.3Å; T332-S335 PolarHBondContact O-N 3.26Å; T332-S335 PolarHBondContact OG1-OG 2.98Å; T332-S335 VanDerWaalsContact OG1-OG 3.1Å; E333-S335 VanDerWaalsContact C-N 3.28Å; E333-S335 PolarHBondContact O-N 3.14Å; S335-E337 PolarHBondContact O-N 3.38Å; S335-F338 PolarHBondContact O-N 3.27Å; S335-I339 WeakPolarHBondContact O-CG1 3.35Å; S335-I339 PolarHBondContact O-N 2.87Å
336	Q	90.4	Very high	88.2	Confident	51 Å²	51	64.5 Å²	64.5	24%	0.238	32%	0.321	C	S	.	.	H	α-helix	trans	-54.1	-49.8	-172.7	-67.8	-162.9	11.2	0	0	113.3	W328 K329 A331 T332 E333 F338 I339 K340	W328-Q336 HydrophobicContact CE3-CB 4.04Å; W328-Q336 HydrophobicContact CZ3-CB 4.3Å; W328-Q336 WeakPolarHBondContact O-CG 3.48Å; K329-Q336 PolarHBondContact O-NE2 2.79Å; A331-Q336 HydrophobicContact CB-CG 4.44Å; A331-Q336 VanDerWaalsContact O-CG 3.32Å; A331-Q336 WeakPolarHBondContact O-CG 3.1Å; A331-Q336 PolarHBondContact O-NE2 3.16Å; T332-Q336 WeakPolarHBondContact O-CG 3.3Å; T332-Q336 PolarHBondContact O-N 2.76Å; E333-Q336 PolarHBondContact O-N 3.2Å; Q336-F338 PolarHBondContact O-N 2.96Å; Q336-I339 PolarHBondContact O-N 3.01Å; Q336-K340 WeakPolarHBondContact O-CB 3.28Å; Q336-K340 PolarHBondContact O-N 3.16Å
337	E	86.7	Confident	87.9	Confident	72 Å²	72	62.7 Å²	62.7	34%	0.336	32%	0.316	S	S	.	.	H	α-helix	trans	-71.6	-30.8	-175.2	-179.2	63.1	-169.3	0	0	112.1	S335 K340 R341	S335-E337 PolarHBondContact O-N 3.38Å; E337-K340 WeakPolarHBondContact OE2-CD 3.5Å; E337-K340 IonicContact OE2-NZ 3.3Å; E337-K340 PolarHBondContact OE2-NZ 2.83Å; E337-R341 WeakPolarHBondContact O-CB 3.22Å; E337-R341 WeakPolarHBondContact O-CD 3.29Å; E337-R341 WeakPolarHBondContact O-CG 3.46Å; E337-R341 PolarHBondContact O-N 3.09Å; E337-R341 VanDerWaalsContact O-N 3.1Å; E337-R341 IonicContact OE1-CZ 2.8Å; E337-R341 IonicContact OE1-NE 3.75Å; E337-R341 PolarHBondContact OE1-NE 3.36Å; E337-R341 IonicContact OE1-NH2 2.99Å; E337-R341 PolarHBondContact OE1-NH2 2.92Å
338	F	89.2	Confident	87.4	Confident	59 Å²	59	68.9 Å²	68.9	26%	0.259	34%	0.344	S	S	.	.	H	α-helix	trans	-66.4	-50.9	170.2	168.8	-101.4	0	0	0	111.3	F303 S335 Q336 K340 R341 Y342 Y394	F303-F338 AromaticContact CD2-CE1 3.99Å; F303-F338 HydrophobicContact CD2-CE1 3.99Å; F303-F338 AromaticContact CE2-CE1 3.62Å; F303-F338 HydrophobicContact CE2-CE1 3.62Å; F303-F338 HydrophobicContact CE2-CZ 4.1Å; F303-F338 AromaticContact CZ-CE1 3.93Å; F303-F338 HydrophobicContact CZ-CE1 3.93Å; F303-F338 HydrophobicContact CZ-CZ 4.11Å; S335-F338 PolarHBondContact O-N 3.27Å; Q336-F338 PolarHBondContact O-N 2.96Å; F338-K340 VanDerWaalsContact C-N 3.35Å; F338-K340 PolarHBondContact O-N 3.09Å; F338-R341 PolarHBondContact O-N 3.28Å; F338-Y342 WeakPolarHBondContact O-CB 3.28Å; F338-Y342 PolarHBondContact O-N 3.17Å; F338-Y394 HydrophobicContact CE2-CD1 4.43Å; F338-Y394 AromaticContact CZ-CD1 3.74Å; F338-Y394 HydrophobicContact CZ-CD1 3.74Å; F338-Y394 HydrophobicContact CZ-CE1 4Å
339	I	91.1	Very high	87.1	Confident	2 Å²	2	67.1 Å²	67.1	1%	0.01	34%	0.338	C	S	.	.	H	α-helix	trans	-61	-44.8	-179.2	-66.8	168.8	0	0	0	110.5	L287 F303 W328 A331 S335 Q336 R341 Y342 L343	L287-I339 HydrophobicContact CD1-CD1 4.47Å; L287-I339 HydrophobicContact CD1-CG2 3.64Å; F303-I339 HydrophobicContact CD2-CG1 4.29Å; W328-I339 HydrophobicContact CB-CB 4.38Å; W328-I339 HydrophobicContact CB-CG2 3.67Å; A331-I339 HydrophobicContact CB-CD1 3.68Å; S335-I339 WeakPolarHBondContact O-CG1 3.35Å; S335-I339 PolarHBondContact O-N 2.87Å; Q336-I339 PolarHBondContact O-N 3.01Å; I339-R341 PolarHBondContact O-N 2.58Å; I339-Y342 WeakPolarHBondContact O-CB 3.24Å; I339-Y342 PolarHBondContact O-N 3.04Å; I339-L343 HydrophobicContact CG2-CD1 3.98Å; I339-L343 HydrophobicContact CG2-CG 4.37Å; I339-L343 VanDerWaalsContact O-CG 3.32Å; I339-L343 WeakPolarHBondContact O-CG 3.39Å; I339-L343 PolarHBondContact O-N 2.67Å
340	K	91.8	Very high	86.7	Confident	85 Å²	85	63.1 Å²	63.1	37%	0.37	32%	0.322	S	S	.	.	H	α-helix	trans	-60	-42.3	176.2	175.9	-178.2	160.8	-150.3	0	112.5	W328 Q336 E337 F338 A344	W328-K340 HydrophobicContact CD2-CB 4Å; W328-K340 HydrophobicContact CD2-CD 4.3Å; W328-K340 HydrophobicContact CD2-CG 4.28Å; W328-K340 HydrophobicContact CE3-CB 4.14Å; W328-K340 HydrophobicContact CE3-CD 4.12Å; W328-K340 HydrophobicContact CG-CB 4.29Å; W328-K340 HydrophobicContact CH2-CD 3.73Å; W328-K340 HydrophobicContact CZ2-CD 3.88Å; W328-K340 HydrophobicContact CZ2-CG 4.35Å; W328-K340 HydrophobicContact CZ3-CD 3.85Å; Q336-K340 WeakPolarHBondContact O-CB 3.28Å; Q336-K340 PolarHBondContact O-N 3.16Å; E337-K340 WeakPolarHBondContact OE2-CD 3.5Å; E337-K340 IonicContact OE2-NZ 3.3Å; E337-K340 PolarHBondContact OE2-NZ 2.83Å; F338-K340 VanDerWaalsContact C-N 3.35Å; F338-K340 PolarHBondContact O-N 3.09Å; K340-A344 WeakPolarHBondContact O-CB 3.29Å; K340-A344 PolarHBondContact O-N 3.05Å; K340-A344 VanDerWaalsContact O-N 3.09Å
341	R	88	Confident	86.8	Confident	139 Å²	139	60 Å²	60	53%	0.525	31%	0.307	S	S	.	.	H	α-helix	trans	-65.7	-43.4	173.2	-73.5	170	-170.2	179.1	7.4	111.9	E337 F338 I339 A344 Q345	E337-R341 WeakPolarHBondContact O-CB 3.22Å; E337-R341 WeakPolarHBondContact O-CD 3.29Å; E337-R341 WeakPolarHBondContact O-CG 3.46Å; E337-R341 PolarHBondContact O-N 3.09Å; E337-R341 VanDerWaalsContact O-N 3.1Å; E337-R341 IonicContact OE1-CZ 2.8Å; E337-R341 IonicContact OE1-NE 3.75Å; E337-R341 PolarHBondContact OE1-NE 3.36Å; E337-R341 IonicContact OE1-NH2 2.99Å; E337-R341 PolarHBondContact OE1-NH2 2.92Å; F338-R341 PolarHBondContact O-N 3.28Å; I339-R341 PolarHBondContact O-N 2.58Å; R341-A344 PolarHBondContact O-N 3.1Å; R341-Q345 WeakPolarHBondContact O-CG 3.19Å; R341-Q345 PolarHBondContact O-N 3.22Å
342	Y	91.4	Very high	86.9	Confident	15 Å²	15	59.7 Å²	59.7	6%	0.059	31%	0.305	C	S	.	.	H	α-helix	trans	-58.7	-49.8	176.9	-179.8	-91.3	0	0	0	111.7	V266 A289 F303 F338 I339 A344 Q345 Y346 R349 Y394	V266-Y342 HydrophobicContact CG1-CE1 4.07Å; A289-Y342 HydrophobicContact CB-CE1 3.94Å; A289-Y342 WeakPolarHBondContact O-CE1 3.41Å; A289-Y342 PolarHBondContact O-OH 3.17Å; F303-Y342 AromaticContact CE2-CD1 3.87Å; F303-Y342 HydrophobicContact CE2-CD1 3.87Å; F303-Y342 AromaticContact CE2-CD2 3.97Å; F303-Y342 HydrophobicContact CE2-CD2 3.97Å; F303-Y342 HydrophobicContact CE2-CE1 4.07Å; F303-Y342 HydrophobicContact CE2-CE2 4.16Å; F303-Y342 AromaticContact CE2-CG 3.82Å; F303-Y342 HydrophobicContact CE2-CG 3.82Å; F303-Y342 HydrophobicContact CZ-CD2 4.21Å; F303-Y342 HydrophobicContact CZ-CE2 4.08Å; F338-Y342 WeakPolarHBondContact O-CB 3.28Å; F338-Y342 PolarHBondContact O-N 3.17Å; I339-Y342 WeakPolarHBondContact O-CB 3.24Å; I339-Y342 PolarHBondContact O-N 3.04Å; Y342-A344 VanDerWaalsContact C-N 3.28Å; Y342-A344 PolarHBondContact O-N 2.99Å; Y342-Q345 PolarHBondContact O-N 2.95Å; Y342-Y346 HydrophobicContact CE1-CD2 4.18Å; Y342-Y346 PolarHBondContact O-N 2.63Å; Y342-R349 HydrophobicContact CE2-CG 4.17Å; Y342-R349 WeakPolarHBondContact OH-CD 3.23Å; Y342-R349 PolarHBondContact OH-NH1 3.04Å; Y342-Y394 HydrophobicContact CD2-CE1 4.24Å; Y342-Y394 HydrophobicContact CE2-CE1 4.15Å; Y342-Y394 HydrophobicContact CE2-CE2 4.43Å; Y342-Y394 AromaticContact CE2-CZ 3.77Å; Y342-Y394 WeakPolarHBondContact CE2-OH 3.41Å
343	L	90.3	Very high	87	Confident	52 Å²	52	62.8 Å²	62.8	27%	0.272	31%	0.312	S	S	.	.	H	α-helix	trans	-64.3	-31.1	178.3	-66.6	175.7	0	0	0	112.7	V266 W328 I339	V266-L343 HydrophobicContact CG1-CD2 3.78Å; W328-L343 HydrophobicContact CB-CD1 4.28Å; I339-L343 HydrophobicContact CG2-CD1 3.98Å; I339-L343 HydrophobicContact CG2-CG 4.37Å; I339-L343 VanDerWaalsContact O-CG 3.32Å; I339-L343 WeakPolarHBondContact O-CG 3.39Å; I339-L343 PolarHBondContact O-N 2.67Å
344	A	88.2	Confident	87.3	Confident	86 Å²	86	55.2 Å²	55.2	71%	0.711	28%	0.277	S	S	*	.	H	α-helix	trans	-78.4	-20.6	176	0	0	0	0	0	114.3	K340 R341 Y342	K340-A344 WeakPolarHBondContact O-CB 3.29Å; K340-A344 PolarHBondContact O-N 3.05Å; K340-A344 VanDerWaalsContact O-N 3.09Å; R341-A344 PolarHBondContact O-N 3.1Å; Y342-A344 VanDerWaalsContact C-N 3.28Å; Y342-A344 PolarHBondContact O-N 2.99Å
345	Q	84.7	Confident	87.7	Confident	93 Å²	93	57.6 Å²	57.6	44%	0.435	27%	0.274	S	S	.	.	H	α-helix	trans	-95.9	-26	177.9	-70	176.7	5.3	0	0	113.1	R341 Y342 Q348	R341-Q345 WeakPolarHBondContact O-CG 3.19Å; R341-Q345 PolarHBondContact O-N 3.22Å; Y342-Q345 PolarHBondContact O-N 2.95Å; Q345-Q348 CarbonylContact C-O 3.56Å; Q345-Q348 WeakPolarHBondContact O-CA 3.19Å; Q345-Q348 WeakPolarHBondContact O-CB 3.31Å; Q345-Q348 PolarHBondContact O-N 3.46Å
346	Y	84.4	Confident	88.1	Confident	60 Å²	60	61.2 Å²	61.2	24%	0.235	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	133.7	179.7	-167.8	-87.1	0	0	0	112.1	V266 Y342 R349 V429	V266-Y346 HydrophobicContact CB-CD1 4.44Å; V266-Y346 HydrophobicContact CB-CE1 4.28Å; V266-Y346 HydrophobicContact CB-CE2 4.41Å; V266-Y346 HydrophobicContact CG1-CD1 4.4Å; V266-Y346 HydrophobicContact CG1-CD2 4Å; V266-Y346 HydrophobicContact CG1-CE2 4.25Å; V266-Y346 HydrophobicContact CG1-CG 4.1Å; V266-Y346 HydrophobicContact CG2-CD2 4.37Å; V266-Y346 HydrophobicContact CG2-CE1 4.07Å; V266-Y346 HydrophobicContact CG2-CE2 3.78Å; Y342-Y346 HydrophobicContact CE1-CD2 4.18Å; Y342-Y346 PolarHBondContact O-N 2.63Å; Y346-R349 HydrophobicContact CD2-CG 4.35Å; Y346-V429 HydrophobicContact CE2-CG2 3.94Å
347	P	83.6	Confident	88.2	Confident	44 Å²	44	61.9 Å²	61.9	29%	0.286	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	cis	-87.2	3.1	11.6	35.9	-37.9	0	0	0	115.6	R349 V429 V431	P347-R349 PolarHBondContact O-N 3.38Å; P347-V429 HydrophobicContact CB-CB 4.28Å; P347-V429 PolarHBondContact O-N 2.66Å; P347-V431 HydrophobicContact CB-CG2 4.36Å; P347-V431 HydrophobicContact CG-CG2 4.47Å
348	Q	80.8	Confident	88.4	Confident	139 Å²	139	60.6 Å²	60.6	65%	0.65	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.4	121.5	176.8	-59	-176.2	8.8	0	0	109.7	Q345	Q345-Q348 CarbonylContact C-O 3.56Å; Q345-Q348 WeakPolarHBondContact O-CA 3.19Å; Q345-Q348 WeakPolarHBondContact O-CB 3.31Å; Q345-Q348 PolarHBondContact O-N 3.46Å
349	R	84.8	Confident	88.6	Confident	6 Å²	6	61.8 Å²	61.8	2%	0.023	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	97.6	-174.5	-61.9	-170.9	-58.8	160	7.2	109.9	E290 Y342 Y346 P347 M351 S427	E290-R349 IonicContact OE2-CZ 2.71Å; E290-R349 IonicContact OE2-NH1 2.71Å; E290-R349 PolarHBondContact OE2-NH1 3.27Å; E290-R349 IonicContact OE2-NH2 2.8Å; E290-R349 PolarHBondContact OE2-NH2 3.43Å; Y342-R349 HydrophobicContact CE2-CG 4.17Å; Y342-R349 WeakPolarHBondContact OH-CD 3.23Å; Y342-R349 PolarHBondContact OH-NH1 3.04Å; Y346-R349 HydrophobicContact CD2-CG 4.35Å; P347-R349 PolarHBondContact O-N 3.38Å; R349-M351 HydrophobicContact CB-CE 3.78Å; R349-M351 VanDerWaalsContact CZ-CE 3.5Å; R349-M351 PolarHBondContact O-N 3.14Å; R349-S427 PolarHBondContact N-O 3Å; R349-S427 PolarHBondContact O-N 3.3Å; R349-S427 VanDerWaalsContact O-N 3.08Å; R349-S427 PolarHBondContact O-OG 3.07Å
350	P	84	Confident	88.6	Confident	17 Å²	17	62 Å²	62	11%	0.11	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	128.5	171.1	28.8	-33	0	0	0	109.2	G396 L403 V424 E425 Y426	P350-G396 WeakPolarHBondContact O-CA 3.32Å; P350-L403 HydrophobicContact CB-CD1 3.94Å; P350-L403 HydrophobicContact CG-CD1 4.37Å; P350-V424 HydrophobicContact CB-CG1 4.11Å; P350-E425 WeakPolarHBondContact CA-O 3.1Å; P350-Y426 HydrophobicContact CB-CD1 3.93Å; P350-Y426 HydrophobicContact CB-CE1 3.85Å
351	M	89.1	Confident	88.7	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	140.7	179.7	-60.5	-172.6	-162.4	0	0	111.1	R349 Y394 R395 E425	R349-M351 HydrophobicContact CB-CE 3.78Å; R349-M351 VanDerWaalsContact CZ-CE 3.5Å; R349-M351 PolarHBondContact O-N 3.14Å; M351-Y394 HydrophobicContact CE-CE2 3.92Å; M351-Y394 HydrophobicContact SD-CE2 4.36Å; M351-R395 CarbonylContact C-O 3.41Å; M351-R395 WeakPolarHBondContact CA-O 3.2Å; M351-R395 HydrophobicContact CB-CB 4Å; M351-R395 HydrophobicContact CG-CB 4.38Å; M351-R395 HydrophobicContact SD-CB 4.37Å; M351-E425 PolarHBondContact N-O 3.06Å; M351-E425 PolarHBondContact O-N 3.09Å
352	V	89.1	Confident	88.8	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	132.3	173.3	-171	0	0	0	0	110.1	L354 R395 L400 P402 L403 V422	V352-L354 HydrophobicContact CB-CD2 4.27Å; V352-L354 HydrophobicContact CB-CG 4.16Å; V352-L354 HydrophobicContact CG1-CD2 3.59Å; V352-L354 HydrophobicContact CG1-CG 3.96Å; V352-L354 PolarHBondContact O-N 2.95Å; V352-R395 PolarHBondContact N-O 3.01Å; V352-R395 PolarHBondContact O-NH1 2.84Å; V352-L400 HydrophobicContact CB-CD1 4.33Å; V352-L400 HydrophobicContact CG2-CB 4.01Å; V352-L400 HydrophobicContact CG2-CD1 4.06Å; V352-P402 HydrophobicContact CG1-CB 4.05Å; V352-P402 HydrophobicContact CG1-CG 4.13Å; V352-P402 HydrophobicContact CG2-CB 4.21Å; V352-L403 HydrophobicContact CG2-CB 3.73Å; V352-V422 HydrophobicContact CG1-CB 4.42Å; V352-V422 HydrophobicContact CG1-CG1 3.46Å; V352-V422 VanDerWaalsContact CG1-CG1 3.46Å
353	R	89.3	Confident	88.8	Confident	108 Å²	108	56.5 Å²	56.5	41%	0.408	31%	0.308	S	S	.	.			trans	-79	95.9	169.4	-80.8	176.6	161.6	-177.3	1.1	110.3	E423 E425	R353-E423 HydrophobicContact CB-CB 4.46Å; R353-E423 WeakPolarHBondContact CB-O 3.43Å; R353-E423 WeakPolarHBondContact CD-OE2 3.43Å; R353-E423 IonicContact CZ-OE2 2.7Å; R353-E423 PolarHBondContact N-O 2.9Å; R353-E423 IonicContact NE-OE2 3.46Å; R353-E423 IonicContact NH1-OE1 2.71Å; R353-E423 IonicContact NH1-OE2 2.66Å; R353-E423 PolarHBondContact NH1-OE2 3.12Å; R353-E425 HydrophobicContact CG-CB 3.85Å; R353-E425 WeakPolarHBondContact CG-OE2 3.29Å; R353-E425 IonicContact CZ-OE1 3.56Å; R353-E425 IonicContact CZ-OE2 3.17Å; R353-E425 IonicContact NE-OE1 2.72Å; R353-E425 PolarHBondContact NE-OE1 2.96Å; R353-E425 IonicContact NE-OE2 3.59Å; R353-E425 PolarHBondContact NE-OE2 2.88Å; R353-E425 VanDerWaalsContact NH2-CD 3.35Å; R353-E425 IonicContact NH2-OE1 2.87Å; R353-E425 PolarHBondContact NH2-OE1 3.09Å; R353-E425 IonicContact NH2-OE2 2.76Å
354	L	90.8	Very high	88.6	Confident	15 Å²	15	55 Å²	55	8%	0.079	30%	0.3	C	S	.	.			trans	-98.4	144.7	-179.7	-63.3	177.4	0	0	0	111.7	V352 V360 V373 V376 A381 M383 R395 L400	V352-L354 HydrophobicContact CB-CD2 4.27Å; V352-L354 HydrophobicContact CB-CG 4.16Å; V352-L354 HydrophobicContact CG1-CD2 3.59Å; V352-L354 HydrophobicContact CG1-CG 3.96Å; V352-L354 PolarHBondContact O-N 2.95Å; L354-V360 HydrophobicContact CD2-CG2 3.7Å; L354-V373 HydrophobicContact CB-CG1 4.31Å; L354-V373 HydrophobicContact CB-CG2 4.1Å; L354-V373 HydrophobicContact CD1-CG2 4.31Å; L354-V373 HydrophobicContact CD2-CG2 4.11Å; L354-V373 HydrophobicContact CG-CG2 4.41Å; L354-V376 HydrophobicContact CB-CG2 4.13Å; L354-A381 HydrophobicContact CD1-CB 3.58Å; L354-M383 HydrophobicContact CD1-SD 4.15Å; L354-R395 HydrophobicContact CD1-CG 4.29Å; L354-L400 HydrophobicContact CD1-CD1 4.11Å; L354-L400 HydrophobicContact CD1-CD2 4.33Å
355	K	90.4	Very high	88.3	Confident	153 Å²	153	58.3 Å²	58.3	67%	0.665	31%	0.306	S	S	*	.			trans	-123.7	138.9	174.7	-65.1	178.5	-177.5	174.7	0	110.7	G357 Q358 V373	K355-G357 PolarHBondContact O-N 3.05Å; K355-Q358 WeakPolarHBondContact O-CB 3.43Å; K355-Q358 PolarHBondContact O-N 3.07Å; K355-V373 WeakPolarHBondContact O-CB 3.26Å
356	P	93.3	Very high	88	Confident	90 Å²	90	56.4 Å²	56.4	58%	0.584	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	133.2	175.8	-27	35.6	0	0	0	112.7	V373	P356-V373 CarbonylContact C-O 3.5Å; P356-V373 WeakPolarHBondContact CA-O 3.48Å
357	G	91.3	Very high	88.1	Confident	64 Å²	64	59.1 Å²	59.1	66%	0.66	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.5	-11.8	-173.2	0	0	0	0	0	115.2	K355 V373	K355-G357 PolarHBondContact O-N 3.05Å; G357-V373 PolarHBondContact N-O 3.15Å
358	Q	91.1	Very high	88.3	Confident	46 Å²	46	61.9 Å²	61.9	22%	0.215	33%	0.334	C	S	.	.			trans	-66.7	139.4	173.4	-172	177.5	-12.2	0	0	110.5	K355 V360 T372 V373 V422	K355-Q358 WeakPolarHBondContact O-CB 3.43Å; K355-Q358 PolarHBondContact O-N 3.07Å; Q358-V360 HydrophobicContact CG-CG2 3.9Å; Q358-T372 WeakPolarHBondContact O-CA 3.25Å; Q358-V373 HydrophobicContact CB-CG2 4.14Å; Q358-V373 PolarHBondContact O-N 2.93Å; Q358-V422 VanDerWaalsContact NE2-CG2 3.34Å
359	T	92.8	Very high	88.8	Confident	84 Å²	84	59 Å²	59	52%	0.515	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	134	169.6	-50.8	0	0	0	0	108.5	K370 A371 T372	T359-K370 HydrophobicContact CG2-CB 4.04Å; T359-K370 HydrophobicContact CG2-CG 4.49Å; T359-A371 WeakPolarHBondContact CA-O 3.48Å; T359-T372 HydrophobicContact CG2-CG2 4.31Å
360	V	91.5	Very high	89.1	Confident	6 Å²	6	65.5 Å²	65.5	4%	0.036	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	136.1	179.9	-176.9	0	0	0	0	108.7	L354 Q358 T362 A371 M383 P402	L354-V360 HydrophobicContact CD2-CG2 3.7Å; Q358-V360 HydrophobicContact CG-CG2 3.9Å; V360-T362 PolarHBondContact O-N 2.8Å; V360-T362 PolarHBondContact O-OG1 3.17Å; V360-A371 PolarHBondContact N-O 3.26Å; V360-A371 PolarHBondContact O-N 3.14Å; V360-M383 HydrophobicContact CB-CE 4.26Å; V360-P402 HydrophobicContact CG1-CG 3.92Å
361	E	93.2	Very high	89.5	Confident	80 Å²	80	64.7 Å²	64.7	37%	0.374	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	122.1	172.5	-72.5	176.7	-168.1	0	0	108.5	M369 K370 E401	E361-M369 WeakPolarHBondContact CA-O 3.32Å; E361-K370 HydrophobicContact CG-CG 3.83Å; E361-K370 WeakPolarHBondContact OE1-CE 3.44Å; E361-K370 IonicContact OE1-NZ 3.84Å; E361-K370 PolarHBondContact OE1-NZ 2.95Å; E361-E401 HydrophobicContact CB-CB 3.96Å; E361-E401 HydrophobicContact CB-CG 4.41Å; E361-E401 WeakPolarHBondContact O-CB 3.22Å; E361-E401 PolarHBondContact O-N 3.35Å
362	T	91.6	Very high	89.7	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	127.5	-166.9	-51.9	0	0	0	0	107.6	V360 M369 A371 M383 F385 I393 R399 L400	V360-T362 PolarHBondContact O-N 2.8Å; V360-T362 PolarHBondContact O-OG1 3.17Å; T362-M369 PolarHBondContact N-O 3.46Å; T362-M369 PolarHBondContact O-N 3.21Å; T362-M369 VanDerWaalsContact O-O 3.12Å; T362-A371 HydrophobicContact CG2-CB 4.49Å; T362-M383 HydrophobicContact CG2-CE 4.48Å; T362-M383 WeakPolarHBondContact OG1-CE 3.25Å; T362-F385 HydrophobicContact CG2-CE1 3.87Å; T362-F385 HydrophobicContact CG2-CZ 3.63Å; T362-I393 HydrophobicContact CG2-CD1 3.69Å; T362-R399 CarbonylContact C-O 3.46Å; T362-R399 VanDerWaalsContact CA-O 3.22Å; T362-R399 WeakPolarHBondContact CA-O 3.49Å; T362-R399 WeakPolarHBondContact CG2-O 3.4Å; T362-L400 HydrophobicContact CG2-CD2 4.07Å
363	E	90.8	Very high	90	Very high	43 Å²	43	67.3 Å²	67.3	20%	0.201	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	140.2	178.3	-178.3	-82.2	173.9	0	0	110.7	G366 D367 W368 R399	E363-G366 VanDerWaalsContact OE1-CA 3.27Å; E363-G366 WeakPolarHBondContact OE1-CA 3.21Å; E363-G366 PolarHBondContact OE1-N 3.35Å; E363-D367 WeakPolarHBondContact CA-O 3.5Å; E363-W368 HydrophobicContact CB-CD2 4.17Å; E363-W368 HydrophobicContact CB-CE3 4.03Å; E363-W368 HydrophobicContact CB-CH2 4.08Å; E363-W368 HydrophobicContact CB-CZ2 4.22Å; E363-W368 HydrophobicContact CB-CZ3 3.98Å; E363-R399 HydrophobicContact CB-CB 4.19Å; E363-R399 HydrophobicContact CB-CG 4.43Å; E363-R399 PolarHBondContact N-O 2.84Å; E363-R399 PolarHBondContact O-NE 3.41Å; E363-R399 PolarHBondContact O-NH2 3.3Å; E363-R399 VanDerWaalsContact OE2-CD 3.27Å; E363-R399 WeakPolarHBondContact OE2-CD 3.03Å; E363-R399 VanDerWaalsContact OE2-CG 3.22Å; E363-R399 WeakPolarHBondContact OE2-CG 3.42Å; E363-R399 IonicContact OE2-CZ 2.7Å; E363-R399 IonicContact OE2-NE 2.82Å; E363-R399 PolarHBondContact OE2-NE 3.1Å
364	L	86	Confident	90.2	Very high	21 Å²	21	66 Å²	66	11%	0.11	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	131.9	167	-176.7	72.8	0	0	0	107.9	G366 D367 M369 F385 H389	L364-G366 PolarHBondContact O-N 3.26Å; L364-G366 VanDerWaalsContact O-N 3.1Å; L364-D367 PolarHBondContact N-O 3.3Å; L364-D367 PolarHBondContact O-N 3.27Å; L364-M369 HydrophobicContact CB-CE 3.88Å; L364-M369 HydrophobicContact CD2-CE 3.62Å; L364-M369 HydrophobicContact CG-CE 4.27Å; L364-F385 HydrophobicContact CB-CD1 4.23Å; L364-F385 HydrophobicContact CB-CE1 3.7Å; L364-F385 HydrophobicContact CB-CZ 3.94Å; L364-F385 HydrophobicContact CD1-CE2 4.44Å; L364-F385 HydrophobicContact CD1-CZ 4.36Å; L364-F385 HydrophobicContact CD2-CD1 4.21Å; L364-F385 HydrophobicContact CD2-CD2 4.33Å; L364-F385 HydrophobicContact CD2-CE1 4.37Å; L364-F385 HydrophobicContact CD2-CE2 4.47Å; L364-F385 HydrophobicContact CD2-CG 4.19Å; L364-F385 HydrophobicContact CD2-CZ 4.49Å; L364-H389 WeakPolarHBondContact CD2-NE2 3.46Å
365	D	81.3	Confident	90.3	Very high	156 Å²	156	69.7 Å²	69.7	83%	0.834	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	29.9	-179.9	-56.1	-34.7	0	0	0	114.5
366	G	79.7	Confident	90.4	Very high	53 Å²	53	64.6 Å²	64.6	55%	0.546	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.9	-14.3	-175.9	0	0	0	0	0	115.7	E363 L364	E363-G366 VanDerWaalsContact OE1-CA 3.27Å; E363-G366 WeakPolarHBondContact OE1-CA 3.21Å; E363-G366 PolarHBondContact OE1-N 3.35Å; L364-G366 PolarHBondContact O-N 3.26Å; L364-G366 VanDerWaalsContact O-N 3.1Å
367	D	85.2	Confident	90.5	Very high	117 Å²	117	61.4 Å²	61.4	63%	0.626	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.9	134.7	-176.1	-90	-34.4	0	0	0	112.8	E363 L364 M369	E363-D367 WeakPolarHBondContact CA-O 3.5Å; L364-D367 PolarHBondContact N-O 3.3Å; L364-D367 PolarHBondContact O-N 3.27Å; D367-M369 PolarHBondContact O-N 2.83Å
368	W	89.3	Confident	90.5	Very high	101 Å²	101	59.3 Å²	59.3	38%	0.383	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	104.3	175.8	-73.2	98.7	0	0	0	111.5	E363 R399 E401 F404	E363-W368 HydrophobicContact CB-CD2 4.17Å; E363-W368 HydrophobicContact CB-CE3 4.03Å; E363-W368 HydrophobicContact CB-CH2 4.08Å; E363-W368 HydrophobicContact CB-CZ2 4.22Å; E363-W368 HydrophobicContact CB-CZ3 3.98Å; W368-R399 WeakPolarHBondContact CZ3-O 3.39Å; W368-E401 HydrophobicContact CE3-CB 4.2Å; W368-E401 HydrophobicContact CH2-CB 4.48Å; W368-E401 HydrophobicContact CZ3-CB 3.82Å; W368-F404 HydrophobicContact CH2-CB 3.78Å; W368-F404 HydrophobicContact CH2-CD1 4.03Å; W368-F404 HydrophobicContact CH2-CD2 4.2Å; W368-F404 AromaticContact CH2-CG 3.76Å; W368-F404 HydrophobicContact CH2-CG 3.76Å; W368-F404 HydrophobicContact CZ2-CB 4.18Å; W368-F404 AromaticContact CZ2-CD1 3.58Å; W368-F404 HydrophobicContact CZ2-CD1 3.58Å; W368-F404 AromaticContact CZ2-CD2 3.89Å; W368-F404 HydrophobicContact CZ2-CD2 3.89Å; W368-F404 AromaticContact CZ2-CE1 3.81Å; W368-F404 HydrophobicContact CZ2-CE1 3.81Å; W368-F404 HydrophobicContact CZ2-CE2 4.12Å; W368-F404 AromaticContact CZ2-CG 3.62Å; W368-F404 HydrophobicContact CZ2-CG 3.62Å; W368-F404 HydrophobicContact CZ2-CZ 4.08Å
369	M	89.7	Confident	90.7	Very high	79 Å²	79	57.1 Å²	57.1	39%	0.389	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	151.6	-177.1	-74	-155.3	-80	0	0	113.8	E361 T362 L364 D367 A371 F385	E361-M369 WeakPolarHBondContact CA-O 3.32Å; T362-M369 PolarHBondContact N-O 3.46Å; T362-M369 PolarHBondContact O-N 3.21Å; T362-M369 VanDerWaalsContact O-O 3.12Å; L364-M369 HydrophobicContact CB-CE 3.88Å; L364-M369 HydrophobicContact CD2-CE 3.62Å; L364-M369 HydrophobicContact CG-CE 4.27Å; D367-M369 PolarHBondContact O-N 2.83Å; M369-A371 PolarHBondContact O-N 3.09Å; M369-F385 HydrophobicContact CB-CD1 4.05Å; M369-F385 HydrophobicContact CB-CE1 4.46Å; M369-F385 HydrophobicContact CE-CD1 4.18Å
370	K	91.5	Very high	90.8	Very high	143 Å²	143	53.3 Å²	53.3	62%	0.622	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.5	84.7	178.4	-74.3	-179.3	177.4	178.7	0	111.4	T359 E361	T359-K370 HydrophobicContact CG2-CB 4.04Å; T359-K370 HydrophobicContact CG2-CG 4.49Å; E361-K370 HydrophobicContact CG-CG 3.83Å; E361-K370 WeakPolarHBondContact OE1-CE 3.44Å; E361-K370 IonicContact OE1-NZ 3.84Å; E361-K370 PolarHBondContact OE1-NZ 2.95Å
371	A	92.9	Very high	90.9	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	153.5	173	0	0	0	0	0	111.9	T359 V360 T362 M369 M383 K384 F385	T359-A371 WeakPolarHBondContact CA-O 3.48Å; V360-A371 PolarHBondContact N-O 3.26Å; V360-A371 PolarHBondContact O-N 3.14Å; T362-A371 HydrophobicContact CG2-CB 4.49Å; M369-A371 PolarHBondContact O-N 3.09Å; A371-M383 HydrophobicContact CB-CB 4.14Å; A371-M383 HydrophobicContact CB-CE 4Å; A371-K384 CarbonylContact C-O 3.31Å; A371-K384 WeakPolarHBondContact CA-O 3.31Å; A371-F385 HydrophobicContact CB-CD1 3.79Å; A371-F385 HydrophobicContact CB-CE1 3.9Å; A371-F385 HydrophobicContact CB-CG 4.13Å; A371-F385 HydrophobicContact CB-CZ 4.33Å
372	T	93.9	Very high	90.9	Very high	51 Å²	51	50.7 Å²	50.7	31%	0.313	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	132	175.3	52.4	0	0	0	0	110.9	Q358 T359 E374 K384	Q358-T372 WeakPolarHBondContact O-CA 3.25Å; T359-T372 HydrophobicContact CG2-CG2 4.31Å; T372-E374 PolarHBondContact O-N 2.64Å; T372-K384 PolarHBondContact N-O 3.21Å; T372-K384 WeakPolarHBondContact O-CB 3.49Å; T372-K384 PolarHBondContact O-N 3.25Å; T372-K384 PolarHBondContact OG1-O 3.04Å
373	V	95	Very high	91.1	Very high	3 Å²	3	50.7 Å²	50.7	2%	0.018	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	110.9	179.1	-176.5	0	0	0	0	108.9	L354 K355 P356 G357 Q358 V376 M383	L354-V373 HydrophobicContact CB-CG1 4.31Å; L354-V373 HydrophobicContact CB-CG2 4.1Å; L354-V373 HydrophobicContact CD1-CG2 4.31Å; L354-V373 HydrophobicContact CD2-CG2 4.11Å; L354-V373 HydrophobicContact CG-CG2 4.41Å; K355-V373 WeakPolarHBondContact O-CB 3.26Å; P356-V373 CarbonylContact C-O 3.5Å; P356-V373 WeakPolarHBondContact CA-O 3.48Å; G357-V373 PolarHBondContact N-O 3.15Å; Q358-V373 HydrophobicContact CB-CG2 4.14Å; Q358-V373 PolarHBondContact O-N 2.93Å; V373-V376 HydrophobicContact CG1-CG2 3.72Å; V373-M383 HydrophobicContact CB-SD 4.44Å; V373-M383 HydrophobicContact CG2-CE 3.98Å; V373-M383 HydrophobicContact CG2-SD 3.82Å
374	E	92.2	Very high	91.2	Very high	82 Å²	82	51 Å²	51	38%	0.383	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-37.5	-177.3	-172.8	155.5	-132	0	0	112	T372 L382 K384 S390	T372-E374 PolarHBondContact O-N 2.64Å; E374-L382 HydrophobicContact CB-CB 4.48Å; E374-L382 HydrophobicContact CB-CD2 4.13Å; E374-L382 HydrophobicContact CB-CG 4.15Å; E374-L382 HydrophobicContact CG-CD2 4.16Å; E374-L382 PolarHBondContact N-O 3.44Å; E374-K384 HydrophobicContact CB-CB 4.29Å; E374-K384 WeakPolarHBondContact OE1-CE 3.21Å; E374-K384 IonicContact OE1-NZ 3.09Å; E374-K384 PolarHBondContact OE1-NZ 2.88Å; E374-K384 IonicContact OE2-NZ 3.31Å; E374-K384 PolarHBondContact OE2-NZ 2.95Å; E374-S390 PolarHBondContact OE2-OG 3.02Å
375	K	93.5	Very high	91.5	Very high	91 Å²	91	51.4 Å²	51.4	40%	0.396	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	152.1	172.8	179	177.5	165.5	-139.8	0	109.6	D377 A381 L382 W392	K375-D377 IonicContact NZ-OD2 3.04Å; K375-D377 PolarHBondContact NZ-OD2 2.8Å; K375-A381 WeakPolarHBondContact O-CA 3.14Å; K375-L382 HydrophobicContact CB-CB 4.12Å; K375-L382 HydrophobicContact CB-CD2 4.42Å; K375-L382 PolarHBondContact O-N 3.45Å; K375-W392 HydrophobicContact CB-CH2 4.13Å; K375-W392 HydrophobicContact CD-CH2 3.7Å; K375-W392 HydrophobicContact CD-CZ2 4.17Å; K375-W392 HydrophobicContact CG-CH2 3.9Å
376	V	93.7	Very high	91.7	Very high	47 Å²	47	46.4 Å²	46.4	29%	0.285	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	139.5	161.8	178.8	0	0	0	0	107.6	L354 V373 A381	L354-V376 HydrophobicContact CB-CG2 4.13Å; V373-V376 HydrophobicContact CG1-CG2 3.72Å; V376-A381 HydrophobicContact CG2-CB 4.3Å
377	D	93.6	Very high	91.7	Very high	22 Å²	22	55.3 Å²	55.3	12%	0.118	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	99.6	179	-164.8	-18.5	0	0	0	107.7	R299 Y311 K375 S379 L380 W392	R299-D377 IonicContact CZ-OD1 2.59Å; R299-D377 IonicContact CZ-OD2 3.2Å; R299-D377 IonicContact NH1-OD1 2.92Å; R299-D377 IonicContact NH1-OD2 2.76Å; R299-D377 PolarHBondContact NH1-OD2 3.24Å; R299-D377 VanDerWaalsContact NH1-OD2 3.08Å; R299-D377 IonicContact NH2-OD1 3.37Å; R299-D377 PolarHBondContact NH2-OD1 3.49Å; R299-D377 IonicContact NH2-OD2 2.72Å; Y311-D377 WeakPolarHBondContact CE2-O 3.4Å; K375-D377 IonicContact NZ-OD2 3.04Å; K375-D377 PolarHBondContact NZ-OD2 2.8Å; D377-S379 PolarHBondContact O-N 3.23Å; D377-L380 PolarHBondContact N-O 2.93Å; D377-L380 PolarHBondContact O-N 2.86Å; D377-W392 HydrophobicContact CB-CH2 3.77Å; D377-W392 HydrophobicContact CB-CZ3 3.81Å
378	A	92.4	Very high	91.5	Very high	20 Å²	20	56.4 Å²	56.4	17%	0.165	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	-107.7	-175.8	0	0	0	0	0	113.7	R295 N296 Y311 R395	R295-A378 WeakPolarHBondContact O-CB 3.35Å; N296-A378 HydrophobicContact CB-CB 3.97Å; Y311-A378 HydrophobicContact CE2-CB 3.88Å; Y311-A378 VanDerWaalsContact OH-CB 3.27Å; Y311-A378 WeakPolarHBondContact OH-CB 3.36Å; A378-R395 PolarHBondContact O-NE 3.32Å; A378-R395 PolarHBondContact O-NH2 3.4Å
379	S	94.2	Very high	91.4	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-0.1	-179.9	-58.9	0	0	0	0	114	E290 Y311 D377 Y394 R395	E290-S379 PolarHBondContact OE2-OG 3.33Å; Y311-S379 VanDerWaalsContact OH-CB 3.28Å; Y311-S379 WeakPolarHBondContact OH-CB 3.34Å; Y311-S379 PolarHBondContact OH-N 2.86Å; Y311-S379 VanDerWaalsContact OH-N 3.1Å; Y311-S379 PolarHBondContact OH-OG 3.34Å; D377-S379 PolarHBondContact O-N 3.23Å; S379-Y394 VanDerWaalsContact O-CD2 3.3Å; S379-Y394 WeakPolarHBondContact O-CD2 3.35Å; S379-R395 PolarHBondContact O-N 3.35Å
380	L	94.7	Very high	91.3	Very high	5 Å²	5	51.8 Å²	51.8	3%	0.026	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	153.9	176.6	-62.2	-173.6	0	0	0	112.8	L301 T309 Y311 D377 W392	L301-L380 HydrophobicContact CD1-CD1 3.89Å; L301-L380 HydrophobicContact CD1-CD2 3.73Å; L301-L380 HydrophobicContact CD1-CG 3.82Å; T309-L380 VanDerWaalsContact OG1-CD2 3.28Å; T309-L380 WeakPolarHBondContact OG1-CD2 3.49Å; Y311-L380 HydrophobicContact CD2-CD1 3.7Å; Y311-L380 HydrophobicContact CD2-CG 3.91Å; Y311-L380 HydrophobicContact CE2-CB 4.32Å; Y311-L380 HydrophobicContact CE2-CD1 4.11Å; Y311-L380 HydrophobicContact CE2-CG 3.78Å; D377-L380 PolarHBondContact N-O 2.93Å; D377-L380 PolarHBondContact O-N 2.86Å; L380-W392 HydrophobicContact CB-CE3 3.74Å; L380-W392 HydrophobicContact CB-CZ3 4.06Å; L380-W392 HydrophobicContact CD1-CE3 4.42Å
381	A	94.2	Very high	91.2	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	135.8	168.1	0	0	0	0	0	110.9	L354 K375 V376 M383 I393 R395	L354-A381 HydrophobicContact CD1-CB 3.58Å; K375-A381 WeakPolarHBondContact O-CA 3.14Å; V376-A381 HydrophobicContact CG2-CB 4.3Å; A381-M383 HydrophobicContact CB-SD 4.04Å; A381-M383 PolarHBondContact O-N 2.95Å; A381-I393 PolarHBondContact N-O 3.42Å; A381-I393 PolarHBondContact O-N 3.37Å; A381-R395 HydrophobicContact CB-CG 3.96Å
382	L	94.4	Very high	91.1	Very high	30 Å²	30	49.9 Å²	49.9	16%	0.157	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	107.6	174	-178.7	62.2	0	0	0	108.3	E374 K375 E391 W392	E374-L382 HydrophobicContact CB-CB 4.48Å; E374-L382 HydrophobicContact CB-CD2 4.13Å; E374-L382 HydrophobicContact CB-CG 4.15Å; E374-L382 HydrophobicContact CG-CD2 4.16Å; E374-L382 PolarHBondContact N-O 3.44Å; K375-L382 HydrophobicContact CB-CB 4.12Å; K375-L382 HydrophobicContact CB-CD2 4.42Å; K375-L382 PolarHBondContact O-N 3.45Å; L382-E391 CarbonylContact C-O 3.5Å; L382-E391 WeakPolarHBondContact CA-O 3.41Å; L382-W392 HydrophobicContact CB-CD2 3.99Å; L382-W392 HydrophobicContact CB-CE3 3.86Å; L382-W392 HydrophobicContact CB-CH2 3.93Å; L382-W392 HydrophobicContact CB-CZ2 4.02Å; L382-W392 HydrophobicContact CB-CZ3 3.84Å; L382-W392 HydrophobicContact CD1-CD2 4.1Å; L382-W392 HydrophobicContact CD1-CG 4.15Å; L382-W392 HydrophobicContact CD2-CZ2 4.3Å
383	M	93.9	Very high	91	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	114.3	-175.9	-59.6	-54.7	-71.3	0	0	109.6	L354 V360 T362 A371 V373 A381 F385 S390 E391 I393 L400	L354-M383 HydrophobicContact CD1-SD 4.15Å; V360-M383 HydrophobicContact CB-CE 4.26Å; T362-M383 HydrophobicContact CG2-CE 4.48Å; T362-M383 WeakPolarHBondContact OG1-CE 3.25Å; A371-M383 HydrophobicContact CB-CB 4.14Å; A371-M383 HydrophobicContact CB-CE 4Å; V373-M383 HydrophobicContact CB-SD 4.44Å; V373-M383 HydrophobicContact CG2-CE 3.98Å; V373-M383 HydrophobicContact CG2-SD 3.82Å; A381-M383 HydrophobicContact CB-SD 4.04Å; A381-M383 PolarHBondContact O-N 2.95Å; M383-F385 HydrophobicContact CB-CE2 4.17Å; M383-F385 WeakPolarHBondContact O-CD2 3.38Å; M383-S390 CarbonylContact O-C 3.59Å; M383-S390 VanDerWaalsContact O-CA 3.23Å; M383-S390 WeakPolarHBondContact O-CA 3.09Å; M383-E391 PolarHBondContact N-O 3.26Å; M383-E391 PolarHBondContact O-N 3.28Å; M383-I393 HydrophobicContact CB-CD1 4.09Å; M383-I393 HydrophobicContact CG-CB 4.2Å; M383-I393 HydrophobicContact CG-CD1 3.97Å; M383-I393 HydrophobicContact CG-CG1 4.26Å; M383-L400 HydrophobicContact CE-CD2 3.91Å; M383-L400 HydrophobicContact CG-CD2 4.5Å; M383-L400 HydrophobicContact SD-CD2 4.36Å
384	K	93.9	Very high	91	Very high	49 Å²	49	47.8 Å²	47.8	21%	0.213	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	107.6	-179.8	-179.8	176.3	-131.3	70.4	0	110.7	A371 T372 E374 S386 S390	A371-K384 CarbonylContact C-O 3.31Å; A371-K384 WeakPolarHBondContact CA-O 3.31Å; T372-K384 PolarHBondContact N-O 3.21Å; T372-K384 WeakPolarHBondContact O-CB 3.49Å; T372-K384 PolarHBondContact O-N 3.25Å; T372-K384 PolarHBondContact OG1-O 3.04Å; E374-K384 HydrophobicContact CB-CB 4.29Å; E374-K384 WeakPolarHBondContact OE1-CE 3.21Å; E374-K384 IonicContact OE1-NZ 3.09Å; E374-K384 PolarHBondContact OE1-NZ 2.88Å; E374-K384 IonicContact OE2-NZ 3.31Å; E374-K384 PolarHBondContact OE2-NZ 2.95Å; K384-S386 WeakPolarHBondContact CE-O 3.49Å; K384-S386 VanDerWaalsContact CG-O 3.24Å; K384-S386 WeakPolarHBondContact CG-O 3.27Å; K384-S390 WeakPolarHBondContact CB-OG 3.35Å; K384-S390 WeakPolarHBondContact CG-OG 3.4Å; K384-S390 PolarHBondContact NZ-OG 3.49Å
385	F	91.5	Very high	91	Very high	31 Å²	31	44.5 Å²	44.5	14%	0.136	22%	0.218	C	C	.	.			trans	-84.8	-36.2	177.6	-62.6	-92.7	0	0	0	112.2	T362 L364 M369 A371 M383 H389 E391 I393	T362-F385 HydrophobicContact CG2-CE1 3.87Å; T362-F385 HydrophobicContact CG2-CZ 3.63Å; L364-F385 HydrophobicContact CB-CD1 4.23Å; L364-F385 HydrophobicContact CB-CE1 3.7Å; L364-F385 HydrophobicContact CB-CZ 3.94Å; L364-F385 HydrophobicContact CD1-CE2 4.44Å; L364-F385 HydrophobicContact CD1-CZ 4.36Å; L364-F385 HydrophobicContact CD2-CD1 4.21Å; L364-F385 HydrophobicContact CD2-CD2 4.33Å; L364-F385 HydrophobicContact CD2-CE1 4.37Å; L364-F385 HydrophobicContact CD2-CE2 4.47Å; L364-F385 HydrophobicContact CD2-CG 4.19Å; L364-F385 HydrophobicContact CD2-CZ 4.49Å; M369-F385 HydrophobicContact CB-CD1 4.05Å; M369-F385 HydrophobicContact CB-CE1 4.46Å; M369-F385 HydrophobicContact CE-CD1 4.18Å; A371-F385 HydrophobicContact CB-CD1 3.79Å; A371-F385 HydrophobicContact CB-CE1 3.9Å; A371-F385 HydrophobicContact CB-CG 4.13Å; A371-F385 HydrophobicContact CB-CZ 4.33Å; M383-F385 HydrophobicContact CB-CE2 4.17Å; M383-F385 WeakPolarHBondContact O-CD2 3.38Å; F385-H389 AromaticContact CD2-CD2 3.52Å; F385-H389 AromaticContact CD2-NE2 3.86Å; F385-H389 PolarHBondContact N-O 2.94Å; F385-H389 VanDerWaalsContact N-O 3.09Å; F385-E391 HydrophobicContact CE2-CB 4.05Å; F385-I393 HydrophobicContact CE2-CD1 4.29Å; F385-I393 HydrophobicContact CZ-CD1 4.04Å
386	S	87.3	Confident	90.9	Very high	51 Å²	51	40.7 Å²	40.7	36%	0.357	20%	0.204	S	C	.	.	S	Bend	trans	-143.8	-166.7	-175.3	85.8	0	0	0	0	112.9	K384 T388 H389	K384-S386 WeakPolarHBondContact CE-O 3.49Å; K384-S386 VanDerWaalsContact CG-O 3.24Å; K384-S386 WeakPolarHBondContact CG-O 3.27Å; S386-T388 VanDerWaalsContact C-N 3.31Å; S386-T388 PolarHBondContact OG-N 3.2Å; S386-T388 PolarHBondContact OG-OG1 2.79Å; S386-H389 PolarHBondContact N-O 3.22Å; S386-H389 VanDerWaalsContact N-O 3.12Å; S386-H389 PolarHBondContact OG-N 2.72Å
387	R	79.4	Confident	90.6	Very high	240 Å²	240	39.1 Å²	39.1	91%	0.906	20%	0.195	S	C	*	.	S	Bend	trans	-74.5	-21	169	-80.6	-170.3	64.1	171.6	-1.8	113.4
388	T	81.4	Confident	90.3	Very high	139 Å²	139	41 Å²	41	85%	0.853	21%	0.207	S	C	*	.	S	Bend	trans	-118.2	-16.1	-171.8	50.9	0	0	0	0	113.5	S386	S386-T388 VanDerWaalsContact C-N 3.31Å; S386-T388 PolarHBondContact OG-N 3.2Å; S386-T388 PolarHBondContact OG-OG1 2.79Å
389	H	85.5	Confident	90.2	Very high	59 Å²	59	42.6 Å²	42.6	27%	0.273	21%	0.209	S	C	.	.			trans	-124.5	119.7	-178.5	-172.9	66	0	0	0	111.2	L364 F385 S386	L364-H389 WeakPolarHBondContact CD2-NE2 3.46Å; F385-H389 AromaticContact CD2-CD2 3.52Å; F385-H389 AromaticContact CD2-NE2 3.86Å; F385-H389 PolarHBondContact N-O 2.94Å; F385-H389 VanDerWaalsContact N-O 3.09Å; S386-H389 PolarHBondContact N-O 3.22Å; S386-H389 VanDerWaalsContact N-O 3.12Å; S386-H389 PolarHBondContact OG-N 2.72Å
390	S	88.7	Confident	90.1	Very high	25 Å²	25	42.6 Å²	42.6	18%	0.175	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	138.8	168	-71.1	0	0	0	0	107.6	E374 M383 K384	E374-S390 PolarHBondContact OE2-OG 3.02Å; M383-S390 CarbonylContact O-C 3.59Å; M383-S390 VanDerWaalsContact O-CA 3.23Å; M383-S390 WeakPolarHBondContact O-CA 3.09Å; K384-S390 WeakPolarHBondContact CB-OG 3.35Å; K384-S390 WeakPolarHBondContact CG-OG 3.4Å; K384-S390 PolarHBondContact NZ-OG 3.49Å
391	E	88.6	Confident	89.9	Confident	39 Å²	39	45.2 Å²	45.2	18%	0.182	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	146	-174.9	-161.2	-155.5	147.4	0	0	111.9	L382 M383 F385 I393 R399	L382-E391 CarbonylContact C-O 3.5Å; L382-E391 WeakPolarHBondContact CA-O 3.41Å; M383-E391 PolarHBondContact N-O 3.26Å; M383-E391 PolarHBondContact O-N 3.28Å; F385-E391 HydrophobicContact CE2-CB 4.05Å; E391-I393 HydrophobicContact CB-CG1 4.28Å; E391-I393 HydrophobicContact CG-CG1 4.28Å; E391-I393 PolarHBondContact O-N 3.48Å; E391-R399 IonicContact OE1-CZ 3.65Å; E391-R399 IonicContact OE1-NH1 3.02Å; E391-R399 PolarHBondContact OE1-NH1 2.8Å; E391-R399 IonicContact OE1-NH2 2.67Å; E391-R399 IonicContact OE2-CZ 2.91Å; E391-R399 VanDerWaalsContact OE2-CZ 3.3Å; E391-R399 IonicContact OE2-NH1 2.74Å; E391-R399 PolarHBondContact OE2-NH1 3.4Å; E391-R399 IonicContact OE2-NH2 3.86Å; E391-R399 PolarHBondContact OE2-NH2 3.12Å
392	W	91.5	Very high	89.5	Confident	63 Å²	63	45.3 Å²	45.3	24%	0.239	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	102.1	172.5	-80.2	109.8	0	0	0	111.6	T309 K375 D377 L380 L382	T309-W392 PolarHBondContact OG1-O 2.81Å; K375-W392 HydrophobicContact CB-CH2 4.13Å; K375-W392 HydrophobicContact CD-CH2 3.7Å; K375-W392 HydrophobicContact CD-CZ2 4.17Å; K375-W392 HydrophobicContact CG-CH2 3.9Å; D377-W392 HydrophobicContact CB-CH2 3.77Å; D377-W392 HydrophobicContact CB-CZ3 3.81Å; L380-W392 HydrophobicContact CB-CE3 3.74Å; L380-W392 HydrophobicContact CB-CZ3 4.06Å; L380-W392 HydrophobicContact CD1-CE3 4.42Å; L382-W392 HydrophobicContact CB-CD2 3.99Å; L382-W392 HydrophobicContact CB-CE3 3.86Å; L382-W392 HydrophobicContact CB-CH2 3.93Å; L382-W392 HydrophobicContact CB-CZ2 4.02Å; L382-W392 HydrophobicContact CB-CZ3 3.84Å; L382-W392 HydrophobicContact CD1-CD2 4.1Å; L382-W392 HydrophobicContact CD1-CG 4.15Å; L382-W392 HydrophobicContact CD2-CZ2 4.3Å
393	I	91.9	Very high	89	Confident	3 Å²	3	44 Å²	44	2%	0.015	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	133.1	-177.4	-58.5	-179	0	0	0	110.2	T362 A381 M383 F385 E391 R395 L400	T362-I393 HydrophobicContact CG2-CD1 3.69Å; A381-I393 PolarHBondContact N-O 3.42Å; A381-I393 PolarHBondContact O-N 3.37Å; M383-I393 HydrophobicContact CB-CD1 4.09Å; M383-I393 HydrophobicContact CG-CB 4.2Å; M383-I393 HydrophobicContact CG-CD1 3.97Å; M383-I393 HydrophobicContact CG-CG1 4.26Å; F385-I393 HydrophobicContact CE2-CD1 4.29Å; F385-I393 HydrophobicContact CZ-CD1 4.04Å; E391-I393 HydrophobicContact CB-CG1 4.28Å; E391-I393 HydrophobicContact CG-CG1 4.28Å; E391-I393 PolarHBondContact O-N 3.48Å; I393-R395 PolarHBondContact O-N 3.39Å; I393-L400 HydrophobicContact CG2-CG 4.47Å
394	Y	93.9	Very high	88.6	Confident	7 Å²	7	47.7 Å²	47.7	3%	0.027	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	130.6	171.7	167.7	-113.7	0	0	0	111.5	L301 F303 F338 Y342 M351 S379 G396 S397	L301-Y394 HydrophobicContact CD2-CD2 4.13Å; L301-Y394 HydrophobicContact CD2-CE2 4.49Å; F303-Y394 HydrophobicContact CE1-CD2 4.4Å; F303-Y394 HydrophobicContact CE1-CG 4.13Å; F303-Y394 HydrophobicContact CZ-CD1 4.12Å; F303-Y394 HydrophobicContact CZ-CD2 4.38Å; F303-Y394 HydrophobicContact CZ-CE1 4.39Å; F303-Y394 HydrophobicContact CZ-CG 4.13Å; F338-Y394 HydrophobicContact CE2-CD1 4.43Å; F338-Y394 AromaticContact CZ-CD1 3.74Å; F338-Y394 HydrophobicContact CZ-CD1 3.74Å; F338-Y394 HydrophobicContact CZ-CE1 4Å; Y342-Y394 HydrophobicContact CD2-CE1 4.24Å; Y342-Y394 HydrophobicContact CE2-CE1 4.15Å; Y342-Y394 HydrophobicContact CE2-CE2 4.43Å; Y342-Y394 AromaticContact CE2-CZ 3.77Å; Y342-Y394 WeakPolarHBondContact CE2-OH 3.41Å; M351-Y394 HydrophobicContact CE-CE2 3.92Å; M351-Y394 HydrophobicContact SD-CE2 4.36Å; S379-Y394 VanDerWaalsContact O-CD2 3.3Å; S379-Y394 WeakPolarHBondContact O-CD2 3.35Å; Y394-G396 WeakPolarHBondContact CE1-O 3.39Å; Y394-G396 PolarHBondContact O-N 2.9Å; Y394-G396 VanDerWaalsContact O-N 3.09Å; Y394-S397 WeakPolarHBondContact O-CB 3.32Å; Y394-S397 PolarHBondContact O-N 2.87Å
395	R	93.6	Very high	87.9	Confident	14 Å²	14	46.9 Å²	46.9	5%	0.053	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-14.1	-173.8	-66.8	-162.4	-65.3	104.4	2.9	114.4	M351 V352 L354 A378 S379 A381 I393	M351-R395 CarbonylContact C-O 3.41Å; M351-R395 WeakPolarHBondContact CA-O 3.2Å; M351-R395 HydrophobicContact CB-CB 4Å; M351-R395 HydrophobicContact CG-CB 4.38Å; M351-R395 HydrophobicContact SD-CB 4.37Å; V352-R395 PolarHBondContact N-O 3.01Å; V352-R395 PolarHBondContact O-NH1 2.84Å; L354-R395 HydrophobicContact CD1-CG 4.29Å; A378-R395 PolarHBondContact O-NE 3.32Å; A378-R395 PolarHBondContact O-NH2 3.4Å; S379-R395 PolarHBondContact O-N 3.35Å; A381-R395 HydrophobicContact CB-CG 3.96Å; I393-R395 PolarHBondContact O-N 3.39Å
396	G	89.6	Confident	87.3	Confident	10 Å²	10	46.9 Å²	46.9	10%	0.103	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	19.4	169.3	0	0	0	0	0	114.1	P350 Y394 L403	P350-G396 WeakPolarHBondContact O-CA 3.32Å; Y394-G396 WeakPolarHBondContact CE1-O 3.39Å; Y394-G396 PolarHBondContact O-N 2.9Å; Y394-G396 VanDerWaalsContact O-N 3.09Å; G396-L403 WeakPolarHBondContact O-CD2 3.29Å
397	S	89.4	Confident	86.6	Confident	14 Å²	14	47.1 Å²	47.1	10%	0.098	23%	0.23	C	C	.	.			trans	-78	137.8	175.4	-179	0	0	0	0	111.5	Y394 R399 L400	Y394-S397 WeakPolarHBondContact O-CB 3.32Å; Y394-S397 PolarHBondContact O-N 2.87Å; S397-R399 PolarHBondContact O-N 2.62Å; S397-R399 VanDerWaalsContact O-N 3.11Å; S397-R399 WeakPolarHBondContact OG-CB 3.5Å; S397-R399 WeakPolarHBondContact OG-CG 3.31Å; S397-R399 PolarHBondContact OG-N 3.24Å; S397-L400 PolarHBondContact O-N 3.23Å
398	T	87.2	Confident	86.4	Confident	61 Å²	61	40 Å²	40	37%	0.374	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-7	170.5	46.3	0	0	0	0	113.6	L400 L407	T398-L400 PolarHBondContact O-N 2.76Å; T398-L407 HydrophobicContact CG2-CD1 3.69Å
399	R	89.9	Confident	85.6	Confident	55 Å²	55	34.9 Å²	34.9	21%	0.208	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-7.9	171.9	-60.6	-179.9	54.9	-143.2	-11.1	113.3	T362 E363 W368 E391 S397	T362-R399 CarbonylContact C-O 3.46Å; T362-R399 VanDerWaalsContact CA-O 3.22Å; T362-R399 WeakPolarHBondContact CA-O 3.49Å; T362-R399 WeakPolarHBondContact CG2-O 3.4Å; E363-R399 HydrophobicContact CB-CB 4.19Å; E363-R399 HydrophobicContact CB-CG 4.43Å; E363-R399 PolarHBondContact N-O 2.84Å; E363-R399 PolarHBondContact O-NE 3.41Å; E363-R399 PolarHBondContact O-NH2 3.3Å; E363-R399 VanDerWaalsContact OE2-CD 3.27Å; E363-R399 WeakPolarHBondContact OE2-CD 3.03Å; E363-R399 VanDerWaalsContact OE2-CG 3.22Å; E363-R399 WeakPolarHBondContact OE2-CG 3.42Å; E363-R399 IonicContact OE2-CZ 2.7Å; E363-R399 IonicContact OE2-NE 2.82Å; E363-R399 PolarHBondContact OE2-NE 3.1Å; W368-R399 WeakPolarHBondContact CZ3-O 3.39Å; E391-R399 IonicContact OE1-CZ 3.65Å; E391-R399 IonicContact OE1-NH1 3.02Å; E391-R399 PolarHBondContact OE1-NH1 2.8Å; E391-R399 IonicContact OE1-NH2 2.67Å; E391-R399 IonicContact OE2-CZ 2.91Å; E391-R399 VanDerWaalsContact OE2-CZ 3.3Å; E391-R399 IonicContact OE2-NH1 2.74Å; E391-R399 PolarHBondContact OE2-NH1 3.4Å; E391-R399 IonicContact OE2-NH2 3.86Å; E391-R399 PolarHBondContact OE2-NH2 3.12Å; S397-R399 PolarHBondContact O-N 2.62Å; S397-R399 VanDerWaalsContact O-N 3.11Å; S397-R399 WeakPolarHBondContact OG-CB 3.5Å; S397-R399 WeakPolarHBondContact OG-CG 3.31Å; S397-R399 PolarHBondContact OG-N 3.24Å
400	L	92	Very high	84.3	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-98.7	119.3	173.8	-64.1	166.9	0	0	0	109.9	V352 L354 T362 M383 I393 S397 T398 P402 L403 F404	V352-L400 HydrophobicContact CB-CD1 4.33Å; V352-L400 HydrophobicContact CG2-CB 4.01Å; V352-L400 HydrophobicContact CG2-CD1 4.06Å; L354-L400 HydrophobicContact CD1-CD1 4.11Å; L354-L400 HydrophobicContact CD1-CD2 4.33Å; T362-L400 HydrophobicContact CG2-CD2 4.07Å; M383-L400 HydrophobicContact CE-CD2 3.91Å; M383-L400 HydrophobicContact CG-CD2 4.5Å; M383-L400 HydrophobicContact SD-CD2 4.36Å; I393-L400 HydrophobicContact CG2-CG 4.47Å; S397-L400 PolarHBondContact O-N 3.23Å; T398-L400 PolarHBondContact O-N 2.76Å; L400-P402 VanDerWaalsContact C-CD 3.44Å; L400-P402 VanDerWaalsContact C-N 3.34Å; L400-L403 PolarHBondContact O-N 2.83Å; L400-L403 VanDerWaalsContact O-N 3.08Å; L400-F404 PolarHBondContact O-N 2.79Å; L400-F404 VanDerWaalsContact O-N 3.09Å
401	E	90.1	Very high	82.4	Confident	60 Å²	60	42.7 Å²	42.7	28%	0.28	22%	0.222	S	C	.	.	H	α-helix	trans	-49.7	-44.4	-174.5	177.8	-74.4	142.6	0	0	113.6	E361 W368 L403 F404 S405	E361-E401 HydrophobicContact CB-CB 3.96Å; E361-E401 HydrophobicContact CB-CG 4.41Å; E361-E401 WeakPolarHBondContact O-CB 3.22Å; E361-E401 PolarHBondContact O-N 3.35Å; W368-E401 HydrophobicContact CE3-CB 4.2Å; W368-E401 HydrophobicContact CH2-CB 4.48Å; W368-E401 HydrophobicContact CZ3-CB 3.82Å; E401-L403 PolarHBondContact O-N 3.09Å; E401-L403 VanDerWaalsContact O-N 3.15Å; E401-F404 WeakPolarHBondContact O-CB 3.41Å; E401-F404 PolarHBondContact O-N 2.93Å; E401-F404 VanDerWaalsContact O-N 3.14Å; E401-S405 WeakPolarHBondContact O-CB 3.16Å; E401-S405 PolarHBondContact O-N 3.27Å; E401-S405 PolarHBondContact O-OG 3.18Å; E401-S405 WeakPolarHBondContact OE1-CB 3.21Å; E401-S405 PolarHBondContact OE1-OG 3.47Å
402	P	86.5	Confident	80.1	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.013	23%	0.234	C	C	.	.	H	α-helix	trans	-61	-32.6	-175.6	-27.9	36.6	0	0	0	113.2	V352 V360 L400 D406 V422	V352-P402 HydrophobicContact CG1-CB 4.05Å; V352-P402 HydrophobicContact CG1-CG 4.13Å; V352-P402 HydrophobicContact CG2-CB 4.21Å; V360-P402 HydrophobicContact CG1-CG 3.92Å; L400-P402 VanDerWaalsContact C-CD 3.44Å; L400-P402 VanDerWaalsContact C-N 3.34Å; P402-D406 WeakPolarHBondContact O-CB 3.42Å; P402-D406 PolarHBondContact O-N 3.23Å; P402-V422 HydrophobicContact CB-CB 3.94Å; P402-V422 HydrophobicContact CB-CG1 4.49Å; P402-V422 HydrophobicContact CG-CB 3.76Å; P402-V422 HydrophobicContact CG-CG1 4.28Å; P402-V422 HydrophobicContact CG-CG2 3.98Å
403	L	83.6	Confident	77	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-84.5	-36.3	177.3	-175.2	62.8	0	0	0	112	P350 V352 G396 L400 E401 D406 L407 V424	P350-L403 HydrophobicContact CB-CD1 3.94Å; P350-L403 HydrophobicContact CG-CD1 4.37Å; V352-L403 HydrophobicContact CG2-CB 3.73Å; G396-L403 WeakPolarHBondContact O-CD2 3.29Å; L400-L403 PolarHBondContact O-N 2.83Å; L400-L403 VanDerWaalsContact O-N 3.08Å; E401-L403 PolarHBondContact O-N 3.09Å; E401-L403 VanDerWaalsContact O-N 3.15Å; L403-D406 PolarHBondContact O-N 3.16Å; L403-L407 HydrophobicContact CD1-CD1 4.18Å; L403-L407 HydrophobicContact CD1-CG 4.26Å; L403-L407 HydrophobicContact CG-CD1 3.9Å; L403-L407 HydrophobicContact CG-CG 4.42Å; L403-L407 WeakPolarHBondContact O-CB 3.41Å; L403-L407 VanDerWaalsContact O-CG 3.28Å; L403-L407 WeakPolarHBondContact O-CG 3.34Å; L403-L407 PolarHBondContact O-N 2.81Å; L403-V424 HydrophobicContact CD1-CG1 3.87Å; L403-V424 HydrophobicContact CD1-CG2 4.42Å
404	F	84.7	Confident	74.3	Confident	78 Å²	78	55.2 Å²	55.2	34%	0.342	30%	0.296	S	S	.	.	H	α-helix	trans	-57.5	-51.1	172.7	-176.3	-103.5	0	0	0	111.1	W368 L400 E401 D406 L407 L408	W368-F404 HydrophobicContact CH2-CB 3.78Å; W368-F404 HydrophobicContact CH2-CD1 4.03Å; W368-F404 HydrophobicContact CH2-CD2 4.2Å; W368-F404 AromaticContact CH2-CG 3.76Å; W368-F404 HydrophobicContact CH2-CG 3.76Å; W368-F404 HydrophobicContact CZ2-CB 4.18Å; W368-F404 AromaticContact CZ2-CD1 3.58Å; W368-F404 HydrophobicContact CZ2-CD1 3.58Å; W368-F404 AromaticContact CZ2-CD2 3.89Å; W368-F404 HydrophobicContact CZ2-CD2 3.89Å; W368-F404 AromaticContact CZ2-CE1 3.81Å; W368-F404 HydrophobicContact CZ2-CE1 3.81Å; W368-F404 HydrophobicContact CZ2-CE2 4.12Å; W368-F404 AromaticContact CZ2-CG 3.62Å; W368-F404 HydrophobicContact CZ2-CG 3.62Å; W368-F404 HydrophobicContact CZ2-CZ 4.08Å; L400-F404 PolarHBondContact O-N 2.79Å; L400-F404 VanDerWaalsContact O-N 3.09Å; E401-F404 WeakPolarHBondContact O-CB 3.41Å; E401-F404 PolarHBondContact O-N 2.93Å; E401-F404 VanDerWaalsContact O-N 3.14Å; F404-D406 PolarHBondContact O-N 2.76Å; F404-L407 PolarHBondContact O-N 3.11Å; F404-L408 HydrophobicContact CD1-CD1 3.77Å; F404-L408 HydrophobicContact CE1-CD1 3.46Å; F404-L408 VanDerWaalsContact CE1-CD1 3.46Å; F404-L408 HydrophobicContact CG-CD1 4.48Å; F404-L408 HydrophobicContact CZ-CD1 3.93Å; F404-L408 WeakPolarHBondContact O-CG 3.41Å; F404-L408 PolarHBondContact O-N 2.94Å
405	S	80.6	Confident	71.2	Confident	31 Å²	31	61.8 Å²	61.8	22%	0.217	34%	0.337	C	S	.	.	H	α-helix	trans	-67.8	-30.1	177.3	-67.5	0	0	0	0	113.3	E401 S409	E401-S405 WeakPolarHBondContact O-CB 3.16Å; E401-S405 PolarHBondContact O-N 3.27Å; E401-S405 PolarHBondContact O-OG 3.18Å; E401-S405 WeakPolarHBondContact OE1-CB 3.21Å; E401-S405 PolarHBondContact OE1-OG 3.47Å; S405-S409 VanDerWaalsContact O-CB 3.29Å; S405-S409 WeakPolarHBondContact O-CB 3.29Å; S405-S409 PolarHBondContact O-N 3.19Å; S405-S409 PolarHBondContact O-OG 3.05Å
406	D	77.3	Confident	68.4	Low	32 Å²	32	65 Å²	65	17%	0.171	36%	0.359	C	S	.	.	H	α-helix	trans	-69.9	-45.1	173.6	-163.3	53.2	0	0	0	111.3	P402 L403 F404 L408 S409 S410 V424 Y426	P402-D406 WeakPolarHBondContact O-CB 3.42Å; P402-D406 PolarHBondContact O-N 3.23Å; L403-D406 PolarHBondContact O-N 3.16Å; F404-D406 PolarHBondContact O-N 2.76Å; D406-L408 VanDerWaalsContact C-N 3.31Å; D406-L408 PolarHBondContact O-N 3.02Å; D406-S409 PolarHBondContact O-N 3.2Å; D406-S409 VanDerWaalsContact O-N 3.15Å; D406-S409 PolarHBondContact O-OG 3.29Å; D406-S410 WeakPolarHBondContact O-CB 3.39Å; D406-S410 PolarHBondContact O-N 2.97Å; D406-S410 PolarHBondContact O-OG 3.19Å; D406-V424 HydrophobicContact CB-CG2 4.15Å; D406-Y426 PolarHBondContact OD2-OH 3.09Å
407	L	73	Confident	65.8	Low	55 Å²	55	70.8 Å²	70.8	29%	0.288	39%	0.393	S	S	.	.	H	α-helix	trans	-66.9	-27.1	176.8	-71.9	167.8	0	0	0	113.7	T398 L403 F404 S410 Q411	T398-L407 HydrophobicContact CG2-CD1 3.69Å; L403-L407 HydrophobicContact CD1-CD1 4.18Å; L403-L407 HydrophobicContact CD1-CG 4.26Å; L403-L407 HydrophobicContact CG-CD1 3.9Å; L403-L407 HydrophobicContact CG-CG 4.42Å; L403-L407 WeakPolarHBondContact O-CB 3.41Å; L403-L407 VanDerWaalsContact O-CG 3.28Å; L403-L407 WeakPolarHBondContact O-CG 3.34Å; L403-L407 PolarHBondContact O-N 2.81Å; F404-L407 PolarHBondContact O-N 3.11Å; L407-S410 WeakPolarHBondContact CA-OG 3.24Å; L407-S410 PolarHBondContact O-OG 3.25Å; L407-Q411 PolarHBondContact O-NE2 3.46Å; L407-Q411 VanDerWaalsContact O-NE2 3.12Å
408	L	75.1	Confident	63	Low	90 Å²	90	79 Å²	79	47%	0.471	43%	0.43	S	S	.	.	H	α-helix	trans	-76.1	-41.9	168.4	-72	172	0	0	0	111.9	F404 D406 Q411 S412	F404-L408 HydrophobicContact CD1-CD1 3.77Å; F404-L408 HydrophobicContact CE1-CD1 3.46Å; F404-L408 VanDerWaalsContact CE1-CD1 3.46Å; F404-L408 HydrophobicContact CG-CD1 4.48Å; F404-L408 HydrophobicContact CZ-CD1 3.93Å; F404-L408 WeakPolarHBondContact O-CG 3.41Å; F404-L408 PolarHBondContact O-N 2.94Å; D406-L408 VanDerWaalsContact C-N 3.31Å; D406-L408 PolarHBondContact O-N 3.02Å; L408-Q411 PolarHBondContact O-N 3.1Å; L408-S412 PolarHBondContact O-N 2.92Å; L408-S412 PolarHBondContact O-OG 3.35Å
409	S	65.9	Low	60.7	Low	32 Å²	32	82.8 Å²	82.8	22%	0.224	45%	0.447	C	S	.	.	H	α-helix	trans	-70.3	-32.6	-179.2	73.4	0	0	0	0	113.4	S405 D406 Q411 S412	S405-S409 VanDerWaalsContact O-CB 3.29Å; S405-S409 WeakPolarHBondContact O-CB 3.29Å; S405-S409 PolarHBondContact O-N 3.19Å; S405-S409 PolarHBondContact O-OG 3.05Å; D406-S409 PolarHBondContact O-N 3.2Å; D406-S409 VanDerWaalsContact O-N 3.15Å; D406-S409 PolarHBondContact O-OG 3.29Å; S409-Q411 PolarHBondContact O-N 3.28Å; S409-S412 CarbonylContact O-C 3.58Å; S409-S412 VanDerWaalsContact O-C 3.31Å; S409-S412 PolarHBondContact O-N 3.3Å; S409-S412 VanDerWaalsContact O-O 3.09Å
410	S	56.8	Low	58.6	Low	83 Å²	83	89.8 Å²	89.8	58%	0.58	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-15.1	173.4	46.8	0	0	0	0	113.5	D406 L407	D406-S410 WeakPolarHBondContact O-CB 3.39Å; D406-S410 PolarHBondContact O-N 2.97Å; D406-S410 PolarHBondContact O-OG 3.19Å; L407-S410 WeakPolarHBondContact CA-OG 3.24Å; L407-S410 PolarHBondContact O-OG 3.25Å
411	Q	50.4	Low	57	Low	165 Å²	165	95.6 Å²	95.6	77%	0.771	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-7.9	167.3	-66	177.8	55.5	0	0	113.3	L407 L408 S409	L407-Q411 PolarHBondContact O-NE2 3.46Å; L407-Q411 VanDerWaalsContact O-NE2 3.12Å; L408-Q411 PolarHBondContact O-N 3.1Å; S409-Q411 PolarHBondContact O-N 3.28Å
412	S	38.9	Very low	55.7	Low	61 Å²	61	94.7 Å²	94.7	43%	0.427	50%	0.503	S	S	.	.	S	Bend	trans	-138.5	90.7	-171.6	52.2	0	0	0	0	113.2	L408 S409 S414	L408-S412 PolarHBondContact O-N 2.92Å; L408-S412 PolarHBondContact O-OG 3.35Å; S409-S412 CarbonylContact O-C 3.58Å; S409-S412 VanDerWaalsContact O-C 3.31Å; S409-S412 PolarHBondContact O-N 3.3Å; S409-S412 VanDerWaalsContact O-O 3.09Å; S412-S414 PolarHBondContact O-N 2.79Å; S412-S414 PolarHBondContact O-OG 3.09Å; S412-S414 VanDerWaalsContact O-OG 3.12Å
413	K	27.4	Very low	54.8	Low	223 Å²	223	100 Å²	100	97%	0.97	53%	0.528	S	S	*	.			trans	-51.2	93.8	-179	-70.2	-178.1	178.7	177.3	0	113.3
414	S	35	Very low	54.2	Low	85 Å²	85	101.3 Å²	101.3	59%	0.594	54%	0.535	S	S	*	.			trans	-152	152.8	175.3	58	0	0	0	0	109.6	S412 P416	S412-S414 PolarHBondContact O-N 2.79Å; S412-S414 PolarHBondContact O-OG 3.09Å; S412-S414 VanDerWaalsContact O-OG 3.12Å; S414-P416 WeakPolarHBondContact O-CD 3.36Å
415	V	29.1	Very low	53.4	Low	144 Å²	144	99.9 Å²	99.9	87%	0.873	53%	0.53	S	S	*	.			trans	-101.4	114.8	-171.2	179.7	0	0	0	0	110.5
416	P	35	Very low	52.5	Low	82 Å²	82	105.3 Å²	105.3	53%	0.532	55%	0.546	S	S	.	.			trans	-82.5	136.2	175.9	-11.8	30	0	0	0	112.1	S414	S414-P416 WeakPolarHBondContact O-CD 3.36Å
417	T	34.2	Very low	51.5	Low	132 Å²	132	104.3 Å²	104.3	81%	0.81	54%	0.542	S	S	*	.			trans	-73.6	148.4	179.1	47.3	0	0	0	0	113.5	N419	T417-N419 PolarHBondContact O-N 2.78Å
418	H	30.6	Very low	50.4	Low	187 Å²	187	105 Å²	105	87%	0.866	55%	0.551	S	S	*	*	S	Bend	trans	-66.2	98.1	-179.6	177.5	-71	0	0	0	113.2
419	N	39.2	Very low	49.3	Very low	139 Å²	139	102.3 Å²	102.3	74%	0.743	54%	0.539	S	S	*	.	S	Bend	trans	-150	139.1	161.9	-103.3	-31.1	0	0	0	109.7	T417 R421	T417-N419 PolarHBondContact O-N 2.78Å; N419-R421 VanDerWaalsContact C-N 3.31Å; N419-R421 PolarHBondContact O-N 3.11Å
420	Q	46.3	Very low	48.2	Very low	203 Å²	203	108 Å²	108	95%	0.949	57%	0.567	S	S	*	*			trans	-18.4	68.8	-175.9	-62.1	-178.7	-7.6	0	0	117.8
421	R	56.9	Low	47.3	Very low	122 Å²	122	108 Å²	108	46%	0.46	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-86.7	143	177.3	-157.8	172.9	-170.2	-164	-1.1	109.8	N419 E423	N419-R421 VanDerWaalsContact C-N 3.31Å; N419-R421 PolarHBondContact O-N 3.11Å; R421-E423 PolarHBondContact O-N 3.16Å
422	V	62.4	Low	46.4	Very low	41 Å²	41	106 Å²	106	25%	0.248	57%	0.565	C	S	.	*	P	Polyproline II helix	trans	-70.6	130.3	175.9	-171.1	0	0	0	0	109	V352 Q358 P402	V352-V422 HydrophobicContact CG1-CB 4.42Å; V352-V422 HydrophobicContact CG1-CG1 3.46Å; V352-V422 VanDerWaalsContact CG1-CG1 3.46Å; Q358-V422 VanDerWaalsContact NE2-CG2 3.34Å; P402-V422 HydrophobicContact CB-CB 3.94Å; P402-V422 HydrophobicContact CB-CG1 4.49Å; P402-V422 HydrophobicContact CG-CB 3.76Å; P402-V422 HydrophobicContact CG-CG1 4.28Å; P402-V422 HydrophobicContact CG-CG2 3.98Å
423	E	69.5	Low	46	Very low	114 Å²	114	110.9 Å²	110.9	53%	0.533	59%	0.585	S	S	.	*	P	Polyproline II helix	trans	-75.2	130.4	-174.1	-170.9	178.3	-138.2	0	0	111.6	R353 R421	R353-E423 HydrophobicContact CB-CB 4.46Å; R353-E423 WeakPolarHBondContact CB-O 3.43Å; R353-E423 WeakPolarHBondContact CD-OE2 3.43Å; R353-E423 IonicContact CZ-OE2 2.7Å; R353-E423 PolarHBondContact N-O 2.9Å; R353-E423 IonicContact NE-OE2 3.46Å; R353-E423 IonicContact NH1-OE1 2.71Å; R353-E423 IonicContact NH1-OE2 2.66Å; R353-E423 PolarHBondContact NH1-OE2 3.12Å; R421-E423 PolarHBondContact O-N 3.16Å
424	V	69.7	Low	46.1	Very low	28 Å²	28	105.3 Å²	105.3	17%	0.17	57%	0.566	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.5	121.4	169.2	177	0	0	0	0	108.4	P350 L403 D406 Y426	P350-V424 HydrophobicContact CB-CG1 4.11Å; L403-V424 HydrophobicContact CD1-CG1 3.87Å; L403-V424 HydrophobicContact CD1-CG2 4.42Å; D406-V424 HydrophobicContact CB-CG2 4.15Å; V424-Y426 HydrophobicContact CG1-CE2 4.11Å
425	E	68.7	Low	45.9	Very low	49 Å²	49	104.4 Å²	104.4	23%	0.229	56%	0.559	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.5	114.6	180	174.6	172.8	-143.1	0	0	110.2	P350 M351 R353 S427	P350-E425 WeakPolarHBondContact CA-O 3.1Å; M351-E425 PolarHBondContact N-O 3.06Å; M351-E425 PolarHBondContact O-N 3.09Å; R353-E425 HydrophobicContact CG-CB 3.85Å; R353-E425 WeakPolarHBondContact CG-OE2 3.29Å; R353-E425 IonicContact CZ-OE1 3.56Å; R353-E425 IonicContact CZ-OE2 3.17Å; R353-E425 IonicContact NE-OE1 2.72Å; R353-E425 PolarHBondContact NE-OE1 2.96Å; R353-E425 IonicContact NE-OE2 3.59Å; R353-E425 PolarHBondContact NE-OE2 2.88Å; R353-E425 VanDerWaalsContact NH2-CD 3.35Å; R353-E425 IonicContact NH2-OE1 2.87Å; R353-E425 PolarHBondContact NH2-OE1 3.09Å; R353-E425 IonicContact NH2-OE2 2.76Å; E425-S427 PolarHBondContact O-N 3.37Å; E425-S427 VanDerWaalsContact O-N 3.07Å
426	Y	60.8	Low	45.8	Very low	144 Å²	144	99.8 Å²	99.8	57%	0.565	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	84.3	171.4	-68.3	-92.1	0	0	0	109.7	P350 D406 V424	P350-Y426 HydrophobicContact CB-CD1 3.93Å; P350-Y426 HydrophobicContact CB-CE1 3.85Å; D406-Y426 PolarHBondContact OD2-OH 3.09Å; V424-Y426 HydrophobicContact CG1-CE2 4.11Å
427	S	56.3	Low	45.6	Very low	11 Å²	11	100 Å²	100	8%	0.077	54%	0.542	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	125.1	177.1	64.9	0	0	0	0	111.2	R349 E425	R349-S427 PolarHBondContact N-O 3Å; R349-S427 PolarHBondContact O-N 3.3Å; R349-S427 VanDerWaalsContact O-N 3.08Å; R349-S427 PolarHBondContact O-OG 3.07Å; E425-S427 PolarHBondContact O-N 3.37Å; E425-S427 VanDerWaalsContact O-N 3.07Å
428	S	49.7	Very low	45.6	Very low	70 Å²	70	102.9 Å²	102.9	49%	0.49	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	152.8	155.4	-167.4	0	0	0	0	108.7
429	V	52.5	Low	45.5	Very low	34 Å²	34	105.9 Å²	105.9	21%	0.206	55%	0.547	C	S	.	.	P	Polyproline II helix	trans	-88.2	132.8	158.6	-170.3	0	0	0	0	107.5	Y346 P347 V431	Y346-V429 HydrophobicContact CE2-CG2 3.94Å; P347-V429 HydrophobicContact CB-CB 4.28Å; P347-V429 PolarHBondContact O-N 2.66Å; V429-V431 PolarHBondContact O-N 2.99Å
430	D	42.1	Very low	45	Very low	152 Å²	152	110.7 Å²	110.7	81%	0.813	56%	0.555	S	S	*	*			trans	-69.6	96.9	167.9	-65	-63.8	0	0	0	108.4	P432	D430-P432 WeakPolarHBondContact O-CD 3.23Å
431	V	38.3	Very low	44.3	Very low	82 Å²	82	111 Å²	111	50%	0.497	55%	0.553	S	S	.	*			trans	-68.2	127.4	175.3	-179.1	0	0	0	0	107.8	P347 V429 L433	P347-V431 HydrophobicContact CB-CG2 4.36Å; P347-V431 HydrophobicContact CG-CG2 4.47Å; V429-V431 PolarHBondContact O-N 2.99Å; V431-L433 PolarHBondContact O-N 3.37Å
432	P	31.2	Very low	42.9	Very low	124 Å²	124	110 Å²	110	81%	0.805	57%	0.571	S	S	*	*			trans	-59.8	99.7	168.8	-23.1	34.9	0	0	0	109.5	D430 D434	D430-P432 WeakPolarHBondContact O-CD 3.23Å; P432-D434 VanDerWaalsContact C-N 3.3Å; P432-D434 PolarHBondContact O-N 2.57Å
433	L	30.8	Very low	41.2	Very low	163 Å²	163	120 Å²	120	85%	0.853	61%	0.605	S	S	*	*			trans	-79.7	82.9	178.2	-89.1	167.1	0	0	0	109.2	V431	V431-L433 PolarHBondContact O-N 3.37Å
434	D	30.8	Very low	39.4	Very low	106 Å²	106	124.2 Å²	124.2	57%	0.567	62%	0.621	S	S	*	*			trans	-66.4	147	165.5	-147.7	-32.5	0	0	0	110.7	P432 S436 N510	P432-D434 VanDerWaalsContact C-N 3.3Å; P432-D434 PolarHBondContact O-N 2.57Å; D434-S436 PolarHBondContact O-N 2.73Å; D434-N510 PolarHBondContact OD1-ND2 2.88Å
435	S	30.1	Very low	37.5	Very low	65 Å²	65	127.5 Å²	127.5	46%	0.455	65%	0.646	S	S	.	*	S	Bend	trans	38.2	65.2	163	31.4	0	0	0	0	118	N510	S435-N510 PolarHBondContact N-ND2 3.09Å
436	S	27.5	Very low	35.4	Very low	48 Å²	48	129.4 Å²	129.4	34%	0.336	67%	0.669	S	S	.	*			trans	48	96.5	132.7	-44.9	0	0	0	0	119.7	D434 I508	D434-S436 PolarHBondContact O-N 2.73Å; S436-I508 WeakPolarHBondContact CB-O 3.4Å; S436-I508 WeakPolarHBondContact O-CD1 3.44Å; S436-I508 WeakPolarHBondContact O-CG1 3.45Å; S436-I508 PolarHBondContact OG-O 2.54Å
437	A	30.6	Very low	33.9	Very low	87 Å²	87	129.6 Å²	129.6	72%	0.719	69%	0.686	S	S	*	*			trans	-151.2	116.9	159	0	0	0	0	0	115.5
438	K	32.6	Very low	32.6	Very low	191 Å²	191	132.9 Å²	132.9	83%	0.83	72%	0.722	S	S	*	*			trans	32.7	103.5	149.6	-61.9	167.7	-176.1	163.6	0	118.3
439	R	29.9	Very low	31.6	Very low	250 Å²	250	136.9 Å²	136.9	94%	0.943	74%	0.737	S	S	*	*				-163.2	107.4	114.4	-108.2	166.2	96.4	161.5	3.4	115
440	R	28.6	Very low	30.7	Very low	240 Å²	240	143.9 Å²	143.9	91%	0.906	77%	0.768	S	S	*	*			trans	-63.5	153.2	157.4	-72.3	171.4	163.2	164.2	-7.6	110.6
441	K	31	Very low	30.1	Very low	209 Å²	209	143.1 Å²	143.1	91%	0.909	76%	0.764	S	S	*	*			trans	108.1	92	160.9	-61.8	173.7	178.1	179.3	0	116.6
442	A	27.4	Very low	29.5	Very low	103 Å²	103	145.7 Å²	145.7	85%	0.851	78%	0.78	S	S	*	*			trans	-178	70.7	131.8	0	0	0	0	0	113.8
443	R	27.8	Very low	29.4	Very low	251 Å²	251	144.1 Å²	144.1	95%	0.947	78%	0.777	S	S	*	*			trans	-146.5	60.3	154.8	-121.5	176.5	-174	178.5	1.4	112.5
444	K	30	Very low	29.3	Very low	201 Å²	201	144.8 Å²	144.8	87%	0.874	78%	0.778	S	S	*	*			trans	-69.7	147	143.5	-78.5	-169.9	173	-170	0	107.6
445	S	30.1	Very low	29.1	Very low	98 Å²	98	144.6 Å²	144.6	69%	0.685	79%	0.785	S	S	*	*			cis	-156.2	153.3	-15.9	-83.5	0	0	0	0	107.9
446	A	25.8	Very low	29.1	Very low	88 Å²	88	148.2 Å²	148.2	73%	0.727	80%	0.804	S	S	*	*	S	Bend	trans	-97	157.3	151.9	0	0	0	0	0	109.3
447	T	29.3	Very low	29.2	Very low	149 Å²	149	157.3 Å²	157.3	91%	0.914	83%	0.831	S	S	*	*			trans	68.5	144.5	-174.3	76.4	0	0	0	0	115.6
448	G	28.8	Very low	29	Very low	80 Å²	80	156.9 Å²	156.9	83%	0.825	83%	0.828	S	S	*	*			trans	127.2	66.6	175.3	0	0	0	0	0	115.5
449	N	28.5	Very low	28.6	Very low	153 Å²	153	155.5 Å²	155.5	82%	0.818	83%	0.828	S	S	*	*			trans	-68.2	131.8	172.5	-106	-10.6	0	0	0	112.1
450	Q	33.1	Very low	28.5	Very low	182 Å²	182	148 Å²	148	85%	0.85	81%	0.814	S	S	*	*			trans	-170.6	106.8	134.8	-108.6	159.5	89.3	0	0	114.2
451	N	29	Very low	28.4	Very low	135 Å²	135	142.4 Å²	142.4	72%	0.722	81%	0.812	S	S	*	*			trans	47	139.4	132.9	-65.1	-3.8	0	0	0	123.6
452	T	27.4	Very low	28.3	Very low	137 Å²	137	135.4 Å²	135.4	84%	0.84	80%	0.799	S	S	*	*			trans	68.1	138.5	149.2	49.9	0	0	0	0	119.3
453	A	28.3	Very low	28.3	Very low	90 Å²	90	137.9 Å²	137.9	74%	0.744	80%	0.798	S	S	*	*			cis	-162	170.1	-13.7	0	0	0	0	0	111.4
454	M	28	Very low	28.2	Very low	177 Å²	177	129.6 Å²	129.6	87%	0.872	78%	0.779	S	S	*	*			trans	-58.3	157.1	155.9	-60.5	163.6	67	0	0	109.3
455	S	27.4	Very low	28.2	Very low	103 Å²	103	127 Å²	127	72%	0.72	77%	0.769	S	S	*	*			cis	-169.7	162.4	46.6	-170.8	0	0	0	0	112.4
456	V	29.5	Very low	28.1	Very low	140 Å²	140	129.5 Å²	129.5	85%	0.848	77%	0.768	S	S	*	*			trans	-93	105.9	170.7	179.5	0	0	0	0	110.9
457	R	29.4	Very low	28.2	Very low	240 Å²	240	131.3 Å²	131.3	91%	0.906	76%	0.764	S	S	*	*			trans	-152.9	143.4	147.1	-71.7	-170.6	-176.8	170	1.1	107.2
458	A	26.8	Very low	28	Very low	78 Å²	78	129.3 Å²	129.3	65%	0.645	76%	0.756	S	S	*	*			cis	-167.3	157.2	-20.7	0	0	0	0	0	107.1
459	L	25.5	Very low	27.9	Very low	162 Å²	162	131.8 Å²	131.8	85%	0.848	75%	0.75	S	S	*	*			trans	65.5	134.6	157.9	-69.3	161.9	0	0	0	120.9
460	S	26.7	Very low	27.9	Very low	93 Å²	93	129.3 Å²	129.3	65%	0.65	75%	0.745	S	S	*	*			trans	66.6	107.9	134.5	68.2	0	0	0	0	122.3
461	S	26.6	Very low	27.6	Very low	121 Å²	121	126.9 Å²	126.9	85%	0.846	74%	0.737	S	S	*	*				68.1	162.1	125	64.6	0	0	0	0	120.4
462	G	28.2	Very low	27.6	Very low	63 Å²	63	127.8 Å²	127.8	65%	0.649	74%	0.736	S	S	*	*			trans	102.4	97.2	-159.7	0	0	0	0	0	108
463	D	27.5	Very low	27.6	Very low	155 Å²	155	128.6 Å²	128.6	83%	0.829	73%	0.731	S	S	*	*				51.4	131.1	59.1	-79.6	-55.8	0	0	0	113.4
464	S	27.2	Very low	27.6	Very low	77 Å²	77	129.3 Å²	129.3	54%	0.538	73%	0.726	S	S	.	*			cis	-167.4	175.5	-12.1	-132.9	0	0	0	0	108.3
465	H	29.3	Very low	27.7	Very low	147 Å²	147	127.6 Å²	127.6	68%	0.681	72%	0.72	S	S	*	*			trans	65.7	166.5	158.3	-68.6	-16.2	0	0	0	115.8
466	K	28.1	Very low	28.1	Very low	149 Å²	149	131.3 Å²	131.3	65%	0.648	72%	0.723	S	S	*	*			cis	-157.5	165.9	-15.8	-115.7	161.5	-175.1	155.3	0	107.8
467	I	28.4	Very low	28.2	Very low	126 Å²	126	129 Å²	129	65%	0.646	71%	0.714	S	S	*	*			trans	53.3	102.8	147.1	-61.8	162.1	0	0	0	115.3
468	S	25	Very low	28.1	Very low	107 Å²	107	125.1 Å²	125.1	75%	0.748	71%	0.71	S	S	*	*			cis	59.1	68	42.6	93.6	0	0	0	0	115.2
469	N	26.8	Very low	28	Very low	132 Å²	132	125.4 Å²	125.4	71%	0.706	71%	0.707	S	S	*	*			trans	-159.2	137.7	146.6	-87.8	-36.4	0	0	0	106.9
470	S	27.5	Very low	28.1	Very low	102 Å²	102	124 Å²	124	71%	0.713	70%	0.7	S	S	*	*			cis	70.9	159	41.3	-160.8	0	0	0	0	112.8
471	I	26.5	Very low	28.1	Very low	130 Å²	130	128.9 Å²	128.9	67%	0.667	71%	0.706	S	S	*	*			trans	71.9	125.8	172.8	-56.7	-174.8	0	0	0	113.2
472	H	28.9	Very low	28.1	Very low	155 Å²	155	129.2 Å²	129.2	72%	0.718	70%	0.698	S	S	*	*			cis	-174.8	-167.1	-11.7	-131.4	-60.5	0	0	0	109
473	Q	28.6	Very low	27.9	Very low	154 Å²	154	131.8 Å²	131.8	72%	0.72	70%	0.697	S	S	*	*			trans	71.1	146	151	-71	150.1	33.2	0	0	117
474	T	27	Very low	27.9	Very low	104 Å²	104	132.5 Å²	132.5	64%	0.638	70%	0.696	S	S	*	*			cis	-159.1	157.9	-0.6	2.8	0	0	0	0	112.7
475	N	31.4	Very low	27.8	Very low	141 Å²	141	132.6 Å²	132.6	75%	0.754	70%	0.701	S	S	*	*			trans	70	136.8	154.3	-61.5	-26.9	0	0	0	117.1
476	K	35.1	Very low	27.6	Very low	181 Å²	181	132.5 Å²	132.5	79%	0.787	71%	0.705	S	S	*	*			cis	-152.6	139.9	18.2	-129.7	174.6	-176.1	179.5	0	111.9
477	S	31.4	Very low	27.4	Very low	93 Å²	93	133.9 Å²	133.9	65%	0.65	71%	0.711	S	S	*	*			trans	29.9	142.3	136.9	61.3	0	0	0	0	122.1
478	L	27	Very low	27.3	Very low	157 Å²	157	133.2 Å²	133.2	82%	0.822	71%	0.712	S	S	*	*			cis	-170.6	172.5	-10.5	-142.3	75.8	0	0	0	108.9
479	S	26.3	Very low	27.3	Very low	84 Å²	84	133.7 Å²	133.7	59%	0.587	71%	0.711	S	S	*	*			trans	5.7	153.6	148.5	64.5	0	0	0	0	121.5
480	N	27	Very low	27.4	Very low	133 Å²	133	132.2 Å²	132.2	71%	0.711	71%	0.711	S	S	*	*			cis	-173.2	175.4	-0.5	-108.7	3.5	0	0	0	108.9
481	Y	25.7	Very low	27.7	Very low	196 Å²	196	135.9 Å²	135.9	77%	0.769	71%	0.714	S	S	*	*			trans	64.9	122.7	155.5	-73.6	-59.4	0	0	0	120.9
482	N	26.5	Very low	27.8	Very low	127 Å²	127	139.5 Å²	139.5	68%	0.679	73%	0.725	S	S	*	*			trans	60.4	128.7	130.1	-65.5	13.3	0	0	0	123.1
483	N	25.8	Very low	28	Very low	118 Å²	118	135.9 Å²	135.9	63%	0.631	73%	0.73	S	S	*	*			trans	76	115.8	130.7	-69.1	37.7	0	0	0	121.7
484	E	26	Very low	28	Very low	170 Å²	170	134 Å²	134	79%	0.794	73%	0.734	S	S	*	*				78.4	139.5	120.8	-65.4	178.7	115.6	0	0	122.5
485	A	25.1	Very low	28.1	Very low	79 Å²	79	136.2 Å²	136.2	65%	0.653	74%	0.737	S	S	*	*			trans	69.9	105.3	136.3	0	0	0	0	0	121.2
486	L	25.7	Very low	28.1	Very low	144 Å²	144	137.5 Å²	137.5	75%	0.754	74%	0.735	S	S	*	*				62.3	128.7	116.4	-73.9	144.2	0	0	0	120.7
487	K	24.6	Very low	27.8	Very low	179 Å²	179	135.7 Å²	135.7	78%	0.778	74%	0.735	S	S	*	*			trans	72.6	150.3	147.8	-63.7	169.5	175.2	173	0	115.9
488	T	24.8	Very low	27.7	Very low	111 Å²	111	139.3 Å²	139.3	68%	0.681	75%	0.745	S	S	*	*			cis	-163.6	174.1	-9.7	16.7	0	0	0	0	110.1
489	T	26.2	Very low	27.7	Very low	118 Å²	118	137.6 Å²	137.6	72%	0.724	74%	0.736	S	S	*	*			trans	62.1	110.8	151.5	46.2	0	0	0	0	118.2
490	S	27.9	Very low	27.8	Very low	100 Å²	100	142.7 Å²	142.7	70%	0.699	75%	0.751	S	S	*	*				115.8	151.4	90	-84	0	0	0	0	110
491	K	34.6	Very low	27.9	Very low	180 Å²	180	144 Å²	144	78%	0.783	75%	0.753	S	S	*	*			cis	-157.7	138.1	17.6	-132.4	163.7	-174.8	173	0	111.4
492	K	29.2	Very low	27.9	Very low	206 Å²	206	140.5 Å²	140.5	90%	0.896	76%	0.755	S	S	*	*			trans	52.6	126.3	152	-69	-174.3	173.7	-166.9	0	121.7
493	G	33.2	Very low	28	Very low	79 Å²	79	141.4 Å²	141.4	81%	0.814	76%	0.759	S	S	*	*			trans	-171	97	160.9	0	0	0	0	0	112
494	S	28.5	Very low	28.1	Very low	115 Å²	115	141.3 Å²	141.3	80%	0.804	77%	0.768	S	S	*	*			trans	-59.1	155.7	178.8	36.9	0	0	0	0	114.8
495	E	29	Very low	28.5	Very low	150 Å²	150	139.7 Å²	139.7	70%	0.701	76%	0.763	S	S	*	*			cis	-162.8	156.7	8.5	-124.2	-179.7	169	0	0	114.7
496	K	31.5	Very low	28.8	Very low	167 Å²	167	141.8 Å²	141.8	73%	0.726	76%	0.764	S	S	*	*			trans	61.8	115	150.5	-73	155.3	-175.1	154.8	0	121.6
497	N	27.9	Very low	29.1	Very low	144 Å²	144	140.8 Å²	140.8	77%	0.77	77%	0.766	S	S	*	*			trans	-75.7	159.5	166.4	-52.1	-38.1	0	0	0	113
498	I	29.7	Very low	29.7	Very low	169 Å²	169	135.8 Å²	135.8	87%	0.867	75%	0.747	S	S	*	*				-132.2	137.6	127.7	-62.3	-174.9	0	0	0	107.1
499	N	26.6	Very low	30.5	Very low	120 Å²	120	134.3 Å²	134.3	64%	0.642	74%	0.738	S	S	*	*			trans	-93.8	137.5	176.6	-83.2	-20.9	0	0	0	111
500	E	28.8	Very low	31.8	Very low	192 Å²	192	129.6 Å²	129.6	90%	0.897	71%	0.708	S	S	*	*			trans	-115.2	110.9	148.4	-74.9	-169.5	148.6	0	0	108	C502	E500-C502 VanDerWaalsContact C-N 3.32Å; E500-C502 PolarHBondContact O-N 2.92Å
501	Q	28.6	Very low	33.1	Very low	161 Å²	161	128.8 Å²	128.8	75%	0.752	70%	0.696	S	S	*	*			trans	-80	79.5	-178.9	-75.3	-178	-22	0	0	111	L503	Q501-L503 VanDerWaalsContact C-N 3.32Å; Q501-L503 PolarHBondContact O-N 3.48Å
502	C	25.9	Very low	34.2	Very low	121 Å²	121	122.7 Å²	122.7	82%	0.818	68%	0.675	S	S	*	*			trans	-67.7	93.7	161.1	-170.3	0	0	0	0	108.7	E500 S504	E500-C502 VanDerWaalsContact C-N 3.32Å; E500-C502 PolarHBondContact O-N 2.92Å; C502-S504 PolarHBondContact O-N 2.72Å
503	L	29.5	Very low	35.6	Very low	146 Å²	146	117.6 Å²	117.6	76%	0.764	66%	0.655	S	S	*	*			trans	-62.2	108.5	174.6	-78	172.8	0	0	0	109.2	Q501 I505	Q501-L503 VanDerWaalsContact C-N 3.32Å; Q501-L503 PolarHBondContact O-N 3.48Å; L503-I505 VanDerWaalsContact C-N 3.27Å; L503-I505 PolarHBondContact O-N 2.89Å
504	S	27.6	Very low	36.8	Very low	116 Å²	116	115.7 Å²	115.7	81%	0.811	63%	0.626	S	S	*	*			trans	-74.2	82.8	174.1	34.2	0	0	0	0	109.4	C502 D506	C502-S504 PolarHBondContact O-N 2.72Å; S504-D506 PolarHBondContact O-N 2.85Å
505	I	34.4	Very low	38.5	Very low	136 Å²	136	112 Å²	112	70%	0.697	60%	0.596	S	S	*	*			trans	-57.3	125.8	171.9	-59.4	173.4	0	0	0	108.3	L503	L503-I505 VanDerWaalsContact C-N 3.27Å; L503-I505 PolarHBondContact O-N 2.89Å
506	D	30	Very low	40.1	Very low	124 Å²	124	108.5 Å²	108.5	66%	0.663	59%	0.588	S	S	*	*			trans	-55.9	133.9	176.9	-89.6	-62.8	0	0	0	110.7	S504 I508	S504-D506 PolarHBondContact O-N 2.85Å; D506-I508 PolarHBondContact O-N 2.98Å
507	P	32.1	Very low	41.6	Very low	123 Å²	123	102.3 Å²	102.3	80%	0.799	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	48	-172.7	34.1	-38.1	0	0	0	112.2
508	I	37	Very low	43.7	Very low	74 Å²	74	95.6 Å²	95.6	38%	0.379	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.6	-14.7	-168.6	-69.8	-168.5	0	0	0	112.9	S436 D506 N510	S436-I508 WeakPolarHBondContact CB-O 3.4Å; S436-I508 WeakPolarHBondContact O-CD1 3.44Å; S436-I508 WeakPolarHBondContact O-CG1 3.45Å; S436-I508 PolarHBondContact OG-O 2.54Å; D506-I508 PolarHBondContact O-N 2.98Å; I508-N510 PolarHBondContact O-N 3.12Å
509	T	41.9	Very low	46.2	Very low	79 Å²	79	89 Å²	89	49%	0.485	50%	0.497	S	S	.	.			trans	-51.4	123.1	176.1	-17	0	0	0	0	111.4	L511 L514	T509-L511 PolarHBondContact O-N 2.7Å; T509-L511 VanDerWaalsContact O-N 3.15Å; T509-L514 HydrophobicContact CG2-CD1 4.01Å
510	N	54.7	Low	49	Very low	19 Å²	19	87.7 Å²	87.7	10%	0.102	49%	0.485	C	S	.	.			trans	-76.3	106.5	-176.8	-173.2	-0.7	0	0	0	109.3	D434 S435 I508 S512 E513 L514	D434-N510 PolarHBondContact OD1-ND2 2.88Å; S435-N510 PolarHBondContact N-ND2 3.09Å; I508-N510 PolarHBondContact O-N 3.12Å; N510-S512 PolarHBondContact O-N 2.71Å; N510-S512 VanDerWaalsContact O-N 3.17Å; N510-S512 PolarHBondContact OD1-N 3.24Å; N510-S512 PolarHBondContact OD1-OG 3.33Å; N510-S512 VanDerWaalsContact OD1-OG 3.05Å; N510-E513 HydrophobicContact CB-CB 3.91Å; N510-E513 WeakPolarHBondContact O-CA 3.39Å; N510-E513 WeakPolarHBondContact O-CB 3.33Å; N510-E513 PolarHBondContact O-N 3.21Å; N510-L514 PolarHBondContact O-N 2.94Å
511	L	55.4	Low	51.7	Low	84 Å²	84	80.4 Å²	80.4	44%	0.44	45%	0.454	S	S	.	.	H	α-helix	trans	-59.6	-30.9	-174.1	-72.7	160.1	0	0	0	113.3	T509 E513 L514 E515 V670 A784	T509-L511 PolarHBondContact O-N 2.7Å; T509-L511 VanDerWaalsContact O-N 3.15Å; L511-E513 VanDerWaalsContact C-N 3.3Å; L511-L514 HydrophobicContact CD2-CD1 4.47Å; L511-L514 PolarHBondContact O-N 2.91Å; L511-E515 WeakPolarHBondContact O-CG 3.46Å; L511-E515 PolarHBondContact O-N 2.86Å; L511-V670 HydrophobicContact CD2-CG1 3.96Å; L511-A784 HydrophobicContact CB-CB 3.68Å
512	S	57	Low	54.3	Low	51 Å²	51	75.2 Å²	75.2	36%	0.357	44%	0.435	S	S	.	.	H	α-helix	trans	-77	-16.2	175.4	56.3	0	0	0	0	114.1	N510 E515 S516	N510-S512 PolarHBondContact O-N 2.71Å; N510-S512 VanDerWaalsContact O-N 3.17Å; N510-S512 PolarHBondContact OD1-N 3.24Å; N510-S512 PolarHBondContact OD1-OG 3.33Å; N510-S512 VanDerWaalsContact OD1-OG 3.05Å; S512-E515 VanDerWaalsContact CA-OE1 3.24Å; S512-E515 WeakPolarHBondContact CA-OE1 3.47Å; S512-E515 WeakPolarHBondContact CB-OE1 3.29Å; S512-S516 PolarHBondContact O-N 3.06Å; S512-S516 PolarHBondContact O-OG 3.39Å
513	E	58.6	Low	57.1	Low	99 Å²	99	72.2 Å²	72.2	46%	0.463	41%	0.407	S	S	.	.	H	α-helix	trans	-69	-49.8	167.1	-158.9	170.3	-158.5	0	0	108.3	N510 L511 E515 S516 T517	N510-E513 HydrophobicContact CB-CB 3.91Å; N510-E513 WeakPolarHBondContact O-CA 3.39Å; N510-E513 WeakPolarHBondContact O-CB 3.33Å; N510-E513 PolarHBondContact O-N 3.21Å; L511-E513 VanDerWaalsContact C-N 3.3Å; E513-E515 VanDerWaalsContact C-N 3.26Å; E513-E515 PolarHBondContact O-N 2.85Å; E513-S516 CarbonylContact O-C 3.54Å; E513-S516 WeakPolarHBondContact O-CA 3.21Å; E513-S516 PolarHBondContact O-N 2.83Å; E513-S516 PolarHBondContact O-OG 2.95Å; E513-T517 HydrophobicContact CG-CG2 4.16Å; E513-T517 WeakPolarHBondContact O-CG2 3.43Å; E513-T517 PolarHBondContact O-N 3.19Å; E513-T517 PolarHBondContact O-OG1 2.97Å
514	L	58.4	Low	59.5	Low	39 Å²	39	65.8 Å²	65.8	20%	0.204	37%	0.374	C	S	.	.	H	α-helix	trans	-58.9	-28.3	175.5	-74.9	155.4	0	0	0	114.7	T509 N510 L511 S516 T517 S669	T509-L514 HydrophobicContact CG2-CD1 4.01Å; N510-L514 PolarHBondContact O-N 2.94Å; L511-L514 HydrophobicContact CD2-CD1 4.47Å; L511-L514 PolarHBondContact O-N 2.91Å; L514-S516 VanDerWaalsContact C-N 3.33Å; L514-T517 WeakPolarHBondContact CA-OG1 3.22Å; L514-T517 PolarHBondContact O-OG1 2.84Å; L514-S669 VanDerWaalsContact O-CB 3.24Å; L514-S669 WeakPolarHBondContact O-CB 3.37Å
515	E	63.2	Low	61.7	Low	38 Å²	38	62.7 Å²	62.7	18%	0.178	35%	0.348	C	S	.	.	H	α-helix	trans	-67.5	-33.7	170.9	-65.4	178.6	-102.7	0	0	112.9	L511 S512 E513 V670 T783 A784 R791	L511-E515 WeakPolarHBondContact O-CG 3.46Å; L511-E515 PolarHBondContact O-N 2.86Å; S512-E515 VanDerWaalsContact CA-OE1 3.24Å; S512-E515 WeakPolarHBondContact CA-OE1 3.47Å; S512-E515 WeakPolarHBondContact CB-OE1 3.29Å; E513-E515 VanDerWaalsContact C-N 3.26Å; E513-E515 PolarHBondContact O-N 2.85Å; E515-V670 HydrophobicContact CG-CG2 3.92Å; E515-T783 WeakPolarHBondContact OE2-CA 3.37Å; E515-T783 WeakPolarHBondContact OE2-CB 3.42Å; E515-A784 HydrophobicContact CG-CB 3.86Å; E515-A784 VanDerWaalsContact OE1-CB 3.26Å; E515-A784 WeakPolarHBondContact OE1-CB 3.45Å; E515-A784 PolarHBondContact OE1-N 3.02Å; E515-A784 PolarHBondContact OE2-N 3.11Å; E515-R791 PolarHBondContact O-NH1 2.81Å
516	S	62.5	Low	63.5	Low	76 Å²	76	61.2 Å²	61.2	53%	0.531	34%	0.341	S	S	.	.	H	α-helix	trans	-114.1	-9.3	-165.1	60.6	0	0	0	0	114.8	S512 E513 L514 G518	S512-S516 PolarHBondContact O-N 3.06Å; S512-S516 PolarHBondContact O-OG 3.39Å; E513-S516 CarbonylContact O-C 3.54Å; E513-S516 WeakPolarHBondContact O-CA 3.21Å; E513-S516 PolarHBondContact O-N 2.83Å; E513-S516 PolarHBondContact O-OG 2.95Å; L514-S516 VanDerWaalsContact C-N 3.33Å; S516-G518 VanDerWaalsContact C-N 3.35Å; S516-G518 PolarHBondContact O-N 3.26Å
517	T	63.1	Low	65.6	Low	38 Å²	38	56.1 Å²	56.1	23%	0.233	31%	0.314	C	S	.	.			trans	-61.4	90.4	170.5	42.1	0	0	0	0	110.7	E513 L514 E646	E513-T517 HydrophobicContact CG-CG2 4.16Å; E513-T517 WeakPolarHBondContact O-CG2 3.43Å; E513-T517 PolarHBondContact O-N 3.19Å; E513-T517 PolarHBondContact O-OG1 2.97Å; L514-T517 WeakPolarHBondContact CA-OG1 3.22Å; L514-T517 PolarHBondContact O-OG1 2.84Å; T517-E646 PolarHBondContact O-N 2.66Å
518	G	73.1	Confident	67.5	Low	3 Å²	3	50.9 Å²	50.9	3%	0.031	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	138	175	0	0	0	0	0	111.1	S516 F643 R644	S516-G518 VanDerWaalsContact C-N 3.35Å; S516-G518 PolarHBondContact O-N 3.26Å; G518-F643 VanDerWaalsContact CA-CZ 3.48Å; G518-R644 CarbonylContact C-O 3.47Å; G518-R644 WeakPolarHBondContact CA-O 3.22Å
519	T	81.9	Confident	68.9	Low	30 Å²	30	54.9 Å²	54.9	18%	0.184	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	152.4	-178.6	64.6	0	0	0	0	110.2	S162 T521 F643 R644 E646	S162-T519 WeakPolarHBondContact OG-CG2 3.42Å; T519-T521 WeakPolarHBondContact OG1-CG2 3.45Å; T519-F643 WeakPolarHBondContact O-CA 3.22Å; T519-R644 PolarHBondContact N-O 2.86Å; T519-R644 PolarHBondContact O-N 2.92Å; T519-E646 HydrophobicContact CG2-CG 3.95Å; T519-E646 WeakPolarHBondContact CG2-OE1 3.27Å
520	K	85.3	Confident	70.1	Confident	93 Å²	93	54.4 Å²	54.4	40%	0.404	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	95.2	167.3	-70.5	-161.4	177.3	-165	0	108.3	Q641 E642	K520-Q641 HydrophobicContact CB-CB 4.49Å; K520-Q641 VanDerWaalsContact CD-OE1 3.27Å; K520-E642 CarbonylContact C-O 3.47Å; K520-E642 WeakPolarHBondContact CA-O 3.44Å
521	T	84.5	Confident	70.8	Confident	39 Å²	39	54.5 Å²	54.5	24%	0.239	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	131.9	179.6	53.8	0	0	0	0	110.4	T519 E642 R644	T519-T521 WeakPolarHBondContact OG1-CG2 3.45Å; T521-E642 PolarHBondContact N-O 3.27Å; T521-E642 PolarHBondContact O-N 3.41Å; T521-E642 PolarHBondContact OG1-O 3.02Å; T521-R644 VanDerWaalsContact OG1-CD 3.3Å; T521-R644 WeakPolarHBondContact OG1-CD 3.38Å; T521-R644 PolarHBondContact OG1-NE 3.2Å
522	S	83.9	Confident	71.2	Confident	51 Å²	51	56.5 Å²	56.5	36%	0.357	30%	0.296	S	S	.	.			trans	-75.5	146.4	159.4	-67.3	0	0	0	0	110	R133 D525 N640	R133-S522 PolarHBondContact NH2-OG 3.22Å; S522-D525 WeakPolarHBondContact CB-OD1 3.26Å; S522-N640 WeakPolarHBondContact CA-O 2.68Å; S522-N640 VanDerWaalsContact CA-OD1 3.3Å; S522-N640 WeakPolarHBondContact CA-OD1 3.27Å; S522-N640 WeakPolarHBondContact CB-O 3.35Å; S522-N640 VanDerWaalsContact CB-OD1 3.29Å; S522-N640 WeakPolarHBondContact CB-OD1 3.42Å; S522-N640 PolarHBondContact OG-O 3.45Å
523	Y	84.3	Confident	71.6	Confident	59 Å²	59	57.3 Å²	57.3	23%	0.231	29%	0.292	C	S	.	.			trans	-143.8	-18.6	-168.8	65.2	-82.8	0	0	0	113.7	D525 N572 E575 N640 E642 N794	Y523-D525 PolarHBondContact O-N 2.84Å; Y523-N572 PolarHBondContact OH-ND2 2.95Å; Y523-E575 WeakPolarHBondContact CE2-OE2 3.49Å; Y523-E575 PolarHBondContact OH-OE2 3Å; Y523-N640 PolarHBondContact N-OD1 2.97Å; Y523-E642 HydrophobicContact CD1-CB 3.7Å; Y523-E642 HydrophobicContact CE1-CB 3.68Å; Y523-N794 PolarHBondContact OH-ND2 3.13Å
524	L	81.1	Confident	72.3	Confident	11 Å²	11	56.3 Å²	56.3	6%	0.058	29%	0.286	C	S	.	.			trans	-85.5	9.5	175.4	-56.8	175.3	0	0	0	112.9	N526 L527 F528 E575 F578 I639 N640	L524-N526 PolarHBondContact O-N 2.86Å; L524-N526 VanDerWaalsContact O-N 3.14Å; L524-L527 HydrophobicContact CD2-CD2 4.07Å; L524-L527 WeakPolarHBondContact O-CB 3.23Å; L524-L527 PolarHBondContact O-N 3.36Å; L524-F528 HydrophobicContact CB-CD1 3.83Å; L524-F528 HydrophobicContact CB-CE1 3.47Å; L524-F528 VanDerWaalsContact CB-CE1 3.47Å; L524-F528 HydrophobicContact CB-CE2 4.23Å; L524-F528 HydrophobicContact CB-CG 4.35Å; L524-F528 HydrophobicContact CB-CZ 3.7Å; L524-F528 HydrophobicContact CD1-CE1 3.77Å; L524-F528 HydrophobicContact CD1-CZ 3.75Å; L524-F528 HydrophobicContact CG-CE1 4.25Å; L524-F528 HydrophobicContact CG-CZ 4.38Å; L524-F528 WeakPolarHBondContact O-CB 3.33Å; L524-F528 VanDerWaalsContact O-CD1 3.31Å; L524-F528 WeakPolarHBondContact O-CD1 3.14Å; L524-F528 VanDerWaalsContact O-CG 3.27Å; L524-F528 WeakPolarHBondContact O-CG 3.12Å; L524-F528 PolarHBondContact O-N 2.8Å; L524-E575 HydrophobicContact CD1-CB 3.94Å; L524-F578 HydrophobicContact CD1-CD2 4.42Å; L524-I639 HydrophobicContact CD1-CG2 4.46Å; L524-N640 HydrophobicContact CB-CB 4.18Å; L524-N640 HydrophobicContact CD1-CB 4.18Å; L524-N640 HydrophobicContact CG-CB 4.41Å; L524-N640 PolarHBondContact N-OD1 2.74Å
525	D	73.5	Confident	73.2	Confident	50 Å²	50	58.3 Å²	58.3	27%	0.267	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-26.1	-171.7	-73.9	43.7	0	0	0	114.7	R133 S522 Y523 K529 N640	R133-D525 IonicContact CZ-OD1 3.96Å; R133-D525 IonicContact CZ-OD2 2.67Å; R133-D525 VanDerWaalsContact CZ-OD2 3.24Å; R133-D525 IonicContact NH1-OD1 2.9Å; R133-D525 IonicContact NH1-OD2 2.8Å; R133-D525 PolarHBondContact NH1-OD2 3.38Å; R133-D525 IonicContact NH2-OD1 3.8Å; R133-D525 PolarHBondContact NH2-OD1 3.03Å; R133-D525 IonicContact NH2-OD2 2.76Å; R133-D525 PolarHBondContact NH2-OD2 2.89Å; S522-D525 WeakPolarHBondContact CB-OD1 3.26Å; Y523-D525 PolarHBondContact O-N 2.84Å; D525-K529 WeakPolarHBondContact O-CD 3.36Å; D525-K529 VanDerWaalsContact O-CE 3.23Å; D525-K529 WeakPolarHBondContact O-CE 3.46Å; D525-K529 WeakPolarHBondContact O-CG 3.43Å; D525-N640 PolarHBondContact OD1-ND2 3.15Å
526	N	72.3	Confident	74.2	Confident	106 Å²	106	60.7 Å²	60.7	57%	0.567	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-44.5	175.7	-67.9	-20.6	0	0	0	111.3	L524 F528 K529 E530	L524-N526 PolarHBondContact O-N 2.86Å; L524-N526 VanDerWaalsContact O-N 3.14Å; N526-F528 PolarHBondContact O-N 3.45Å; N526-K529 WeakPolarHBondContact O-CB 3.42Å; N526-K529 PolarHBondContact O-N 3.49Å; N526-K529 PolarHBondContact OD1-NZ 2.76Å; N526-E530 PolarHBondContact O-N 3.12Å
527	L	74.1	Confident	75.3	Confident	17 Å²	17	63.4 Å²	63.4	9%	0.089	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-52.4	-40.2	169.9	-179.7	70.5	0	0	0	111.3	L524 K529 E530 F531 L560 F578	L524-L527 HydrophobicContact CD2-CD2 4.07Å; L524-L527 WeakPolarHBondContact O-CB 3.23Å; L524-L527 PolarHBondContact O-N 3.36Å; L527-K529 PolarHBondContact O-N 2.9Å; L527-E530 PolarHBondContact O-N 2.88Å; L527-E530 VanDerWaalsContact O-N 3.09Å; L527-F531 HydrophobicContact CD1-CE2 4.35Å; L527-F531 HydrophobicContact CD1-CZ 3.88Å; L527-F531 HydrophobicContact CD2-CE2 4.3Å; L527-F531 HydrophobicContact CD2-CZ 4.25Å; L527-F531 HydrophobicContact CG-CE2 3.78Å; L527-F531 HydrophobicContact CG-CZ 3.77Å; L527-F531 WeakPolarHBondContact O-CD2 3.37Å; L527-F531 WeakPolarHBondContact O-CE2 3.14Å; L527-L560 HydrophobicContact CD1-CD2 3.75Å; L527-F578 HydrophobicContact CD2-CB 4.08Å
528	F	70.7	Confident	76.5	Confident	12 Å²	12	67.4 Å²	67.4	5%	0.053	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-72.1	-9.8	-179.7	-68.9	6.1	0	0	0	114.1	F130 D131 L524 N526 F531 F578 N640	F130-F528 AromaticContact CD1-CD2 3.79Å; F130-F528 HydrophobicContact CD1-CD2 3.79Å; F130-F528 AromaticContact CD1-CE2 3.91Å; F130-F528 HydrophobicContact CD1-CE2 3.91Å; F130-F528 HydrophobicContact CD1-CG 4.16Å; F130-F528 HydrophobicContact CD1-CZ 4.41Å; F130-F528 HydrophobicContact CE1-CB 4.38Å; F130-F528 AromaticContact CE1-CD1 3.66Å; F130-F528 HydrophobicContact CE1-CD1 3.66Å; F130-F528 AromaticContact CE1-CD2 3.56Å; F130-F528 HydrophobicContact CE1-CD2 3.56Å; F130-F528 AromaticContact CE1-CE1 3.68Å; F130-F528 HydrophobicContact CE1-CE1 3.68Å; F130-F528 AromaticContact CE1-CE2 3.57Å; F130-F528 HydrophobicContact CE1-CE2 3.57Å; F130-F528 AromaticContact CE1-CG 3.61Å; F130-F528 HydrophobicContact CE1-CG 3.61Å; F130-F528 AromaticContact CE1-CZ 3.63Å; F130-F528 HydrophobicContact CE1-CZ 3.63Å; F130-F528 HydrophobicContact CZ-CD1 4.29Å; F130-F528 HydrophobicContact CZ-CE1 4.3Å; D131-F528 HydrophobicContact CB-CE2 4.19Å; L524-F528 HydrophobicContact CB-CD1 3.83Å; L524-F528 HydrophobicContact CB-CE1 3.47Å; L524-F528 VanDerWaalsContact CB-CE1 3.47Å; L524-F528 HydrophobicContact CB-CE2 4.23Å; L524-F528 HydrophobicContact CB-CG 4.35Å; L524-F528 HydrophobicContact CB-CZ 3.7Å; L524-F528 HydrophobicContact CD1-CE1 3.77Å; L524-F528 HydrophobicContact CD1-CZ 3.75Å; L524-F528 HydrophobicContact CG-CE1 4.25Å; L524-F528 HydrophobicContact CG-CZ 4.38Å; L524-F528 WeakPolarHBondContact O-CB 3.33Å; L524-F528 VanDerWaalsContact O-CD1 3.31Å; L524-F528 WeakPolarHBondContact O-CD1 3.14Å; L524-F528 VanDerWaalsContact O-CG 3.27Å; L524-F528 WeakPolarHBondContact O-CG 3.12Å; L524-F528 PolarHBondContact O-N 2.8Å; N526-F528 PolarHBondContact O-N 3.45Å; F528-F531 HydrophobicContact CD1-CD2 4.35Å; F528-F531 HydrophobicContact CD1-CE2 4.01Å; F528-F578 HydrophobicContact CE1-CD2 4.06Å; F528-F578 HydrophobicContact CE1-CE2 4.13Å; F528-F578 HydrophobicContact CE1-CG 4.35Å; F528-F578 HydrophobicContact CE1-CZ 4.47Å; F528-F578 HydrophobicContact CZ-CD2 4.46Å; F528-F578 HydrophobicContact CZ-CE2 4.09Å; F528-F578 HydrophobicContact CZ-CZ 4.32Å; F528-N640 HydrophobicContact CD2-CB 4.48Å; F528-N640 HydrophobicContact CE2-CB 3.47Å; F528-N640 VanDerWaalsContact CE2-CB 3.47Å; F528-N640 VanDerWaalsContact CE2-ND2 3.33Å; F528-N640 WeakPolarHBondContact CE2-ND2 3.27Å; F528-N640 HydrophobicContact CZ-CB 3.71Å
529	K	68.1	Low	77.3	Confident	158 Å²	158	69.5 Å²	69.5	69%	0.687	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-92.4	-14.2	170.2	-63.2	162.4	-167.2	162.8	0	112.7	D525 N526 L527 F531	D525-K529 WeakPolarHBondContact O-CD 3.36Å; D525-K529 VanDerWaalsContact O-CE 3.23Å; D525-K529 WeakPolarHBondContact O-CE 3.46Å; D525-K529 WeakPolarHBondContact O-CG 3.43Å; N526-K529 WeakPolarHBondContact O-CB 3.42Å; N526-K529 PolarHBondContact O-N 3.49Å; N526-K529 PolarHBondContact OD1-NZ 2.76Å; L527-K529 PolarHBondContact O-N 2.9Å; K529-F531 VanDerWaalsContact C-N 3.32Å
530	E	67.2	Low	77.7	Confident	70 Å²	70	77.1 Å²	77.1	33%	0.327	38%	0.384	S	S	.	.	S	Bend	trans	-88.3	0.4	179.8	-64.4	174	-166.9	0	0	112.6	N526 L527 Y549 L560	N526-E530 PolarHBondContact O-N 3.12Å; L527-E530 PolarHBondContact O-N 2.88Å; L527-E530 VanDerWaalsContact O-N 3.09Å; E530-Y549 PolarHBondContact O-OH 2.98Å; E530-Y549 VanDerWaalsContact O-OH 3.09Å; E530-L560 WeakPolarHBondContact OE2-CD1 3.33Å
531	F	67.8	Low	77.9	Confident	21 Å²	21	72.9 Å²	72.9	9%	0.092	37%	0.367	C	S	.	.			trans	-99	96.9	-176.9	-70	-47.5	0	0	0	113.8	F130 L527 F528 K529 Y549 F578 L583	F130-F531 HydrophobicContact CZ-CD2 4.02Å; F130-F531 HydrophobicContact CZ-CE2 4.33Å; L527-F531 HydrophobicContact CD1-CE2 4.35Å; L527-F531 HydrophobicContact CD1-CZ 3.88Å; L527-F531 HydrophobicContact CD2-CE2 4.3Å; L527-F531 HydrophobicContact CD2-CZ 4.25Å; L527-F531 HydrophobicContact CG-CE2 3.78Å; L527-F531 HydrophobicContact CG-CZ 3.77Å; L527-F531 WeakPolarHBondContact O-CD2 3.37Å; L527-F531 WeakPolarHBondContact O-CE2 3.14Å; F528-F531 HydrophobicContact CD1-CD2 4.35Å; F528-F531 HydrophobicContact CD1-CE2 4.01Å; K529-F531 VanDerWaalsContact C-N 3.32Å; F531-Y549 HydrophobicContact CD1-CE2 4.42Å; F531-Y549 AromaticContact CD1-CZ 4Å; F531-Y549 VanDerWaalsContact CD1-OH 3.29Å; F531-Y549 WeakPolarHBondContact CD1-OH 3.12Å; F531-F578 VanDerWaalsContact CE1-O 3.32Å; F531-F578 WeakPolarHBondContact CE1-O 3.36Å; F531-F578 HydrophobicContact CE2-CB 4.01Å; F531-F578 HydrophobicContact CE2-CD1 4.39Å; F531-F578 HydrophobicContact CE2-CG 4.47Å; F531-F578 HydrophobicContact CZ-CB 3.74Å; F531-F578 WeakPolarHBondContact CZ-O 3.46Å; F531-L583 HydrophobicContact CB-CD2 3.64Å; F531-L583 HydrophobicContact CD1-CD2 3.61Å; F531-L583 HydrophobicContact CD2-CD2 3.79Å; F531-L583 HydrophobicContact CE1-CD2 4.25Å; F531-L583 HydrophobicContact CE2-CD2 4.39Å; F531-L583 HydrophobicContact CG-CD2 3.4Å; F531-L583 VanDerWaalsContact CG-CD2 3.4Å
532	D	64.1	Low	78.3	Confident	126 Å²	126	71.6 Å²	71.6	67%	0.674	36%	0.362	S	S	*	.			trans	-72.1	138.3	162.9	-64.3	-45.3	0	0	0	111	K534	D532-K534 PolarHBondContact O-N 2.82Å
533	Y	66.6	Low	78.6	Confident	68 Å²	68	73.4 Å²	73.4	27%	0.267	36%	0.364	S	S	.	.			trans	-78.7	108.8	174	171.1	-101.4	0	0	0	110.6	R128 L137 P535	R128-Y533 PolarHBondContact NH1-OH 2.67Å; L137-Y533 HydrophobicContact CD1-CD2 4.23Å; L137-Y533 HydrophobicContact CD1-CG 4.2Å; Y533-P535 HydrophobicContact CE1-CB 4.48Å; Y533-P535 HydrophobicContact CE1-CG 4.34Å; Y533-P535 WeakPolarHBondContact O-CD 3.38Å
534	K	73.1	Confident	78.8	Confident	78 Å²	78	76.3 Å²	76.3	34%	0.339	38%	0.376	S	S	.	.			trans	-76.6	119.7	168.4	-175	164.4	-175	170.3	0	110.7	D532 G606	D532-K534 PolarHBondContact O-N 2.82Å; K534-G606 WeakPolarHBondContact O-CA 3.32Å
535	P	76.5	Confident	79.2	Confident	80 Å²	80	75.8 Å²	75.8	52%	0.519	37%	0.373	S	S	.	.			trans	-61.1	155.5	170.8	-21.9	34.9	0	0	0	112	Y533 E537	Y533-P535 HydrophobicContact CE1-CB 4.48Å; Y533-P535 HydrophobicContact CE1-CG 4.34Å; Y533-P535 WeakPolarHBondContact O-CD 3.38Å; P535-E537 PolarHBondContact O-N 2.87Å
536	F	85	Confident	79.8	Confident	89 Å²	89	74 Å²	74	39%	0.39	36%	0.363	S	S	.	.			trans	-83.2	105.2	174.9	179.9	-107.9	0	0	0	111.2	H539 R607	F536-H539 AromaticContact CD2-CE1 4Å; F536-H539 AromaticContact CE2-CE1 3.44Å; F536-H539 VanDerWaalsContact CE2-CE1 3.44Å; F536-H539 WeakPolarHBondContact CE2-CE1 3.49Å; F536-H539 AromaticContact CE2-ND1 3.69Å; F536-R607 HydrophobicContact CD2-CB 3.77Å; F536-R607 HydrophobicContact CD2-CG 4.4Å; F536-R607 HydrophobicContact CE2-CB 3.75Å; F536-R607 HydrophobicContact CE2-CG 4.1Å
537	E	85.4	Confident	79.8	Confident	133 Å²	133	75.4 Å²	75.4	62%	0.621	36%	0.364	S	S	*	.			trans	-75.3	139.8	163.3	-67.8	159.1	-157.1	0	0	109.8	P535 H539	P535-E537 PolarHBondContact O-N 2.87Å; E537-H539 PolarHBondContact O-N 3.15Å; E537-H539 PolarHBondContact O-ND1 3.31Å
538	S	88	Confident	79.1	Confident	122 Å²	122	76.3 Å²	76.3	85%	0.853	37%	0.372	S	S	*	.			trans	-72.3	113.4	-175.7	-169.6	0	0	0	0	112.4
539	H	90.2	Very high	78.5	Confident	46 Å²	46	78.1 Å²	78.1	21%	0.213	38%	0.379	C	S	.	.			trans	-150	154.7	-179.7	65	-83.4	0	0	0	114	F536 E537 C541 Y544 C545	F536-H539 AromaticContact CD2-CE1 4Å; F536-H539 AromaticContact CE2-CE1 3.44Å; F536-H539 VanDerWaalsContact CE2-CE1 3.44Å; F536-H539 WeakPolarHBondContact CE2-CE1 3.49Å; F536-H539 AromaticContact CE2-ND1 3.69Å; E537-H539 PolarHBondContact O-N 3.15Å; E537-H539 PolarHBondContact O-ND1 3.31Å; H539-C541 PolarHBondContact NE2-SG 3.07Å; H539-C541 PolarHBondContact O-N 2.76Å; H539-C541 VanDerWaalsContact O-N 3.12Å; H539-Y544 AromaticContact CD2-CE2 3.73Å; H539-Y544 AromaticContact CD2-CZ 3.89Å; H539-Y544 PolarHBondContact CD2-OH 3.02Å; H539-C545 VanDerWaalsContact CD2-SG 3.58Å; H539-C545 PolarHBondContact NE2-SG 2.81Å
540	K	91	Very high	77.7	Confident	190 Å²	190	80.7 Å²	80.7	83%	0.826	38%	0.384	S	S	*	.			trans	-78.8	89.1	171.8	-75.3	-176.8	178.2	178.5	0	109.8	Y544	K540-Y544 VanDerWaalsContact C-OH 3.29Å; K540-Y544 PolarHBondContact O-OH 3.16Å
541	C	89.4	Confident	77	Confident	4 Å²	4	81.2 Å²	81.2	3%	0.027	39%	0.385	C	S	.	.			trans	-49.3	139.4	-174.2	-48.7	0	0	0	0	114.3	H539 C545 R607 F618 K621	H539-C541 PolarHBondContact NE2-SG 3.07Å; H539-C541 PolarHBondContact O-N 2.76Å; H539-C541 VanDerWaalsContact O-N 3.12Å; C541-C545 WeakPolarHBondContact CA-SG 3.31Å; C541-R607 VanDerWaalsContact SG-CD 3.51Å; C541-R607 PolarHBondContact SG-NH1 3.14Å; C541-R607 VanDerWaalsContact SG-NH1 3.36Å; C541-F618 HydrophobicContact CB-CE2 4.1Å; C541-K621 WeakPolarHBondContact O-CD 3.4Å; C541-K621 WeakPolarHBondContact O-CE 3.48Å; C541-K621 PolarHBondContact O-NZ 2.74Å
542	G	91.3	Very high	75.9	Confident	13 Å²	13	82.5 Å²	82.5	13%	0.134	40%	0.396	C	S	.	.			trans	-163.9	-167.4	179.6	0	0	0	0	0	110.2	Y544 C545 T622	G542-Y544 PolarHBondContact O-N 2.79Å; G542-C545 PolarHBondContact N-SG 3.26Å; G542-C545 WeakPolarHBondContact O-CB 3.31Å; G542-C545 PolarHBondContact O-N 3.31Å; G542-C545 PolarHBondContact O-SG 3.1Å; G542-T622 WeakPolarHBondContact O-CG2 3.33Å
543	H	90.8	Very high	75.1	Confident	89 Å²	89	83.1 Å²	83.1	41%	0.412	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-56.2	-27.9	-169.8	-176.2	69.6	0	0	0	115.9	C545 L546 K547 T622	H543-C545 PolarHBondContact O-N 2.74Å; H543-L546 PolarHBondContact O-N 2.6Å; H543-K547 VanDerWaalsContact NE2-CE 3.3Å; H543-K547 WeakPolarHBondContact NE2-CE 3.47Å; H543-T622 VanDerWaalsContact CA-O 3.3Å; H543-T622 WeakPolarHBondContact CA-O 3.17Å; H543-T622 WeakPolarHBondContact CB-O 3.5Å; H543-T622 PolarHBondContact ND1-O 3.25Å; H543-T622 VanDerWaalsContact ND1-O 3.16Å
544	Y	89.2	Confident	74.2	Confident	120 Å²	120	84.5 Å²	84.5	47%	0.471	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-64.2	-21	175	64.3	-89.4	0	0	0	114	H539 K540 G542 L546 K547 S548	H539-Y544 AromaticContact CD2-CE2 3.73Å; H539-Y544 AromaticContact CD2-CZ 3.89Å; H539-Y544 PolarHBondContact CD2-OH 3.02Å; K540-Y544 VanDerWaalsContact C-OH 3.29Å; K540-Y544 PolarHBondContact O-OH 3.16Å; G542-Y544 PolarHBondContact O-N 2.79Å; Y544-L546 PolarHBondContact O-N 2.75Å; Y544-K547 PolarHBondContact O-N 3Å; Y544-S548 PolarHBondContact O-N 2.83Å; Y544-S548 PolarHBondContact O-OG 3.46Å; Y544-S548 VanDerWaalsContact O-OG 3.06Å
545	C	89.5	Confident	72.8	Confident	0 Å²	0	81.7 Å²	81.7	0%	0	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-63.9	-24	177	-62.9	0	0	0	0	113.3	H539 C541 G542 H543 S548 C605 F618 T622	H539-C545 VanDerWaalsContact CD2-SG 3.58Å; H539-C545 PolarHBondContact NE2-SG 2.81Å; C541-C545 WeakPolarHBondContact CA-SG 3.31Å; G542-C545 PolarHBondContact N-SG 3.26Å; G542-C545 WeakPolarHBondContact O-CB 3.31Å; G542-C545 PolarHBondContact O-N 3.31Å; G542-C545 PolarHBondContact O-SG 3.1Å; H543-C545 PolarHBondContact O-N 2.74Å; C545-S548 WeakPolarHBondContact O-CB 3.46Å; C545-S548 PolarHBondContact O-OG 2.91Å; C545-C605 HydrophobicContact CB-CB 3.72Å; C545-F618 HydrophobicContact CB-CZ 3.96Å; C545-T622 HydrophobicContact CB-CG2 4.09Å
546	L	85.2	Confident	71.2	Confident	12 Å²	12	86.3 Å²	86.3	6%	0.063	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-40.4	177.7	-51.3	171.9	0	0	0	110.1	H543 Y544 S548 E563 F618 T622	H543-L546 PolarHBondContact O-N 2.6Å; Y544-L546 PolarHBondContact O-N 2.75Å; L546-S548 PolarHBondContact O-N 3.24Å; L546-E563 HydrophobicContact CB-CG 4.19Å; L546-E563 HydrophobicContact CD1-CG 4.28Å; L546-F618 HydrophobicContact CD2-CE1 4.13Å; L546-T622 WeakPolarHBondContact CD1-O 3.31Å; L546-T622 HydrophobicContact CD2-CG2 4.49Å
547	K	73	Confident	69.2	Low	136 Å²	136	84.5 Å²	84.5	59%	0.591	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	5.9	176.6	-55.3	-174.9	-177.7	-179	0	114.1	H543 Y544	H543-K547 VanDerWaalsContact NE2-CE 3.3Å; H543-K547 WeakPolarHBondContact NE2-CE 3.47Å; Y544-K547 PolarHBondContact O-N 3Å
548	S	60.1	Low	67.3	Low	36 Å²	36	83.4 Å²	83.4	25%	0.252	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-13.5	-174.9	-69.5	0	0	0	0	114.2	Y544 C545 L546 P604	Y544-S548 PolarHBondContact O-N 2.83Å; Y544-S548 PolarHBondContact O-OG 3.46Å; Y544-S548 VanDerWaalsContact O-OG 3.06Å; C545-S548 WeakPolarHBondContact O-CB 3.46Å; C545-S548 PolarHBondContact O-OG 2.91Å; L546-S548 PolarHBondContact O-N 3.24Å; S548-P604 VanDerWaalsContact CB-O 3.23Å; S548-P604 WeakPolarHBondContact CB-O 3.33Å
549	Y	57	Low	65.5	Low	50 Å²	50	82.2 Å²	82.2	20%	0.196	43%	0.426	C	S	.	.			trans	-102.5	108.8	172.2	-162.9	-99.1	0	0	0	108.9	E530 F531	E530-Y549 PolarHBondContact O-OH 2.98Å; E530-Y549 VanDerWaalsContact O-OH 3.09Å; F531-Y549 HydrophobicContact CD1-CE2 4.42Å; F531-Y549 AromaticContact CD1-CZ 4Å; F531-Y549 VanDerWaalsContact CD1-OH 3.29Å; F531-Y549 WeakPolarHBondContact CD1-OH 3.12Å
550	R	52.2	Low	63.9	Low	211 Å²	211	80.9 Å²	80.9	80%	0.796	42%	0.42	S	S	*	.			trans	-117.7	137.6	171.4	-72.1	-174.8	178	-175.7	-1.8	108.2
551	K	51.5	Low	62.6	Low	82 Å²	82	75.9 Å²	75.9	36%	0.357	41%	0.408	S	S	.	.			trans	-39.4	139.7	-174	-79.3	-170.9	159	-156.8	0	115.4	A555 S557	K551-A555 PolarHBondContact NZ-O 2.81Å; K551-S557 VanDerWaalsContact CE-O 3.29Å; K551-S557 WeakPolarHBondContact CE-O 3.44Å; K551-S557 PolarHBondContact NZ-O 2.64Å
552	P	45.7	Very low	62.1	Low	47 Å²	47	77.1 Å²	77.1	31%	0.305	42%	0.417	S	S	.	.			trans	-55.9	141.1	149.6	-19.6	32.4	0	0	0	110.6	S554	P552-S554 PolarHBondContact O-N 2.83Å
553	S	47.5	Very low	61.8	Low	140 Å²	140	78.1 Å²	78.1	98%	0.979	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	0.2	-167.4	-42.2	0	0	0	0	116.6
554	S	46.7	Very low	61.6	Low	96 Å²	96	76.1 Å²	76.1	67%	0.671	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.7	-6.3	-165.3	51.9	0	0	0	0	115.3	P552 L556	P552-S554 PolarHBondContact O-N 2.83Å; S554-L556 PolarHBondContact O-N 3.37Å
555	A	43	Very low	61.5	Low	20 Å²	20	70.8 Å²	70.8	17%	0.165	39%	0.391	C	S	.	.			trans	-78.6	109.2	-172.2	0	0	0	0	0	113.4	K551 S557	K551-A555 PolarHBondContact NZ-O 2.81Å; A555-S557 PolarHBondContact O-N 2.61Å; A555-S557 VanDerWaalsContact O-N 3.15Å
556	L	44.1	Very low	61.4	Low	176 Å²	176	73.8 Å²	73.8	92%	0.921	41%	0.409	S	S	*	.			trans	-65.3	-8.7	-179	-92.7	76.8	0	0	0	115.3	S554	S554-L556 PolarHBondContact O-N 3.37Å
557	S	43.3	Very low	61.5	Low	51 Å²	51	77 Å²	77	36%	0.357	43%	0.427	S	S	.	.			trans	-95.8	122.6	-179.9	52	0	0	0	0	111.5	K551 A555 I559	K551-S557 VanDerWaalsContact CE-O 3.29Å; K551-S557 WeakPolarHBondContact CE-O 3.44Å; K551-S557 PolarHBondContact NZ-O 2.64Å; A555-S557 PolarHBondContact O-N 2.61Å; A555-S557 VanDerWaalsContact O-N 3.15Å; S557-I559 VanDerWaalsContact C-N 3.33Å; S557-I559 PolarHBondContact O-N 3.36Å
558	P	44.3	Very low	62.2	Low	110 Å²	110	70.9 Å²	70.9	71%	0.714	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-16.2	-174.7	27.5	-33.7	0	0	0	114.8	L560	P558-L560 PolarHBondContact O-N 3.03Å
559	I	51.2	Low	63.4	Low	98 Å²	98	74.3 Å²	74.3	50%	0.503	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-6.3	-164.6	-38.5	-177.8	0	0	0	113.3	S557 C561 Y568	S557-I559 VanDerWaalsContact C-N 3.33Å; S557-I559 PolarHBondContact O-N 3.36Å; I559-C561 VanDerWaalsContact C-N 3.28Å; I559-C561 PolarHBondContact O-N 3.41Å; I559-Y568 HydrophobicContact CG2-CD1 4.32Å; I559-Y568 HydrophobicContact CG2-CE1 3.73Å; I559-Y568 PolarHBondContact O-OH 3.13Å
560	L	55.7	Low	64.8	Low	17 Å²	17	73 Å²	73	9%	0.089	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	73.4	172.5	-77	163.1	0	0	0	111.4	L527 E530 P558 H579	L527-L560 HydrophobicContact CD1-CD2 3.75Å; E530-L560 WeakPolarHBondContact OE2-CD1 3.33Å; P558-L560 PolarHBondContact O-N 3.03Å; L560-H579 HydrophobicContact CD2-CB 4.38Å
561	C	64.7	Low	66.6	Low	85 Å²	85	65.3 Å²	65.3	57%	0.574	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-175.1	-7	171.2	-111.6	0	0	0	0	116	I559	I559-C561 VanDerWaalsContact C-N 3.28Å; I559-C561 PolarHBondContact O-N 3.41Å
562	S	79.4	Confident	68.5	Low	30 Å²	30	61.8 Å²	61.8	21%	0.21	37%	0.371	C	S	.	.			trans	-83.7	146.2	-172.7	-168.2	0	0	0	0	112.8	N564 D567 Y568 C580	S562-N564 PolarHBondContact OG-N 3.35Å; S562-N564 VanDerWaalsContact OG-N 3.12Å; S562-D567 WeakPolarHBondContact CB-OD2 3.43Å; S562-D567 PolarHBondContact OG-OD2 2.72Å; S562-Y568 PolarHBondContact N-OH 2.89Å; S562-Y568 VanDerWaalsContact N-OH 3.07Å; S562-Y568 PolarHBondContact O-OH 2.81Å; S562-C580 PolarHBondContact O-SG 3.15Å
563	E	83.6	Confident	70.7	Confident	35 Å²	35	60.3 Å²	60.3	16%	0.164	36%	0.361	C	S	.	.			trans	-91.9	-9.5	169.5	-87.9	-77.5	131.6	0	0	112.3	L546 P565 S624 Q625 L626	L546-E563 HydrophobicContact CB-CG 4.19Å; L546-E563 HydrophobicContact CD1-CG 4.28Å; E563-P565 WeakPolarHBondContact O-CD 3.27Å; E563-S624 WeakPolarHBondContact OE2-CA 3.29Å; E563-S624 VanDerWaalsContact OE2-CB 3.28Å; E563-S624 WeakPolarHBondContact OE2-CB 3.17Å; E563-S624 PolarHBondContact OE2-OG 3.1Å; E563-Q625 HydrophobicContact CB-CB 4.17Å; E563-Q625 CarbonylContact O-C 3.57Å; E563-Q625 WeakPolarHBondContact O-CB 3.21Å; E563-Q625 PolarHBondContact OE2-N 2.82Å; E563-L626 WeakPolarHBondContact O-CD2 3.24Å
564	N	87.2	Confident	72.9	Confident	47 Å²	47	53.9 Å²	53.9	25%	0.251	32%	0.316	S	S	.	.			trans	-89.5	117.4	-174.8	-177.3	22.5	0	0	0	111.7	S562 V566 D567 Y568	S562-N564 PolarHBondContact OG-N 3.35Å; S562-N564 VanDerWaalsContact OG-N 3.12Å; N564-V566 PolarHBondContact O-N 3.44Å; N564-V566 VanDerWaalsContact O-N 3.11Å; N564-V566 PolarHBondContact OD1-N 2.81Å; N564-D567 PolarHBondContact ND2-OD1 2.79Å; N564-D567 PolarHBondContact O-N 3.5Å; N564-D567 VanDerWaalsContact O-N 3.16Å; N564-Y568 WeakPolarHBondContact O-CD2 3.31Å
565	P	86.7	Confident	75	Confident	7 Å²	7	49.5 Å²	49.5	5%	0.045	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-58.9	-24.9	177.6	-25	34.3	0	0	0	114.5	E563 D567 Y568 I576 Q625 L626 L630 W775	E563-P565 WeakPolarHBondContact O-CD 3.27Å; P565-D567 VanDerWaalsContact C-N 3.28Å; P565-D567 PolarHBondContact O-N 3.3Å; P565-Y568 PolarHBondContact O-N 2.84Å; P565-Y568 VanDerWaalsContact O-N 3.15Å; P565-I576 HydrophobicContact CB-CD1 4.33Å; P565-Q625 WeakPolarHBondContact CD-O 3.45Å; P565-L626 HydrophobicContact CG-CD2 3.93Å; P565-L630 HydrophobicContact CB-CD1 4.42Å; P565-L630 HydrophobicContact CG-CD1 4.02Å; P565-W775 HydrophobicContact CB-CH2 4.21Å; P565-W775 HydrophobicContact CB-CZ3 4.42Å; P565-W775 WeakPolarHBondContact O-CH2 3.47Å; P565-W775 WeakPolarHBondContact O-CZ3 3.47Å
566	V	87	Confident	77.3	Confident	64 Å²	64	48.5 Å²	48.5	39%	0.388	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-68.4	-27.6	-179.3	177.4	0	0	0	0	112.3	N564 Y568 K569 W775	N564-V566 PolarHBondContact O-N 3.44Å; N564-V566 VanDerWaalsContact O-N 3.11Å; N564-V566 PolarHBondContact OD1-N 2.81Å; V566-Y568 PolarHBondContact O-N 3.18Å; V566-K569 HydrophobicContact CG1-CD 4.3Å; V566-K569 WeakPolarHBondContact O-CG 3.47Å; V566-K569 PolarHBondContact O-N 3.28Å; V566-W775 HydrophobicContact CG2-CH2 4.39Å
567	D	88	Confident	79.6	Confident	80 Å²	80	40.1 Å²	40.1	43%	0.428	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-70.7	-12	176.6	-54.3	3.8	0	0	0	111.5	S562 N564 P565	S562-D567 WeakPolarHBondContact CB-OD2 3.43Å; S562-D567 PolarHBondContact OG-OD2 2.72Å; N564-D567 PolarHBondContact ND2-OD1 2.79Å; N564-D567 PolarHBondContact O-N 3.5Å; N564-D567 VanDerWaalsContact O-N 3.16Å; P565-D567 VanDerWaalsContact C-N 3.28Å; P565-D567 PolarHBondContact O-N 3.3Å
568	Y	87	Confident	81.7	Confident	6 Å²	6	37.8 Å²	37.8	2%	0.024	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-110.9	26.2	178.7	-58.2	-69.7	0	0	0	112.6	I559 S562 N564 P565 V566 L571 I576 H579	I559-Y568 HydrophobicContact CG2-CD1 4.32Å; I559-Y568 HydrophobicContact CG2-CE1 3.73Å; I559-Y568 PolarHBondContact O-OH 3.13Å; S562-Y568 PolarHBondContact N-OH 2.89Å; S562-Y568 VanDerWaalsContact N-OH 3.07Å; S562-Y568 PolarHBondContact O-OH 2.81Å; N564-Y568 WeakPolarHBondContact O-CD2 3.31Å; P565-Y568 PolarHBondContact O-N 2.84Å; P565-Y568 VanDerWaalsContact O-N 3.15Å; V566-Y568 PolarHBondContact O-N 3.18Å; Y568-L571 HydrophobicContact CD1-CD1 3.89Å; Y568-L571 HydrophobicContact CG-CD1 4.37Å; Y568-L571 VanDerWaalsContact O-CB 3.25Å; Y568-L571 WeakPolarHBondContact O-CB 3.47Å; Y568-L571 WeakPolarHBondContact O-CG 3.23Å; Y568-L571 PolarHBondContact O-N 2.69Å; Y568-I576 HydrophobicContact CD2-CG2 3.75Å; Y568-I576 HydrophobicContact CE2-CG2 4.44Å; Y568-I576 HydrophobicContact CG-CG1 4.48Å; Y568-I576 HydrophobicContact CG-CG2 4.24Å; Y568-H579 HydrophobicContact CD1-CB 4.06Å; Y568-H579 HydrophobicContact CE1-CB 3.49Å; Y568-H579 VanDerWaalsContact CE1-CB 3.49Å
569	K	85.7	Confident	83.6	Confident	109 Å²	109	34 Å²	34	47%	0.474	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53	145.2	168.9	-85.6	-177.3	168.5	-161.1	0	111.6	V566 L571 N661 W775	V566-K569 HydrophobicContact CG1-CD 4.3Å; V566-K569 WeakPolarHBondContact O-CG 3.47Å; V566-K569 PolarHBondContact O-N 3.28Å; K569-L571 VanDerWaalsContact C-N 3.28Å; K569-L571 PolarHBondContact O-N 2.67Å; K569-N661 HydrophobicContact CD-CB 4.42Å; K569-N661 WeakPolarHBondContact CE-OD1 3.19Å; K569-N661 HydrophobicContact CG-CB 4.23Å; K569-N661 PolarHBondContact NZ-OD1 2.93Å; K569-W775 HydrophobicContact CG-CH2 4.48Å
570	G	86.8	Confident	85.2	Confident	22 Å²	22	29.8 Å²	29.8	23%	0.227	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	84	-18.1	-171.6	0	0	0	0	0	115.8	N661	G570-N661 PolarHBondContact N-O 2.95Å
571	L	89.5	Confident	86.4	Confident	50 Å²	50	29.1 Å²	29.1	26%	0.262	17%	0.165	S	C	.	.	S	Bend	trans	-83.8	162.3	-179.1	-61.4	-160.3	0	0	0	113.4	Y568 K569 E575	Y568-L571 HydrophobicContact CD1-CD1 3.89Å; Y568-L571 HydrophobicContact CG-CD1 4.37Å; Y568-L571 VanDerWaalsContact O-CB 3.25Å; Y568-L571 WeakPolarHBondContact O-CB 3.47Å; Y568-L571 WeakPolarHBondContact O-CG 3.23Å; Y568-L571 PolarHBondContact O-N 2.69Å; K569-L571 VanDerWaalsContact C-N 3.28Å; K569-L571 PolarHBondContact O-N 2.67Å; L571-E575 WeakPolarHBondContact CA-OE1 3.42Å; L571-E575 HydrophobicContact CB-CG 4.21Å; L571-E575 VanDerWaalsContact CB-OE1 3.26Å; L571-E575 WeakPolarHBondContact CB-OE1 3.47Å; L571-E575 HydrophobicContact CD1-CG 4.31Å
572	N	91	Very high	87.6	Confident	8 Å²	8	25 Å²	25	4%	0.043	14%	0.138	C	C	.	.			trans	-70	124.3	169	168.9	6.1	0	0	0	109.1	Y523 L574 E575 K777	Y523-N572 PolarHBondContact OH-ND2 2.95Å; N572-L574 PolarHBondContact O-N 3.46Å; N572-L574 PolarHBondContact OD1-N 3.49Å; N572-E575 HydrophobicContact CB-CB 4.47Å; N572-E575 HydrophobicContact CB-CG 4.22Å; N572-E575 PolarHBondContact N-OE1 3.23Å; N572-E575 VanDerWaalsContact O-CG 3.29Å; N572-E575 WeakPolarHBondContact O-CG 3.36Å; N572-E575 PolarHBondContact O-N 2.84Å; N572-K777 HydrophobicContact CB-CD 4.29Å
573	P	93	Very high	87.9	Confident	15 Å²	15	24 Å²	24	10%	0.097	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-26.7	-174.2	-29.6	37.6	0	0	0	115.1	E575 L630 W775	P573-E575 VanDerWaalsContact C-N 3.29Å; P573-E575 PolarHBondContact O-N 2.83Å; P573-L630 HydrophobicContact CB-CD2 3.82Å; P573-L630 WeakPolarHBondContact O-CD2 3.45Å; P573-W775 VanDerWaalsContact CD-O 3.24Å; P573-W775 WeakPolarHBondContact CD-O 3.29Å; P573-W775 HydrophobicContact CG-CB 3.84Å; P573-W775 WeakPolarHBondContact CG-O 3.44Å
574	L	93.7	Very high	88.2	Confident	6 Å²	6	22.5 Å²	22.5	3%	0.031	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-10.1	176.9	-61.7	-178.2	0	0	0	113.8	N572 L630 L637 I639 P797	N572-L574 PolarHBondContact O-N 3.46Å; N572-L574 PolarHBondContact OD1-N 3.49Å; L574-L630 WeakPolarHBondContact CD2-O 3.26Å; L574-L637 HydrophobicContact CD1-CD1 3.66Å; L574-L637 HydrophobicContact CD1-CD2 3.63Å; L574-L637 HydrophobicContact CD1-CG 4.33Å; L574-I639 HydrophobicContact CB-CD1 4.03Å; L574-I639 HydrophobicContact CB-CG1 4.07Å; L574-I639 HydrophobicContact CB-CG2 3.95Å; L574-I639 HydrophobicContact CD1-CG1 4.35Å; L574-P797 HydrophobicContact CD1-CG 3.91Å; L574-P797 HydrophobicContact CD2-CG 4.28Å
575	E	90.9	Very high	88	Confident	3 Å²	3	20.5 Å²	20.5	1%	0.014	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-19.6	176.9	92.3	-155.4	158.3	0	0	113.4	Y523 L524 L571 N572 P573 P577 F578 H579 I639	Y523-E575 WeakPolarHBondContact CE2-OE2 3.49Å; Y523-E575 PolarHBondContact OH-OE2 3Å; L524-E575 HydrophobicContact CD1-CB 3.94Å; L571-E575 WeakPolarHBondContact CA-OE1 3.42Å; L571-E575 HydrophobicContact CB-CG 4.21Å; L571-E575 VanDerWaalsContact CB-OE1 3.26Å; L571-E575 WeakPolarHBondContact CB-OE1 3.47Å; L571-E575 HydrophobicContact CD1-CG 4.31Å; N572-E575 HydrophobicContact CB-CB 4.47Å; N572-E575 HydrophobicContact CB-CG 4.22Å; N572-E575 PolarHBondContact N-OE1 3.23Å; N572-E575 VanDerWaalsContact O-CG 3.29Å; N572-E575 WeakPolarHBondContact O-CG 3.36Å; N572-E575 PolarHBondContact O-N 2.84Å; P573-E575 VanDerWaalsContact C-N 3.29Å; P573-E575 PolarHBondContact O-N 2.83Å; E575-P577 VanDerWaalsContact C-CD 3.49Å; E575-P577 VanDerWaalsContact C-N 3.35Å; E575-F578 HydrophobicContact CB-CD2 4.12Å; E575-F578 VanDerWaalsContact O-CB 3.32Å; E575-F578 WeakPolarHBondContact O-CB 3.36Å; E575-F578 PolarHBondContact O-N 2.79Å; E575-H579 PolarHBondContact O-CD2 3.28Å; E575-H579 PolarHBondContact O-N 3.25Å; E575-I639 HydrophobicContact CB-CG2 4.2Å
576	I	91.2	Very high	87.8	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-50	-46.5	175.6	-60.8	-179.7	0	0	0	112.2	P565 Y568 F578 H579 C580 L626 L630 W775	P565-I576 HydrophobicContact CB-CD1 4.33Å; Y568-I576 HydrophobicContact CD2-CG2 3.75Å; Y568-I576 HydrophobicContact CE2-CG2 4.44Å; Y568-I576 HydrophobicContact CG-CG1 4.48Å; Y568-I576 HydrophobicContact CG-CG2 4.24Å; I576-F578 PolarHBondContact O-N 2.84Å; I576-H579 PolarHBondContact O-N 2.87Å; I576-C580 PolarHBondContact O-N 3.19Å; I576-C580 PolarHBondContact O-SG 3.14Å; I576-L626 HydrophobicContact CG2-CD2 4.03Å; I576-L630 HydrophobicContact CB-CD1 4.49Å; I576-L630 HydrophobicContact CD1-CD2 4.4Å; I576-L630 HydrophobicContact CG2-CD1 4.23Å; I576-W775 HydrophobicContact CD1-CZ3 4.16Å
577	P	91.2	Very high	87.3	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-58.1	-32.5	177.9	-25.4	35.9	0	0	0	114.2	E575 C580 G581 W582 L630 F631	E575-P577 VanDerWaalsContact C-CD 3.49Å; E575-P577 VanDerWaalsContact C-N 3.35Å; P577-C580 CarbonylContact O-C 3.58Å; P577-C580 PolarHBondContact O-N 2.83Å; P577-G581 PolarHBondContact O-N 3.07Å; P577-W582 HydrophobicContact CB-CB 3.91Å; P577-W582 HydrophobicContact CB-CG 4.1Å; P577-W582 VanDerWaalsContact O-CB 3.24Å; P577-W582 WeakPolarHBondContact O-CB 3.46Å; P577-W582 PolarHBondContact O-N 3.21Å; P577-L630 HydrophobicContact CG-CB 3.95Å; P577-F631 HydrophobicContact CB-CE1 3.81Å; P577-F631 HydrophobicContact CB-CZ 3.9Å; P577-F631 HydrophobicContact CG-CD1 4.35Å; P577-F631 HydrophobicContact CG-CE1 3.96Å; P577-F631 HydrophobicContact CG-CE2 4.16Å; P577-F631 HydrophobicContact CG-CZ 3.86Å
578	F	87	Confident	86.5	Confident	2 Å²	2	17 Å²	17	1%	0.009	9%	0.087	C	C	.	.	H	α-helix	trans	-63.9	-43.1	176	-60.8	-56.4	0	0	0	111	F130 L524 L527 F528 F531 E575 I576 C580 G581 W582 R584 I639	F130-F578 HydrophobicContact CE1-CE1 4.18Å; F130-F578 HydrophobicContact CE2-CE1 4.34Å; F130-F578 AromaticContact CZ-CD1 3.93Å; F130-F578 HydrophobicContact CZ-CD1 3.93Å; F130-F578 AromaticContact CZ-CE1 3.6Å; F130-F578 HydrophobicContact CZ-CE1 3.6Å; F130-F578 HydrophobicContact CZ-CZ 4.37Å; L524-F578 HydrophobicContact CD1-CD2 4.42Å; L527-F578 HydrophobicContact CD2-CB 4.08Å; F528-F578 HydrophobicContact CE1-CD2 4.06Å; F528-F578 HydrophobicContact CE1-CE2 4.13Å; F528-F578 HydrophobicContact CE1-CG 4.35Å; F528-F578 HydrophobicContact CE1-CZ 4.47Å; F528-F578 HydrophobicContact CZ-CD2 4.46Å; F528-F578 HydrophobicContact CZ-CE2 4.09Å; F528-F578 HydrophobicContact CZ-CZ 4.32Å; F531-F578 VanDerWaalsContact CE1-O 3.32Å; F531-F578 WeakPolarHBondContact CE1-O 3.36Å; F531-F578 HydrophobicContact CE2-CB 4.01Å; F531-F578 HydrophobicContact CE2-CD1 4.39Å; F531-F578 HydrophobicContact CE2-CG 4.47Å; F531-F578 HydrophobicContact CZ-CB 3.74Å; F531-F578 WeakPolarHBondContact CZ-O 3.46Å; E575-F578 HydrophobicContact CB-CD2 4.12Å; E575-F578 VanDerWaalsContact O-CB 3.32Å; E575-F578 WeakPolarHBondContact O-CB 3.36Å; E575-F578 PolarHBondContact O-N 2.79Å; I576-F578 PolarHBondContact O-N 2.84Å; F578-C580 PolarHBondContact O-N 3.21Å; F578-G581 PolarHBondContact O-N 3.39Å; F578-W582 WeakPolarHBondContact CA-O 3.43Å; F578-W582 VanDerWaalsContact CD1-O 3.3Å; F578-W582 WeakPolarHBondContact CD1-O 3.38Å; F578-R584 HydrophobicContact CE1-CB 3.65Å; F578-R584 HydrophobicContact CZ-CB 3.85Å; F578-I639 HydrophobicContact CE2-CB 4.23Å; F578-I639 HydrophobicContact CE2-CD1 3.95Å; F578-I639 HydrophobicContact CE2-CG2 3.93Å; F578-I639 HydrophobicContact CZ-CD1 3.95Å
579	H	84.3	Confident	85.5	Confident	31 Å²	31	20.3 Å²	20.3	14%	0.144	10%	0.1	C	C	.	.	H	α-helix	trans	-65.3	-24.3	175.7	-65.6	-73.6	0	0	0	113.3	L560 Y568 E575 I576 G581	L560-H579 HydrophobicContact CD2-CB 4.38Å; Y568-H579 HydrophobicContact CD1-CB 4.06Å; Y568-H579 HydrophobicContact CE1-CB 3.49Å; Y568-H579 VanDerWaalsContact CE1-CB 3.49Å; E575-H579 PolarHBondContact O-CD2 3.28Å; E575-H579 PolarHBondContact O-N 3.25Å; I576-H579 PolarHBondContact O-N 2.87Å; H579-G581 VanDerWaalsContact C-N 3.31Å
580	C	84.8	Confident	84.4	Confident	8 Å²	8	18.9 Å²	18.9	5%	0.054	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	13.6	171.7	-49.2	0	0	0	0	113.6	S562 I576 P577 F578 P604 L626	S562-C580 PolarHBondContact O-SG 3.15Å; I576-C580 PolarHBondContact O-N 3.19Å; I576-C580 PolarHBondContact O-SG 3.14Å; P577-C580 CarbonylContact O-C 3.58Å; P577-C580 PolarHBondContact O-N 2.83Å; F578-C580 PolarHBondContact O-N 3.21Å; C580-P604 WeakPolarHBondContact O-CG 3.21Å; C580-L626 HydrophobicContact CB-CD1 3.98Å
581	G	82.4	Confident	83.2	Confident	3 Å²	3	20.4 Å²	20.4	3%	0.031	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.1	16	175.8	0	0	0	0	0	115.8	P577 F578 H579 P604	P577-G581 PolarHBondContact O-N 3.07Å; F578-G581 PolarHBondContact O-N 3.39Å; H579-G581 VanDerWaalsContact C-N 3.31Å; G581-P604 WeakPolarHBondContact O-CA 3.27Å
582	W	88.6	Confident	81.9	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.11	C	C	.	.			trans	-86	148.8	171.2	-64.6	68.7	0	0	0	111.2	P577 F578 T602 A603 P604 L609 F618 L619 F631	P577-W582 HydrophobicContact CB-CB 3.91Å; P577-W582 HydrophobicContact CB-CG 4.1Å; P577-W582 VanDerWaalsContact O-CB 3.24Å; P577-W582 WeakPolarHBondContact O-CB 3.46Å; P577-W582 PolarHBondContact O-N 3.21Å; F578-W582 WeakPolarHBondContact CA-O 3.43Å; F578-W582 VanDerWaalsContact CD1-O 3.3Å; F578-W582 WeakPolarHBondContact CD1-O 3.38Å; W582-T602 CarbonylContact C-O 3.49Å; W582-T602 WeakPolarHBondContact CA-O 3.28Å; W582-A603 HydrophobicContact CD2-CB 4.33Å; W582-A603 HydrophobicContact CE3-CB 3.9Å; W582-A603 HydrophobicContact CH2-CB 3.89Å; W582-A603 HydrophobicContact CZ2-CB 4.28Å; W582-A603 HydrophobicContact CZ3-CB 3.67Å; W582-P604 HydrophobicContact CG-CG 4.31Å; W582-L609 HydrophobicContact CH2-CD1 4Å; W582-L609 HydrophobicContact CZ3-CD1 3.73Å; W582-F618 AromaticContact CH2-CD1 3.38Å; W582-F618 HydrophobicContact CH2-CD1 3.38Å; W582-F618 AromaticContact CH2-CE1 3.72Å; W582-F618 HydrophobicContact CH2-CE1 3.72Å; W582-F618 HydrophobicContact CH2-CG 4.12Å; W582-F618 AromaticContact CZ2-CD1 3.67Å; W582-F618 HydrophobicContact CZ2-CD1 3.67Å; W582-F618 AromaticContact CZ2-CE1 3.67Å; W582-F618 HydrophobicContact CZ2-CE1 3.67Å; W582-F618 HydrophobicContact CZ3-CD1 4.5Å; W582-L619 HydrophobicContact CH2-CD2 4.31Å; W582-L619 HydrophobicContact CZ2-CD2 3.86Å; W582-F631 AromaticContact CD2-CE1 3.7Å; W582-F631 HydrophobicContact CD2-CE1 3.7Å; W582-F631 AromaticContact CD2-CZ 3.9Å; W582-F631 HydrophobicContact CD2-CZ 3.9Å; W582-F631 AromaticContact CE2-CZ 3.86Å; W582-F631 AromaticContact CE3-CE1 3.54Å; W582-F631 HydrophobicContact CE3-CE1 3.54Å; W582-F631 HydrophobicContact CE3-CZ 4.1Å; W582-F631 HydrophobicContact CG-CE1 4.24Å; W582-F631 HydrophobicContact CG-CZ 4.44Å; W582-F631 HydrophobicContact CH2-CE1 4.23Å; W582-F631 HydrophobicContact CH2-CZ 4.16Å; W582-F631 HydrophobicContact CZ2-CE1 4.39Å; W582-F631 HydrophobicContact CZ2-CZ 4Å; W582-F631 AromaticContact CZ3-CE1 3.82Å; W582-F631 HydrophobicContact CZ3-CE1 3.82Å; W582-F631 HydrophobicContact CZ3-CZ 4.22Å
583	L	87.1	Confident	80.1	Confident	8 Å²	8	23.7 Å²	23.7	4%	0.042	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	149.3	179.1	-56	178.1	0	0	0	110.6	F130 F531 Y585 Y601 T602	F130-L583 HydrophobicContact CE2-CB 3.92Å; F130-L583 HydrophobicContact CE2-CD2 3.85Å; F130-L583 HydrophobicContact CE2-CG 4.45Å; F130-L583 HydrophobicContact CZ-CD2 4.33Å; F531-L583 HydrophobicContact CB-CD2 3.64Å; F531-L583 HydrophobicContact CD1-CD2 3.61Å; F531-L583 HydrophobicContact CD2-CD2 3.79Å; F531-L583 HydrophobicContact CE1-CD2 4.25Å; F531-L583 HydrophobicContact CE2-CD2 4.39Å; F531-L583 HydrophobicContact CG-CD2 3.4Å; F531-L583 VanDerWaalsContact CG-CD2 3.4Å; L583-Y585 HydrophobicContact CB-CE2 3.73Å; L583-Y585 VanDerWaalsContact CD1-OH 3.28Å; L583-Y585 WeakPolarHBondContact CD1-OH 3.31Å; L583-Y601 CarbonylContact O-C 3.55Å; L583-Y601 VanDerWaalsContact O-CA 3.28Å; L583-Y601 WeakPolarHBondContact O-CA 3.45Å; L583-T602 PolarHBondContact N-O 2.89Å; L583-T602 PolarHBondContact O-N 2.85Å
584	R	88.6	Confident	78.5	Confident	3 Å²	3	26.7 Å²	26.7	1%	0.011	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	113.6	-176.4	-173.1	-169.8	-171.8	-117.6	-0.5	111.6	D131 F578 I599 Y601 S632 D634 L637	D131-R584 PolarHBondContact N-O 3.04Å; D131-R584 IonicContact OD1-CZ 2.79Å; D131-R584 IonicContact OD1-NH1 3.75Å; D131-R584 PolarHBondContact OD1-NH1 3.38Å; F578-R584 HydrophobicContact CE1-CB 3.65Å; F578-R584 HydrophobicContact CZ-CB 3.85Å; R584-I599 HydrophobicContact CG-CG2 4.09Å; R584-Y601 HydrophobicContact CB-CD1 4.1Å; R584-Y601 HydrophobicContact CB-CE1 3.85Å; R584-Y601 HydrophobicContact CG-CD1 4.31Å; R584-Y601 HydrophobicContact CG-CE1 3.89Å; R584-Y601 HydrophobicContact CG-CE2 4.13Å; R584-Y601 PolarHBondContact NE-OH 2.81Å; R584-S632 PolarHBondContact NE-O 3.32Å; R584-S632 PolarHBondContact NH2-O 3.43Å; R584-D634 PolarHBondContact NH2-O 3.17Å; R584-L637 PolarHBondContact NH1-O 3.44Å
585	Y	83	Confident	76.9	Confident	6 Å²	6	30.4 Å²	30.4	2%	0.024	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	143.3	-179.8	-56.1	-79.2	0	0	0	111.9	R128 L129 F130 L137 L583 I599 I600	R128-Y585 HydrophobicContact CB-CD1 4.09Å; R128-Y585 HydrophobicContact CB-CG 4.45Å; L129-Y585 CarbonylContact O-C 3.59Å; L129-Y585 WeakPolarHBondContact O-CA 3.35Å; F130-Y585 HydrophobicContact CB-CD1 4.45Å; F130-Y585 HydrophobicContact CB-CE1 4.49Å; F130-Y585 HydrophobicContact CD2-CD1 4.19Å; F130-Y585 AromaticContact CD2-CE1 3.82Å; F130-Y585 HydrophobicContact CD2-CE1 3.82Å; L137-Y585 HydrophobicContact CD1-CE1 3.53Å; L137-Y585 VanDerWaalsContact CD1-OH 3.3Å; L137-Y585 WeakPolarHBondContact CD1-OH 3.42Å; L583-Y585 HydrophobicContact CB-CE2 3.73Å; L583-Y585 VanDerWaalsContact CD1-OH 3.28Å; L583-Y585 WeakPolarHBondContact CD1-OH 3.31Å; Y585-I599 CarbonylContact O-C 3.56Å; Y585-I599 VanDerWaalsContact O-CA 3.3Å; Y585-I599 WeakPolarHBondContact O-CA 3.46Å; Y585-I600 PolarHBondContact N-O 3.17Å; Y585-I600 PolarHBondContact O-N 3.32Å
586	L	82.1	Confident	75.6	Confident	3 Å²	3	36.3 Å²	36.3	2%	0.016	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	105.9	163.7	179.1	61.4	0	0	0	108.4	L129 N132 K588 C597 I599	L129-L586 HydrophobicContact CB-CB 4.38Å; L129-L586 PolarHBondContact N-O 3.2Å; L129-L586 PolarHBondContact O-N 3.15Å; N132-L586 VanDerWaalsContact OD1-CD2 3.26Å; N132-L586 WeakPolarHBondContact OD1-CD2 3.32Å; L586-K588 HydrophobicContact CG-CG 4.33Å; L586-C597 HydrophobicContact CD1-CB 3.78Å; L586-C597 HydrophobicContact CG-CB 4.4Å; L586-I599 HydrophobicContact CB-CD1 3.92Å; L586-I599 HydrophobicContact CD1-CD1 3.81Å; L586-I599 HydrophobicContact CD1-CG1 4.32Å; L586-I599 HydrophobicContact CG-CD1 4.43Å
587	A	77.1	Confident	74.7	Confident	3 Å²	3	38.2 Å²	38.2	3%	0.025	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	118.8	174.2	0	0	0	0	0	110	V126 L127 C597 N598 I600	V126-A587 HydrophobicContact CG1-CB 3.81Å; L127-A587 CarbonylContact O-C 3.49Å; L127-A587 WeakPolarHBondContact O-CA 3.17Å; A587-C597 CarbonylContact O-C 3.53Å; A587-C597 WeakPolarHBondContact O-CA 3.36Å; A587-N598 PolarHBondContact N-O 3.05Å; A587-N598 PolarHBondContact O-N 3.19Å; A587-I600 HydrophobicContact CB-CD1 3.87Å; A587-I600 HydrophobicContact CB-CG1 4.38Å
588	K	71	Confident	74.1	Confident	71 Å²	71	42 Å²	42	31%	0.309	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	140.9	172.9	-65	179.5	-175.4	162.5	0	109.7	V126 L127 L129 N132 L586 C597	V126-K588 CarbonylContact C-O 3.49Å; V126-K588 WeakPolarHBondContact CA-O 3.22Å; L127-K588 PolarHBondContact N-O 2.68Å; L127-K588 PolarHBondContact O-N 2.8Å; L129-K588 HydrophobicContact CD1-CD 3.69Å; L129-K588 HydrophobicContact CD1-CG 4.44Å; N132-K588 PolarHBondContact OD1-NZ 3.37Å; L586-K588 HydrophobicContact CG-CG 4.33Å; K588-C597 HydrophobicContact CG-CB 3.92Å
589	Y	66.9	Low	74.1	Confident	76 Å²	76	42.3 Å²	42.3	30%	0.298	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	140.2	172.6	-62.7	-92.4	0	0	0	110.4	F123 R125 V126 P591 P592 K596	F123-Y589 WeakPolarHBondContact O-CD1 3.36Å; R125-Y589 CarbonylContact O-C 3.59Å; R125-Y589 WeakPolarHBondContact O-CA 3.02Å; V126-Y589 HydrophobicContact CG2-CD1 3.92Å; V126-Y589 HydrophobicContact CG2-CE1 3.77Å; Y589-P591 CarbonylContact C-O 3.6Å; Y589-P591 CarbonylContact O-C 3.59Å; Y589-P592 VanDerWaalsContact O-CA 3.28Å; Y589-P592 WeakPolarHBondContact O-CA 3.49Å; Y589-K596 HydrophobicContact CD2-CB 3.89Å; Y589-K596 WeakPolarHBondContact CD2-O 3.4Å; Y589-K596 HydrophobicContact CE2-CB 4.1Å
590	D	62.7	Low	74.4	Confident	78 Å²	78	42.1 Å²	42.1	42%	0.417	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	115.3	177.9	-175.7	30.7	0	0	0	110.5	G124 R125 L127	G124-D590 CarbonylContact C-O 3.29Å; G124-D590 WeakPolarHBondContact CA-O 3.37Å; R125-D590 HydrophobicContact CB-CB 4.46Å; R125-D590 PolarHBondContact N-O 3.48Å; R125-D590 PolarHBondContact O-N 3.32Å; L127-D590 HydrophobicContact CD1-CB 4.1Å; L127-D590 HydrophobicContact CG-CB 4.34Å
591	P	60.8	Low	74.7	Confident	54 Å²	54	41.8 Å²	41.8	35%	0.351	22%	0.22	S	C	.	.	S	Bend	cis	-65	154.1	2.9	27.7	-35.8	0	0	0	113.2	Y589 V593	Y589-P591 CarbonylContact C-O 3.6Å; Y589-P591 CarbonylContact O-C 3.59Å; P591-V593 VanDerWaalsContact C-N 3.35Å; P591-V593 PolarHBondContact O-N 3.38Å
592	P	61.7	Low	75.1	Confident	61 Å²	61	41.8 Å²	41.8	40%	0.396	22%	0.22	S	C	.	.			trans	-72.2	79.7	-173	28.6	-36.1	0	0	0	113.5	Y589 N594	Y589-P592 VanDerWaalsContact O-CA 3.28Å; Y589-P592 WeakPolarHBondContact O-CA 3.49Å; P592-N594 PolarHBondContact O-N 3.29Å; P592-N594 VanDerWaalsContact O-N 3.11Å
593	V	54.8	Low	75.2	Confident	67 Å²	67	41.9 Å²	41.9	41%	0.406	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-65.8	110.8	175.6	-177	0	0	0	0	110.1	P591 N595 K596	P591-V593 VanDerWaalsContact C-N 3.35Å; P591-V593 PolarHBondContact O-N 3.38Å; V593-N595 PolarHBondContact O-N 2.83Å; V593-K596 PolarHBondContact O-N 3.15Å
594	N	59.3	Low	75.3	Confident	78 Å²	78	41.8 Å²	41.8	42%	0.417	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	55.5	28.3	179.2	-63.2	-48.6	0	0	0	115	P592 K596 L966 L968	P592-N594 PolarHBondContact O-N 3.29Å; P592-N594 VanDerWaalsContact O-N 3.11Å; N594-K596 HydrophobicContact CB-CG 4.42Å; N594-K596 PolarHBondContact O-N 3.49Å; N594-L966 PolarHBondContact OD1-O 3.49Å; N594-L968 WeakPolarHBondContact OD1-CB 3.37Å
595	N	60	Low	75.2	Confident	83 Å²	83	41.9 Å²	41.9	44%	0.444	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	50.4	27.3	-175.6	-71.1	-15	0	0	0	114.2	V593 C597 N969	V593-N595 PolarHBondContact O-N 2.83Å; N595-C597 PolarHBondContact O-N 2.78Å; N595-N969 PolarHBondContact ND2-OD1 2.83Å
596	K	63.6	Low	75.5	Confident	128 Å²	128	41.6 Å²	41.6	56%	0.557	22%	0.22	S	C	*	.			trans	-63.9	123.1	178.6	-74.4	-173.5	174.7	-174.1	0	110.1	Y589 V593 N594	Y589-K596 HydrophobicContact CD2-CB 3.89Å; Y589-K596 WeakPolarHBondContact CD2-O 3.4Å; Y589-K596 HydrophobicContact CE2-CB 4.1Å; V593-K596 PolarHBondContact O-N 3.15Å; N594-K596 HydrophobicContact CB-CG 4.42Å; N594-K596 PolarHBondContact O-N 3.49Å
597	C	71.1	Confident	75.9	Confident	40 Å²	40	46.3 Å²	46.3	27%	0.27	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	132	169.7	65.6	0	0	0	0	109.7	L586 A587 K588 N595	L586-C597 HydrophobicContact CD1-CB 3.78Å; L586-C597 HydrophobicContact CG-CB 4.4Å; A587-C597 CarbonylContact O-C 3.53Å; A587-C597 WeakPolarHBondContact O-CA 3.36Å; K588-C597 HydrophobicContact CG-CB 3.92Å; N595-C597 PolarHBondContact O-N 2.78Å
598	N	78.4	Confident	76.6	Confident	80 Å²	80	48.1 Å²	48.1	43%	0.428	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	133.2	-173.8	-61.9	-17	0	0	0	109	A587	A587-N598 PolarHBondContact N-O 3.05Å; A587-N598 PolarHBondContact O-N 3.19Å
599	I	88.2	Confident	77.7	Confident	7 Å²	7	45 Å²	45	4%	0.036	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	140.6	165.4	-65.5	-67.7	0	0	0	109.1	R584 Y585 L586 Y601 F633	R584-I599 HydrophobicContact CG-CG2 4.09Å; Y585-I599 CarbonylContact O-C 3.56Å; Y585-I599 VanDerWaalsContact O-CA 3.3Å; Y585-I599 WeakPolarHBondContact O-CA 3.46Å; L586-I599 HydrophobicContact CB-CD1 3.92Å; L586-I599 HydrophobicContact CD1-CD1 3.81Å; L586-I599 HydrophobicContact CD1-CG1 4.32Å; L586-I599 HydrophobicContact CG-CD1 4.43Å; I599-Y601 HydrophobicContact CG2-CD2 3.98Å; I599-Y601 HydrophobicContact CG2-CE2 3.92Å; I599-F633 HydrophobicContact CB-CB 4.23Å; I599-F633 HydrophobicContact CB-CD1 3.84Å; I599-F633 HydrophobicContact CB-CG 4.37Å; I599-F633 WeakPolarHBondContact CG1-O 3.44Å; I599-F633 HydrophobicContact CG2-CD1 3.78Å; I599-F633 HydrophobicContact CG2-CE1 4.23Å; I599-F633 HydrophobicContact CG2-CG 4.28Å; I599-F633 WeakPolarHBondContact O-CD1 3.25Å
600	I	89.4	Confident	78.8	Confident	28 Å²	28	49.7 Å²	49.7	14%	0.144	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	121.7	172.5	-55.4	179.9	0	0	0	106.4	Y585 A587	Y585-I600 PolarHBondContact N-O 3.17Å; Y585-I600 PolarHBondContact O-N 3.32Å; A587-I600 HydrophobicContact CB-CD1 3.87Å; A587-I600 HydrophobicContact CB-CG1 4.38Å
601	Y	92	Very high	80.3	Confident	1 Å²	1	47.8 Å²	47.8	0%	0.004	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	144	166	-82.2	-92.3	0	0	0	109.1	L583 R584 I599 S608 L609 F631 S632 F633	L583-Y601 CarbonylContact O-C 3.55Å; L583-Y601 VanDerWaalsContact O-CA 3.28Å; L583-Y601 WeakPolarHBondContact O-CA 3.45Å; R584-Y601 HydrophobicContact CB-CD1 4.1Å; R584-Y601 HydrophobicContact CB-CE1 3.85Å; R584-Y601 HydrophobicContact CG-CD1 4.31Å; R584-Y601 HydrophobicContact CG-CE1 3.89Å; R584-Y601 HydrophobicContact CG-CE2 4.13Å; R584-Y601 PolarHBondContact NE-OH 2.81Å; I599-Y601 HydrophobicContact CG2-CD2 3.98Å; I599-Y601 HydrophobicContact CG2-CE2 3.92Å; Y601-S608 CarbonylContact O-C 3.42Å; Y601-S608 WeakPolarHBondContact O-CA 3.34Å; Y601-L609 PolarHBondContact N-O 2.82Å; Y601-L609 PolarHBondContact O-N 3.39Å; Y601-F631 AromaticContact CD1-CD1 3.71Å; Y601-F631 HydrophobicContact CD1-CD1 3.71Å; Y601-F631 HydrophobicContact CD1-CE1 4.05Å; Y601-F631 HydrophobicContact CD2-CD1 4.3Å; Y601-F631 AromaticContact CE1-CD1 3.64Å; Y601-F631 HydrophobicContact CE1-CD1 3.64Å; Y601-F631 HydrophobicContact CE1-CE1 4.2Å; Y601-F631 HydrophobicContact CE2-CB 4.3Å; Y601-F631 HydrophobicContact CE2-CD1 4.24Å; Y601-F631 HydrophobicContact CG-CD1 4.03Å; Y601-F631 AromaticContact CZ-CD1 3.9Å; Y601-S632 WeakPolarHBondContact CE2-O 3.5Å; Y601-S632 PolarHBondContact OH-N 3.37Å; Y601-S632 PolarHBondContact OH-O 3Å; Y601-F633 HydrophobicContact CD2-CD2 4.48Å; Y601-F633 AromaticContact CD2-CE1 3.97Å; Y601-F633 HydrophobicContact CD2-CE1 3.97Å; Y601-F633 AromaticContact CD2-CE2 3.93Å; Y601-F633 HydrophobicContact CD2-CE2 3.93Å; Y601-F633 AromaticContact CD2-CZ 3.64Å; Y601-F633 HydrophobicContact CD2-CZ 3.64Å; Y601-F633 HydrophobicContact CE2-CD2 4.47Å; Y601-F633 HydrophobicContact CE2-CE2 4.27Å; Y601-F633 HydrophobicContact CE2-CZ 4.39Å
602	T	90.4	Very high	81.9	Confident	3 Å²	3	46.5 Å²	46.5	2%	0.018	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	124.3	168	-73.3	0	0	0	0	108	W582 L583 G606 R607 S608	W582-T602 CarbonylContact C-O 3.49Å; W582-T602 WeakPolarHBondContact CA-O 3.28Å; L583-T602 PolarHBondContact N-O 2.89Å; L583-T602 PolarHBondContact O-N 2.85Å; T602-G606 WeakPolarHBondContact CG2-O 3.22Å; T602-R607 WeakPolarHBondContact CA-O 3.44Å; T602-S608 PolarHBondContact OG1-OG 3.06Å
603	A	91.5	Very high	83.5	Confident	2 Å²	2	47.5 Å²	47.5	2%	0.017	24%	0.236	C	C	.	.			trans	-74.6	164.3	176.7	0	0	0	0	0	111.6	W582 C605 G606 R607 F618	W582-A603 HydrophobicContact CD2-CB 4.33Å; W582-A603 HydrophobicContact CE3-CB 3.9Å; W582-A603 HydrophobicContact CH2-CB 3.89Å; W582-A603 HydrophobicContact CZ2-CB 4.28Å; W582-A603 HydrophobicContact CZ3-CB 3.67Å; A603-C605 PolarHBondContact O-N 2.98Å; A603-G606 PolarHBondContact O-N 3.47Å; A603-R607 HydrophobicContact CB-CB 4.48Å; A603-R607 PolarHBondContact N-O 2.71Å; A603-F618 HydrophobicContact CB-CD1 4.43Å; A603-F618 HydrophobicContact CB-CD2 4.44Å; A603-F618 HydrophobicContact CB-CE1 3.8Å; A603-F618 HydrophobicContact CB-CE2 3.82Å; A603-F618 HydrophobicContact CB-CZ 3.45Å; A603-F618 VanDerWaalsContact CB-CZ 3.45Å
604	P	87.8	Confident	85.4	Confident	5 Å²	5	47.4 Å²	47.4	3%	0.032	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-8	-174.9	-22	33.1	0	0	0	115.5	S548 C580 G581 W582	S548-P604 VanDerWaalsContact CB-O 3.23Å; S548-P604 WeakPolarHBondContact CB-O 3.33Å; C580-P604 WeakPolarHBondContact O-CG 3.21Å; G581-P604 WeakPolarHBondContact O-CA 3.27Å; W582-P604 HydrophobicContact CG-CG 4.31Å
605	C	88.2	Confident	87.1	Confident	5 Å²	5	43.7 Å²	43.7	3%	0.034	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	16.5	173.2	64	0	0	0	0	113.9	C545 A603 R607	C545-C605 HydrophobicContact CB-CB 3.72Å; A603-C605 PolarHBondContact O-N 2.98Å; C605-R607 PolarHBondContact O-N 2.8Å
606	G	88.3	Confident	88.7	Confident	1 Å²	1	41 Å²	41	1%	0.01	20%	0.196	C	C	.	.	S	Bend	trans	78.9	-9.7	-177.5	0	0	0	0	0	115.1	K534 T602 A603 S608	K534-G606 WeakPolarHBondContact O-CA 3.32Å; T602-G606 WeakPolarHBondContact CG2-O 3.22Å; A603-G606 PolarHBondContact O-N 3.47Å; G606-S608 PolarHBondContact O-N 2.92Å
607	R	91	Very high	90.2	Very high	102 Å²	102	41.8 Å²	41.8	39%	0.385	20%	0.195	S	C	.	.			trans	-69	116.3	-175	-174.2	175.5	-177.5	119.5	7.3	112.5	F536 C541 T602 A603 C605 L609	F536-R607 HydrophobicContact CD2-CB 3.77Å; F536-R607 HydrophobicContact CD2-CG 4.4Å; F536-R607 HydrophobicContact CE2-CB 3.75Å; F536-R607 HydrophobicContact CE2-CG 4.1Å; C541-R607 VanDerWaalsContact SG-CD 3.51Å; C541-R607 PolarHBondContact SG-NH1 3.14Å; C541-R607 VanDerWaalsContact SG-NH1 3.36Å; T602-R607 WeakPolarHBondContact CA-O 3.44Å; A603-R607 HydrophobicContact CB-CB 4.48Å; A603-R607 PolarHBondContact N-O 2.71Å; C605-R607 PolarHBondContact O-N 2.8Å; R607-L609 HydrophobicContact CG-CD2 3.94Å
608	S	91.8	Very high	91.3	Very high	41 Å²	41	40.3 Å²	40.3	29%	0.287	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	133.9	170.8	-60.1	0	0	0	0	112.8	Y601 T602 G606	Y601-S608 CarbonylContact O-C 3.42Å; Y601-S608 WeakPolarHBondContact O-CA 3.34Å; T602-S608 PolarHBondContact OG1-OG 3.06Å; G606-S608 PolarHBondContact O-N 2.92Å
609	L	93.5	Very high	92.1	Very high	4 Å²	4	37.1 Å²	37.1	2%	0.021	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	135.1	176.6	-50.5	-178.5	0	0	0	109.4	W582 Y601 R607 E614 V615 F618	W582-L609 HydrophobicContact CH2-CD1 4Å; W582-L609 HydrophobicContact CZ3-CD1 3.73Å; Y601-L609 PolarHBondContact N-O 2.82Å; Y601-L609 PolarHBondContact O-N 3.39Å; R607-L609 HydrophobicContact CG-CD2 3.94Å; L609-E614 WeakPolarHBondContact CA-OE2 3.5Å; L609-E614 HydrophobicContact CB-CB 3.97Å; L609-E614 HydrophobicContact CD2-CB 4.23Å; L609-V615 HydrophobicContact CB-CG2 4.34Å; L609-V615 HydrophobicContact CD1-CG2 4.06Å; L609-F618 HydrophobicContact CD1-CB 3.62Å; L609-F618 HydrophobicContact CD1-CD2 4.26Å; L609-F618 HydrophobicContact CD1-CG 3.92Å; L609-F618 HydrophobicContact CD2-CD2 4.44Å
610	R	91	Very high	92.3	Very high	176 Å²	176	40.5 Å²	40.5	66%	0.664	19%	0.185	S	C	*	.			trans	-114.5	-0.2	-167.5	-57.7	177.5	-177.2	138.1	-0.2	114.5	E614	R610-E614 PolarHBondContact N-OE2 3.18Å
611	S	94.2	Very high	92.5	Very high	38 Å²	38	44.7 Å²	44.7	27%	0.266	20%	0.202	S	C	.	.	S	Bend	trans	-152.3	160.6	-178.9	64.7	0	0	0	0	112.8	H613 E614 V615 F633	S611-H613 PolarHBondContact O-N 2.82Å; S611-E614 WeakPolarHBondContact CB-OE1 3.33Å; S611-E614 PolarHBondContact N-OE1 2.87Å; S611-E614 PolarHBondContact O-N 3.21Å; S611-E614 VanDerWaalsContact O-N 3.16Å; S611-E614 WeakPolarHBondContact OG-CG 3.49Å; S611-E614 PolarHBondContact OG-N 2.81Å; S611-E614 PolarHBondContact OG-OE1 2.97Å; S611-V615 PolarHBondContact O-N 2.68Å; S611-V615 VanDerWaalsContact O-N 3.08Å; S611-F633 WeakPolarHBondContact O-CE2 3.37Å; S611-F633 WeakPolarHBondContact O-CZ 3.41Å
612	M	94.2	Very high	92.6	Very high	27 Å²	27	44.7 Å²	44.7	13%	0.133	20%	0.203	C	C	.	.	H	α-helix	trans	-58.6	-33.6	173.3	-63.3	-67.5	-63.9	0	0	112.2	V615 E616 A628 F631 F633 Y741	M612-V615 PolarHBondContact O-N 3.37Å; M612-E616 WeakPolarHBondContact O-CB 3.23Å; M612-E616 PolarHBondContact O-N 3.47Å; M612-A628 HydrophobicContact CE-CB 4.3Å; M612-A628 WeakPolarHBondContact CE-O 3.39Å; M612-F631 HydrophobicContact SD-CB 4.49Å; M612-F633 HydrophobicContact CG-CD2 3.94Å; M612-F633 HydrophobicContact CG-CE2 4.42Å; M612-F633 HydrophobicContact SD-CD2 3.61Å; M612-F633 HydrophobicContact SD-CE2 4.03Å; M612-Y741 HydrophobicContact CB-CD1 4.02Å; M612-Y741 HydrophobicContact CB-CD2 3.59Å; M612-Y741 HydrophobicContact CB-CE1 4.04Å; M612-Y741 HydrophobicContact CB-CE2 3.61Å; M612-Y741 HydrophobicContact CB-CG 3.8Å; M612-Y741 HydrophobicContact CE-CD2 4.32Å; M612-Y741 HydrophobicContact CE-CG 3.95Å; M612-Y741 HydrophobicContact CG-CD2 4.04Å; M612-Y741 HydrophobicContact CG-CE2 4.35Å; M612-Y741 HydrophobicContact CG-CG 4.42Å
613	H	93.8	Very high	92.7	Very high	81 Å²	81	48.8 Å²	48.8	38%	0.375	22%	0.224	S	C	.	.	H	α-helix	trans	-66.9	-39.8	176.4	-179.7	67.3	0	0	0	112.4	S611 R617	S611-H613 PolarHBondContact O-N 2.82Å; H613-R617 PolarHBondContact NE2-NH1 3.49Å; H613-R617 VanDerWaalsContact NE2-NH1 3.14Å; H613-R617 VanDerWaalsContact O-CB 3.26Å; H613-R617 WeakPolarHBondContact O-CB 3.12Å; H613-R617 PolarHBondContact O-N 3.01Å
614	E	95.5	Very high	92.7	Very high	65 Å²	65	48.8 Å²	48.8	30%	0.304	22%	0.224	S	C	.	.	H	α-helix	trans	-66.3	-38.4	173.5	-74.5	160.3	-106.4	0	0	112	L609 R610 S611 F618	L609-E614 WeakPolarHBondContact CA-OE2 3.5Å; L609-E614 HydrophobicContact CB-CB 3.97Å; L609-E614 HydrophobicContact CD2-CB 4.23Å; R610-E614 PolarHBondContact N-OE2 3.18Å; S611-E614 WeakPolarHBondContact CB-OE1 3.33Å; S611-E614 PolarHBondContact N-OE1 2.87Å; S611-E614 PolarHBondContact O-N 3.21Å; S611-E614 VanDerWaalsContact O-N 3.16Å; S611-E614 WeakPolarHBondContact OG-CG 3.49Å; S611-E614 PolarHBondContact OG-N 2.81Å; S611-E614 PolarHBondContact OG-OE1 2.97Å; E614-F618 WeakPolarHBondContact O-CB 3.47Å; E614-F618 PolarHBondContact O-N 2.97Å
615	V	95.7	Very high	92.9	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62.4	-54.6	172.9	171.1	0	0	0	0	110.8	L609 S611 M612 R617 F618 L619 F631 F633	L609-V615 HydrophobicContact CB-CG2 4.34Å; L609-V615 HydrophobicContact CD1-CG2 4.06Å; S611-V615 PolarHBondContact O-N 2.68Å; S611-V615 VanDerWaalsContact O-N 3.08Å; M612-V615 PolarHBondContact O-N 3.37Å; V615-R617 VanDerWaalsContact C-N 3.31Å; V615-R617 PolarHBondContact O-N 2.86Å; V615-F618 WeakPolarHBondContact O-CA 3.48Å; V615-F618 WeakPolarHBondContact O-CB 3.35Å; V615-F618 PolarHBondContact O-N 2.88Å; V615-L619 HydrophobicContact CG1-CD1 3.84Å; V615-L619 HydrophobicContact CG1-CG 4.15Å; V615-L619 WeakPolarHBondContact O-CG 3.3Å; V615-L619 PolarHBondContact O-N 2.97Å; V615-F631 HydrophobicContact CG1-CB 4.2Å; V615-F631 HydrophobicContact CG1-CD1 4.04Å; V615-F631 HydrophobicContact CG1-CD2 3.63Å; V615-F631 HydrophobicContact CG1-CE1 4.35Å; V615-F631 HydrophobicContact CG1-CE2 3.96Å; V615-F631 HydrophobicContact CG1-CG 3.68Å; V615-F631 HydrophobicContact CG1-CZ 4.31Å; V615-F631 HydrophobicContact CG2-CD1 4.3Å; V615-F631 HydrophobicContact CG2-CG 4.47Å; V615-F633 HydrophobicContact CG2-CE2 3.75Å; V615-F633 HydrophobicContact CG2-CZ 3.85Å
616	E	93.8	Very high	93.2	Very high	27 Å²	27	51.5 Å²	51.5	13%	0.126	24%	0.236	C	C	.	.	H	α-helix	trans	-59.3	-40.4	-178.9	-170.1	-179.3	-123.5	0	0	111.9	M612 D620 R709 Y741 S766	M612-E616 WeakPolarHBondContact O-CB 3.23Å; M612-E616 PolarHBondContact O-N 3.47Å; E616-D620 VanDerWaalsContact O-CB 3.26Å; E616-D620 WeakPolarHBondContact O-CB 3.47Å; E616-D620 PolarHBondContact O-N 2.92Å; E616-D620 VanDerWaalsContact O-N 3.09Å; E616-R709 HydrophobicContact CG-CG 4.43Å; E616-R709 WeakPolarHBondContact OE2-CG 3.47Å; E616-Y741 HydrophobicContact CB-CD1 4.36Å; E616-Y741 HydrophobicContact CB-CE1 4.37Å; E616-Y741 WeakPolarHBondContact OE2-CE1 3.44Å; E616-S766 PolarHBondContact OE1-OG 3.09Å; E616-S766 VanDerWaalsContact OE1-OG 3.05Å
617	R	93.9	Very high	93.5	Very high	145 Å²	145	51.8 Å²	51.8	55%	0.547	24%	0.238	S	C	.	.	H	α-helix	trans	-66	-33	172.7	178.7	178	-91.1	152.2	-8.9	113	H613 V615 K621	H613-R617 PolarHBondContact NE2-NH1 3.49Å; H613-R617 VanDerWaalsContact NE2-NH1 3.14Å; H613-R617 VanDerWaalsContact O-CB 3.26Å; H613-R617 WeakPolarHBondContact O-CB 3.12Å; H613-R617 PolarHBondContact O-N 3.01Å; V615-R617 VanDerWaalsContact C-N 3.31Å; V615-R617 PolarHBondContact O-N 2.86Å; R617-K621 VanDerWaalsContact O-CB 3.25Å; R617-K621 WeakPolarHBondContact O-CB 3.42Å; R617-K621 PolarHBondContact O-N 2.93Å; R617-K621 VanDerWaalsContact O-N 3.12Å
618	F	95.2	Very high	93.7	Very high	9 Å²	9	47.2 Å²	47.2	4%	0.039	22%	0.221	C	C	.	.	H	α-helix	trans	-72.8	-45.7	175.6	-176.1	-82.6	0	0	0	111.8	C541 C545 L546 W582 A603 L609 E614 V615 D620 K621 T622	C541-F618 HydrophobicContact CB-CE2 4.1Å; C545-F618 HydrophobicContact CB-CZ 3.96Å; L546-F618 HydrophobicContact CD2-CE1 4.13Å; W582-F618 AromaticContact CH2-CD1 3.38Å; W582-F618 HydrophobicContact CH2-CD1 3.38Å; W582-F618 AromaticContact CH2-CE1 3.72Å; W582-F618 HydrophobicContact CH2-CE1 3.72Å; W582-F618 HydrophobicContact CH2-CG 4.12Å; W582-F618 AromaticContact CZ2-CD1 3.67Å; W582-F618 HydrophobicContact CZ2-CD1 3.67Å; W582-F618 AromaticContact CZ2-CE1 3.67Å; W582-F618 HydrophobicContact CZ2-CE1 3.67Å; W582-F618 HydrophobicContact CZ3-CD1 4.5Å; A603-F618 HydrophobicContact CB-CD1 4.43Å; A603-F618 HydrophobicContact CB-CD2 4.44Å; A603-F618 HydrophobicContact CB-CE1 3.8Å; A603-F618 HydrophobicContact CB-CE2 3.82Å; A603-F618 HydrophobicContact CB-CZ 3.45Å; A603-F618 VanDerWaalsContact CB-CZ 3.45Å; L609-F618 HydrophobicContact CD1-CB 3.62Å; L609-F618 HydrophobicContact CD1-CD2 4.26Å; L609-F618 HydrophobicContact CD1-CG 3.92Å; L609-F618 HydrophobicContact CD2-CD2 4.44Å; E614-F618 WeakPolarHBondContact O-CB 3.47Å; E614-F618 PolarHBondContact O-N 2.97Å; V615-F618 WeakPolarHBondContact O-CA 3.48Å; V615-F618 WeakPolarHBondContact O-CB 3.35Å; V615-F618 PolarHBondContact O-N 2.88Å; F618-D620 VanDerWaalsContact C-N 3.34Å; F618-D620 PolarHBondContact O-N 2.93Å; F618-K621 PolarHBondContact O-N 3.23Å; F618-T622 HydrophobicContact CD1-CG2 3.93Å; F618-T622 HydrophobicContact CD2-CG2 4.38Å; F618-T622 HydrophobicContact CE1-CG2 3.54Å; F618-T622 HydrophobicContact CE2-CG2 4.03Å; F618-T622 HydrophobicContact CG-CG2 4.34Å; F618-T622 HydrophobicContact CZ-CG2 3.59Å; F618-T622 WeakPolarHBondContact O-CB 3.37Å; F618-T622 WeakPolarHBondContact O-CG2 3.41Å; F618-T622 PolarHBondContact O-N 3.26Å; F618-T622 PolarHBondContact O-OG1 2.69Å
619	L	94.7	Very high	93.8	Very high	12 Å²	12	46.5 Å²	46.5	6%	0.063	21%	0.214	C	C	.	.	H	α-helix	trans	-59.4	-46.6	179.3	-66	176.7	0	0	0	110.9	W582 V615 T622 N623 S624 L626 F631	W582-L619 HydrophobicContact CH2-CD2 4.31Å; W582-L619 HydrophobicContact CZ2-CD2 3.86Å; V615-L619 HydrophobicContact CG1-CD1 3.84Å; V615-L619 HydrophobicContact CG1-CG 4.15Å; V615-L619 WeakPolarHBondContact O-CG 3.3Å; V615-L619 PolarHBondContact O-N 2.97Å; L619-T622 PolarHBondContact O-N 3.03Å; L619-T622 PolarHBondContact O-OG1 3.08Å; L619-N623 PolarHBondContact O-N 2.65Å; L619-S624 WeakPolarHBondContact CD2-OG 3.3Å; L619-S624 PolarHBondContact O-N 2.81Å; L619-L626 HydrophobicContact CD2-CB 3.96Å; L619-F631 HydrophobicContact CD1-CE2 4.06Å; L619-F631 HydrophobicContact CD2-CE2 4.34Å; L619-F631 HydrophobicContact CD2-CZ 4.48Å
620	D	92.6	Very high	93.9	Very high	78 Å²	78	46.8 Å²	46.8	42%	0.417	22%	0.216	S	C	.	.	H	α-helix	trans	-55.2	-58.9	171.9	172.9	59.1	0	0	0	111.7	E616 F618 T622 N623 R709	E616-D620 VanDerWaalsContact O-CB 3.26Å; E616-D620 WeakPolarHBondContact O-CB 3.47Å; E616-D620 PolarHBondContact O-N 2.92Å; E616-D620 VanDerWaalsContact O-N 3.09Å; F618-D620 VanDerWaalsContact C-N 3.34Å; F618-D620 PolarHBondContact O-N 2.93Å; D620-T622 PolarHBondContact O-N 3Å; D620-N623 PolarHBondContact O-N 2.98Å; D620-R709 IonicContact OD1-NH2 3.41Å; D620-R709 IonicContact OD2-CZ 2.61Å; D620-R709 IonicContact OD2-NH1 3.06Å; D620-R709 PolarHBondContact OD2-NH1 2.68Å; D620-R709 IonicContact OD2-NH2 3.56Å; D620-R709 PolarHBondContact OD2-NH2 2.92Å
621	K	93.3	Very high	94.2	Very high	117 Å²	117	38.4 Å²	38.4	51%	0.509	18%	0.184	S	C	.	.	H	α-helix	trans	-64.4	-25.2	-175.7	-163	-176.3	-175	-139.5	0	114.2	C541 R617 F618	C541-K621 WeakPolarHBondContact O-CD 3.4Å; C541-K621 WeakPolarHBondContact O-CE 3.48Å; C541-K621 PolarHBondContact O-NZ 2.74Å; R617-K621 VanDerWaalsContact O-CB 3.25Å; R617-K621 WeakPolarHBondContact O-CB 3.42Å; R617-K621 PolarHBondContact O-N 2.93Å; R617-K621 VanDerWaalsContact O-N 3.12Å; F618-K621 PolarHBondContact O-N 3.23Å
622	T	93.5	Very high	94.2	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.006	17%	0.173	C	C	.	.	H	α-helix	trans	-93.1	-4.1	175.9	58.5	0	0	0	0	113.6	G542 H543 C545 L546 F618 L619 D620 S624	G542-T622 WeakPolarHBondContact O-CG2 3.33Å; H543-T622 VanDerWaalsContact CA-O 3.3Å; H543-T622 WeakPolarHBondContact CA-O 3.17Å; H543-T622 WeakPolarHBondContact CB-O 3.5Å; H543-T622 PolarHBondContact ND1-O 3.25Å; H543-T622 VanDerWaalsContact ND1-O 3.16Å; C545-T622 HydrophobicContact CB-CG2 4.09Å; L546-T622 WeakPolarHBondContact CD1-O 3.31Å; L546-T622 HydrophobicContact CD2-CG2 4.49Å; F618-T622 HydrophobicContact CD1-CG2 3.93Å; F618-T622 HydrophobicContact CD2-CG2 4.38Å; F618-T622 HydrophobicContact CE1-CG2 3.54Å; F618-T622 HydrophobicContact CE2-CG2 4.03Å; F618-T622 HydrophobicContact CG-CG2 4.34Å; F618-T622 HydrophobicContact CZ-CG2 3.59Å; F618-T622 WeakPolarHBondContact O-CB 3.37Å; F618-T622 WeakPolarHBondContact O-CG2 3.41Å; F618-T622 PolarHBondContact O-N 3.26Å; F618-T622 PolarHBondContact O-OG1 2.69Å; L619-T622 PolarHBondContact O-N 3.03Å; L619-T622 PolarHBondContact O-OG1 3.08Å; D620-T622 PolarHBondContact O-N 3Å; T622-S624 PolarHBondContact O-N 2.72Å
623	N	92.4	Very high	94.1	Very high	89 Å²	89	37.4 Å²	37.4	48%	0.476	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	36.6	-170.7	-165.4	27.6	0	0	0	112.3	L619 D620 R764	L619-N623 PolarHBondContact O-N 2.65Å; D620-N623 PolarHBondContact O-N 2.98Å; N623-R764 PolarHBondContact O-NH1 2.95Å; N623-R764 PolarHBondContact OD1-NH1 3.41Å; N623-R764 PolarHBondContact OD1-NH2 2.82Å; N623-R764 VanDerWaalsContact OD1-NH2 3.1Å
624	S	92.8	Very high	93.8	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.014	17%	0.174	C	C	.	.			trans	-61.8	152.2	179.8	174.5	0	0	0	0	111.4	E563 L619 T622 L626 R764	E563-S624 WeakPolarHBondContact OE2-CA 3.29Å; E563-S624 VanDerWaalsContact OE2-CB 3.28Å; E563-S624 WeakPolarHBondContact OE2-CB 3.17Å; E563-S624 PolarHBondContact OE2-OG 3.1Å; L619-S624 WeakPolarHBondContact CD2-OG 3.3Å; L619-S624 PolarHBondContact O-N 2.81Å; T622-S624 PolarHBondContact O-N 2.72Å; S624-L626 PolarHBondContact OG-N 2.82Å; S624-R764 WeakPolarHBondContact O-CD 3.32Å; S624-R764 PolarHBondContact O-NH1 3.36Å
625	Q	92.5	Very high	93.3	Very high	63 Å²	63	35.5 Å²	35.5	29%	0.294	17%	0.173	S	C	.	.	S	Bend	trans	-93.1	-1.1	177.9	-69.9	-60.5	-49.5	0	0	113	E563 P565 R763	E563-Q625 HydrophobicContact CB-CB 4.17Å; E563-Q625 CarbonylContact O-C 3.57Å; E563-Q625 WeakPolarHBondContact O-CB 3.21Å; E563-Q625 PolarHBondContact OE2-N 2.82Å; P565-Q625 WeakPolarHBondContact CD-O 3.45Å; Q625-R763 PolarHBondContact O-NH2 3.27Å
626	L	94.2	Very high	92.7	Very high	3 Å²	3	40.9 Å²	40.9	2%	0.016	21%	0.206	C	C	.	.			trans	-79.6	161.3	170.9	-55	-176.2	0	0	0	112.3	E563 P565 I576 C580 L619 S624 L630 F631	E563-L626 WeakPolarHBondContact O-CD2 3.24Å; P565-L626 HydrophobicContact CG-CD2 3.93Å; I576-L626 HydrophobicContact CG2-CD2 4.03Å; C580-L626 HydrophobicContact CB-CD1 3.98Å; L619-L626 HydrophobicContact CD2-CB 3.96Å; S624-L626 PolarHBondContact OG-N 2.82Å; L626-L630 HydrophobicContact CB-CD1 4.12Å; L626-L630 HydrophobicContact CD2-CD1 3.94Å; L626-F631 HydrophobicContact CB-CE2 4.43Å; L626-F631 HydrophobicContact CD1-CE2 4.48Å; L626-F631 HydrophobicContact CD1-CZ 4.17Å
627	T	95	Very high	92.3	Very high	8 Å²	8	40 Å²	40	5%	0.049	20%	0.202	C	C	.	.			trans	-125.4	156.5	179.7	53.1	0	0	0	0	112.1	D629 L630 R764	T627-D629 VanDerWaalsContact C-N 3.28Å; T627-D629 WeakPolarHBondContact CB-OD1 3.12Å; T627-D629 PolarHBondContact O-N 2.85Å; T627-D629 PolarHBondContact OG1-OD1 2.9Å; T627-L630 WeakPolarHBondContact O-CB 3.32Å; T627-L630 WeakPolarHBondContact O-CG 3.48Å; T627-L630 PolarHBondContact O-N 3.06Å; T627-L630 VanDerWaalsContact O-N 3.12Å; T627-R764 HydrophobicContact CG2-CB 4.03Å; T627-R764 HydrophobicContact CG2-CG 4.15Å
628	A	95	Very high	91.9	Very high	5 Å²	5	35.5 Å²	35.5	4%	0.041	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-64.7	-26.8	-169.6	0	0	0	0	0	114.5	M612 L630 F631	M612-A628 HydrophobicContact CE-CB 4.3Å; M612-A628 WeakPolarHBondContact CE-O 3.39Å; A628-L630 PolarHBondContact O-N 2.77Å; A628-F631 PolarHBondContact O-N 3.14Å; A628-F631 VanDerWaalsContact O-N 3.1Å
629	D	94.2	Very high	91.6	Very high	26 Å²	26	35.1 Å²	35.1	14%	0.139	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-65.8	-15.9	174.8	45	-15	0	0	0	114.4	T627 F631 R742 R743	T627-D629 VanDerWaalsContact C-N 3.28Å; T627-D629 WeakPolarHBondContact CB-OD1 3.12Å; T627-D629 PolarHBondContact O-N 2.85Å; T627-D629 PolarHBondContact OG1-OD1 2.9Å; D629-F631 PolarHBondContact O-N 2.94Å; D629-R742 HydrophobicContact CB-CB 3.85Å; D629-R742 IonicContact OD1-CZ 2.6Å; D629-R742 IonicContact OD1-NE 2.72Å; D629-R742 PolarHBondContact OD1-NE 3.18Å; D629-R742 IonicContact OD1-NH2 2.7Å; D629-R742 IonicContact OD2-CZ 3.42Å; D629-R742 VanDerWaalsContact OD2-CZ 3.28Å; D629-R742 IonicContact OD2-NE 2.69Å; D629-R742 PolarHBondContact OD2-NE 3.44Å; D629-R742 IonicContact OD2-NH2 3.05Å; D629-R742 PolarHBondContact OD2-NH2 2.93Å; D629-R743 PolarHBondContact O-NH2 3.37Å
630	L	95.4	Very high	91.2	Very high	10 Å²	10	34.6 Å²	34.6	5%	0.052	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-75	-8.9	171	-50.7	-178.9	0	0	0	112.8	P565 P573 L574 I576 P577 L626 T627 A628	P565-L630 HydrophobicContact CB-CD1 4.42Å; P565-L630 HydrophobicContact CG-CD1 4.02Å; P573-L630 HydrophobicContact CB-CD2 3.82Å; P573-L630 WeakPolarHBondContact O-CD2 3.45Å; L574-L630 WeakPolarHBondContact CD2-O 3.26Å; I576-L630 HydrophobicContact CB-CD1 4.49Å; I576-L630 HydrophobicContact CD1-CD2 4.4Å; I576-L630 HydrophobicContact CG2-CD1 4.23Å; P577-L630 HydrophobicContact CG-CB 3.95Å; L626-L630 HydrophobicContact CB-CD1 4.12Å; L626-L630 HydrophobicContact CD2-CD1 3.94Å; T627-L630 WeakPolarHBondContact O-CB 3.32Å; T627-L630 WeakPolarHBondContact O-CG 3.48Å; T627-L630 PolarHBondContact O-N 3.06Å; T627-L630 VanDerWaalsContact O-N 3.12Å; A628-L630 PolarHBondContact O-N 2.77Å
631	F	96	Very high	90.9	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.176	C	C	.	.			trans	-113.7	141.2	-176	-62.5	-96.6	0	0	0	112	P577 W582 Y601 M612 V615 L619 L626 A628 D629 R743	P577-F631 HydrophobicContact CB-CE1 3.81Å; P577-F631 HydrophobicContact CB-CZ 3.9Å; P577-F631 HydrophobicContact CG-CD1 4.35Å; P577-F631 HydrophobicContact CG-CE1 3.96Å; P577-F631 HydrophobicContact CG-CE2 4.16Å; P577-F631 HydrophobicContact CG-CZ 3.86Å; W582-F631 AromaticContact CD2-CE1 3.7Å; W582-F631 HydrophobicContact CD2-CE1 3.7Å; W582-F631 AromaticContact CD2-CZ 3.9Å; W582-F631 HydrophobicContact CD2-CZ 3.9Å; W582-F631 AromaticContact CE2-CZ 3.86Å; W582-F631 AromaticContact CE3-CE1 3.54Å; W582-F631 HydrophobicContact CE3-CE1 3.54Å; W582-F631 HydrophobicContact CE3-CZ 4.1Å; W582-F631 HydrophobicContact CG-CE1 4.24Å; W582-F631 HydrophobicContact CG-CZ 4.44Å; W582-F631 HydrophobicContact CH2-CE1 4.23Å; W582-F631 HydrophobicContact CH2-CZ 4.16Å; W582-F631 HydrophobicContact CZ2-CE1 4.39Å; W582-F631 HydrophobicContact CZ2-CZ 4Å; W582-F631 AromaticContact CZ3-CE1 3.82Å; W582-F631 HydrophobicContact CZ3-CE1 3.82Å; W582-F631 HydrophobicContact CZ3-CZ 4.22Å; Y601-F631 AromaticContact CD1-CD1 3.71Å; Y601-F631 HydrophobicContact CD1-CD1 3.71Å; Y601-F631 HydrophobicContact CD1-CE1 4.05Å; Y601-F631 HydrophobicContact CD2-CD1 4.3Å; Y601-F631 AromaticContact CE1-CD1 3.64Å; Y601-F631 HydrophobicContact CE1-CD1 3.64Å; Y601-F631 HydrophobicContact CE1-CE1 4.2Å; Y601-F631 HydrophobicContact CE2-CB 4.3Å; Y601-F631 HydrophobicContact CE2-CD1 4.24Å; Y601-F631 HydrophobicContact CG-CD1 4.03Å; Y601-F631 AromaticContact CZ-CD1 3.9Å; M612-F631 HydrophobicContact SD-CB 4.49Å; V615-F631 HydrophobicContact CG1-CB 4.2Å; V615-F631 HydrophobicContact CG1-CD1 4.04Å; V615-F631 HydrophobicContact CG1-CD2 3.63Å; V615-F631 HydrophobicContact CG1-CE1 4.35Å; V615-F631 HydrophobicContact CG1-CE2 3.96Å; V615-F631 HydrophobicContact CG1-CG 3.68Å; V615-F631 HydrophobicContact CG1-CZ 4.31Å; V615-F631 HydrophobicContact CG2-CD1 4.3Å; V615-F631 HydrophobicContact CG2-CG 4.47Å; L619-F631 HydrophobicContact CD1-CE2 4.06Å; L619-F631 HydrophobicContact CD2-CE2 4.34Å; L619-F631 HydrophobicContact CD2-CZ 4.48Å; L626-F631 HydrophobicContact CB-CE2 4.43Å; L626-F631 HydrophobicContact CD1-CE2 4.48Å; L626-F631 HydrophobicContact CD1-CZ 4.17Å; A628-F631 PolarHBondContact O-N 3.14Å; A628-F631 VanDerWaalsContact O-N 3.1Å; D629-F631 PolarHBondContact O-N 2.94Å; F631-R743 PolarHBondContact O-NH1 3.06Å; F631-R743 PolarHBondContact O-NH2 3.17Å
632	S	94	Very high	90.8	Very high	4 Å²	4	28.9 Å²	28.9	3%	0.028	16%	0.156	C	C	.	.			trans	-141.6	119.2	177.6	-174.5	0	0	0	0	113.4	R584 Y601 D634	R584-S632 PolarHBondContact NE-O 3.32Å; R584-S632 PolarHBondContact NH2-O 3.43Å; Y601-S632 WeakPolarHBondContact CE2-O 3.5Å; Y601-S632 PolarHBondContact OH-N 3.37Å; Y601-S632 PolarHBondContact OH-O 3Å; S632-D634 VanDerWaalsContact C-N 3.28Å; S632-D634 PolarHBondContact OG-N 3.25Å
633	F	92.4	Very high	90.7	Very high	41 Å²	41	30.5 Å²	30.5	18%	0.18	16%	0.163	C	C	.	.			trans	-86.2	7.4	174.6	-72.6	-94	0	0	0	113.8	I599 Y601 S611 M612 V615 S635	I599-F633 HydrophobicContact CB-CB 4.23Å; I599-F633 HydrophobicContact CB-CD1 3.84Å; I599-F633 HydrophobicContact CB-CG 4.37Å; I599-F633 WeakPolarHBondContact CG1-O 3.44Å; I599-F633 HydrophobicContact CG2-CD1 3.78Å; I599-F633 HydrophobicContact CG2-CE1 4.23Å; I599-F633 HydrophobicContact CG2-CG 4.28Å; I599-F633 WeakPolarHBondContact O-CD1 3.25Å; Y601-F633 HydrophobicContact CD2-CD2 4.48Å; Y601-F633 AromaticContact CD2-CE1 3.97Å; Y601-F633 HydrophobicContact CD2-CE1 3.97Å; Y601-F633 AromaticContact CD2-CE2 3.93Å; Y601-F633 HydrophobicContact CD2-CE2 3.93Å; Y601-F633 AromaticContact CD2-CZ 3.64Å; Y601-F633 HydrophobicContact CD2-CZ 3.64Å; Y601-F633 HydrophobicContact CE2-CD2 4.47Å; Y601-F633 HydrophobicContact CE2-CE2 4.27Å; Y601-F633 HydrophobicContact CE2-CZ 4.39Å; S611-F633 WeakPolarHBondContact O-CE2 3.37Å; S611-F633 WeakPolarHBondContact O-CZ 3.41Å; M612-F633 HydrophobicContact CG-CD2 3.94Å; M612-F633 HydrophobicContact CG-CE2 4.42Å; M612-F633 HydrophobicContact SD-CD2 3.61Å; M612-F633 HydrophobicContact SD-CE2 4.03Å; V615-F633 HydrophobicContact CG2-CE2 3.75Å; V615-F633 HydrophobicContact CG2-CZ 3.85Å; F633-S635 PolarHBondContact O-N 2.91Å
634	D	88.8	Confident	90.5	Very high	66 Å²	66	32.1 Å²	32.1	35%	0.353	16%	0.163	S	C	.	.			trans	-67.8	113.8	174	-170.3	-27.7	0	0	0	110.8	R584 S632 T636 L637	R584-D634 PolarHBondContact NH2-O 3.17Å; S632-D634 VanDerWaalsContact C-N 3.28Å; S632-D634 PolarHBondContact OG-N 3.25Å; D634-T636 PolarHBondContact O-N 3.03Å; D634-T636 WeakPolarHBondContact OD1-CA 3.03Å; D634-T636 WeakPolarHBondContact OD1-CB 3.35Å; D634-T636 PolarHBondContact OD1-N 3.35Å; D634-T636 PolarHBondContact OD1-OG1 3.21Å; D634-L637 HydrophobicContact CB-CB 4.02Å; D634-L637 PolarHBondContact O-N 3.34Å
635	S	84.7	Confident	90.2	Very high	39 Å²	39	33.2 Å²	33.2	27%	0.273	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-10.7	-179.5	55.2	0	0	0	0	114.3	F633	F633-S635 PolarHBondContact O-N 2.91Å
636	T	82.7	Confident	89.5	Confident	114 Å²	114	35.9 Å²	35.9	70%	0.699	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-19.3	173.6	73.7	0	0	0	0	112.7	D634 I638	D634-T636 PolarHBondContact O-N 3.03Å; D634-T636 WeakPolarHBondContact OD1-CA 3.03Å; D634-T636 WeakPolarHBondContact OD1-CB 3.35Å; D634-T636 PolarHBondContact OD1-N 3.35Å; D634-T636 PolarHBondContact OD1-OG1 3.21Å; T636-I638 PolarHBondContact O-N 3.39Å
637	L	86.2	Confident	88.8	Confident	8 Å²	8	41.1 Å²	41.1	4%	0.042	21%	0.207	C	C	.	.			trans	-79	121	-179.2	-163.8	158.3	0	0	0	110.5	L574 R584 D634 I639 A795 P797	L574-L637 HydrophobicContact CD1-CD1 3.66Å; L574-L637 HydrophobicContact CD1-CD2 3.63Å; L574-L637 HydrophobicContact CD1-CG 4.33Å; R584-L637 PolarHBondContact NH1-O 3.44Å; D634-L637 HydrophobicContact CB-CB 4.02Å; D634-L637 PolarHBondContact O-N 3.34Å; L637-I639 HydrophobicContact CD2-CB 4.44Å; L637-I639 HydrophobicContact CD2-CD1 4.47Å; L637-I639 HydrophobicContact CD2-CG1 3.43Å; L637-I639 VanDerWaalsContact CD2-CG1 3.43Å; L637-A795 HydrophobicContact CD2-CB 4.42Å; L637-A795 HydrophobicContact CG-CB 3.95Å; L637-P797 HydrophobicContact CD1-CB 4.36Å; L637-P797 HydrophobicContact CD1-CG 3.72Å
638	I	85.1	Confident	88.3	Confident	50 Å²	50	44.1 Å²	44.1	26%	0.256	23%	0.225	S	C	.	.			trans	-101.7	122.8	168.8	-52.8	172.6	0	0	0	106.8	D131 T636 Q641	D131-I638 WeakPolarHBondContact OD2-CG2 3.46Å; T636-I638 PolarHBondContact O-N 3.39Å; I638-Q641 HydrophobicContact CB-CG 4.45Å; I638-Q641 HydrophobicContact CG2-CG 3.88Å
639	I	88.3	Confident	87.8	Confident	1 Å²	1	47 Å²	47	1%	0.005	24%	0.24	C	C	.	.	S	Bend	trans	-84.6	-40.4	-177.4	-59	169.5	0	0	0	110.1	D131 L524 L574 E575 F578 L637 Q641	D131-I639 PolarHBondContact OD1-N 3.47Å; D131-I639 PolarHBondContact OD2-N 3.11Å; L524-I639 HydrophobicContact CD1-CG2 4.46Å; L574-I639 HydrophobicContact CB-CD1 4.03Å; L574-I639 HydrophobicContact CB-CG1 4.07Å; L574-I639 HydrophobicContact CB-CG2 3.95Å; L574-I639 HydrophobicContact CD1-CG1 4.35Å; E575-I639 HydrophobicContact CB-CG2 4.2Å; F578-I639 HydrophobicContact CE2-CB 4.23Å; F578-I639 HydrophobicContact CE2-CD1 3.95Å; F578-I639 HydrophobicContact CE2-CG2 3.93Å; F578-I639 HydrophobicContact CZ-CD1 3.95Å; L637-I639 HydrophobicContact CD2-CB 4.44Å; L637-I639 HydrophobicContact CD2-CD1 4.47Å; L637-I639 HydrophobicContact CD2-CG1 3.43Å; L637-I639 VanDerWaalsContact CD2-CG1 3.43Å; I639-Q641 PolarHBondContact O-N 3.48Å
640	N	86	Confident	87.4	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	24%	0.243	C	C	.	.	S	Bend	trans	-78.5	56.1	177.9	-173.4	5.4	0	0	0	112.2	D131 R133 S522 Y523 L524 D525 F528	D131-N640 PolarHBondContact OD2-N 2.9Å; R133-N640 PolarHBondContact NH2-ND2 3.48Å; S522-N640 WeakPolarHBondContact CA-O 2.68Å; S522-N640 VanDerWaalsContact CA-OD1 3.3Å; S522-N640 WeakPolarHBondContact CA-OD1 3.27Å; S522-N640 WeakPolarHBondContact CB-O 3.35Å; S522-N640 VanDerWaalsContact CB-OD1 3.29Å; S522-N640 WeakPolarHBondContact CB-OD1 3.42Å; S522-N640 PolarHBondContact OG-O 3.45Å; Y523-N640 PolarHBondContact N-OD1 2.97Å; L524-N640 HydrophobicContact CB-CB 4.18Å; L524-N640 HydrophobicContact CD1-CB 4.18Å; L524-N640 HydrophobicContact CG-CB 4.41Å; L524-N640 PolarHBondContact N-OD1 2.74Å; D525-N640 PolarHBondContact OD1-ND2 3.15Å; F528-N640 HydrophobicContact CD2-CB 4.48Å; F528-N640 HydrophobicContact CE2-CB 3.47Å; F528-N640 VanDerWaalsContact CE2-CB 3.47Å; F528-N640 VanDerWaalsContact CE2-ND2 3.33Å; F528-N640 WeakPolarHBondContact CE2-ND2 3.27Å; F528-N640 HydrophobicContact CZ-CB 3.71Å
641	Q	87	Confident	87.1	Confident	56 Å²	56	50.5 Å²	50.5	26%	0.262	27%	0.266	S	S	.	.			trans	-144.7	126.5	167.3	-75	-170.2	-5.3	0	0	110.6	K520 I638 I639 N794	K520-Q641 HydrophobicContact CB-CB 4.49Å; K520-Q641 VanDerWaalsContact CD-OE1 3.27Å; I638-Q641 HydrophobicContact CB-CG 4.45Å; I638-Q641 HydrophobicContact CG2-CG 3.88Å; I639-Q641 PolarHBondContact O-N 3.48Å; Q641-N794 PolarHBondContact O-ND2 2.86Å
642	E	90.7	Very high	86.8	Confident	19 Å²	19	52.9 Å²	52.9	9%	0.089	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	137.6	170.4	-177	177.3	75.1	0	0	109	K520 T521 Y523 R644 K777 L793	K520-E642 CarbonylContact C-O 3.47Å; K520-E642 WeakPolarHBondContact CA-O 3.44Å; T521-E642 PolarHBondContact N-O 3.27Å; T521-E642 PolarHBondContact O-N 3.41Å; T521-E642 PolarHBondContact OG1-O 3.02Å; Y523-E642 HydrophobicContact CD1-CB 3.7Å; Y523-E642 HydrophobicContact CE1-CB 3.68Å; E642-R644 IonicContact OE1-CZ 2.65Å; E642-R644 VanDerWaalsContact OE1-CZ 3.23Å; E642-R644 IonicContact OE1-NE 3.85Å; E642-R644 PolarHBondContact OE1-NE 3.14Å; E642-R644 IonicContact OE1-NH2 3.41Å; E642-R644 PolarHBondContact OE1-NH2 3.17Å; E642-K777 IonicContact OE2-NZ 3.85Å; E642-K777 PolarHBondContact OE2-NZ 3.26Å; E642-L793 CarbonylContact C-O 3.42Å; E642-L793 WeakPolarHBondContact CA-O 3.18Å; E642-L793 HydrophobicContact CG-CB 4.4Å
643	F	91.2	Very high	86.7	Confident	36 Å²	36	58.7 Å²	58.7	16%	0.158	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	129.1	173.1	-179.4	-83.6	0	0	0	110.5	G518 T519 R791 L793	G518-F643 VanDerWaalsContact CA-CZ 3.48Å; T519-F643 WeakPolarHBondContact O-CA 3.22Å; F643-R791 VanDerWaalsContact CE1-CZ 3.43Å; F643-L793 PolarHBondContact N-O 3.04Å
644	R	89	Confident	86.7	Confident	123 Å²	123	58.2 Å²	58.2	46%	0.464	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	122	175.7	-63.6	-171.7	175.3	-178.9	-0.5	110.2	G518 T519 T521 E642	G518-R644 CarbonylContact C-O 3.47Å; G518-R644 WeakPolarHBondContact CA-O 3.22Å; T519-R644 PolarHBondContact N-O 2.86Å; T519-R644 PolarHBondContact O-N 2.92Å; T521-R644 VanDerWaalsContact OG1-CD 3.3Å; T521-R644 WeakPolarHBondContact OG1-CD 3.38Å; T521-R644 PolarHBondContact OG1-NE 3.2Å; E642-R644 IonicContact OE1-CZ 2.65Å; E642-R644 VanDerWaalsContact OE1-CZ 3.23Å; E642-R644 IonicContact OE1-NE 3.85Å; E642-R644 PolarHBondContact OE1-NE 3.14Å; E642-R644 IonicContact OE1-NH2 3.41Å; E642-R644 PolarHBondContact OE1-NH2 3.17Å
645	A	85.6	Confident	86.9	Confident	25 Å²	25	56.1 Å²	56.1	21%	0.207	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	136.3	175.5	0	0	0	0	0	110.5	K647 T648	A645-K647 VanDerWaalsContact C-N 3.31Å; A645-T648 HydrophobicContact CB-CG2 4.18Å
646	E	78.9	Confident	87.3	Confident	118 Å²	118	54.2 Å²	54.2	55%	0.551	29%	0.288	S	S	*	.	S	Bend	trans	-73.6	-25.9	-178.7	-73.4	172.8	171.1	0	0	112.7	T517 T519	T517-E646 PolarHBondContact O-N 2.66Å; T519-E646 HydrophobicContact CG2-CG 3.95Å; T519-E646 WeakPolarHBondContact CG2-OE1 3.27Å
647	K	79.6	Confident	87.7	Confident	113 Å²	113	54.7 Å²	54.7	49%	0.491	28%	0.278	S	S	.	.			trans	-142.2	133.8	179.4	-173.5	-178.2	-179.7	-172.8	0	110.8	A645 S669	A645-K647 VanDerWaalsContact C-N 3.31Å; K647-S669 WeakPolarHBondContact O-CB 3.34Å; K647-S669 PolarHBondContact O-OG 3.27Å
648	T	83.4	Confident	87.9	Confident	71 Å²	71	57.2 Å²	57.2	44%	0.436	31%	0.305	S	S	.	.			trans	-128.7	115.1	172	55.6	0	0	0	0	110.1	A645 V667 N668	A645-T648 HydrophobicContact CB-CG2 4.18Å; T648-V667 HydrophobicContact CG2-CB 3.93Å; T648-V667 HydrophobicContact CG2-CG1 4.01Å; T648-N668 CarbonylContact C-O 3.52Å; T648-N668 WeakPolarHBondContact CA-O 3.27Å
649	L	85.4	Confident	88.2	Confident	65 Å²	65	59.2 Å²	59.2	34%	0.34	31%	0.312	S	S	.	.	S	Bend	trans	-77.3	-25	172.4	-64.5	171.8	0	0	0	112	N668 D671	L649-N668 PolarHBondContact N-O 3.38Å; L649-D671 WeakPolarHBondContact CB-O 3.46Å; L649-D671 VanDerWaalsContact CD1-O 3.23Å; L649-D671 WeakPolarHBondContact CD1-O 3.24Å
650	T	84.9	Confident	88.4	Confident	35 Å²	35	60.4 Å²	60.4	22%	0.215	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	145	171.7	-67.3	0	0	0	0	108.6	V667 N668 V674	T650-V667 WeakPolarHBondContact O-CA 3.4Å; T650-N668 PolarHBondContact N-O 3.03Å; T650-N668 PolarHBondContact O-N 3.13Å; T650-V674 HydrophobicContact CG2-CG2 4.21Å
651	S	89.2	Confident	88.6	Confident	75 Å²	75	61.8 Å²	61.8	52%	0.524	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	133	176.7	-171.3	0	0	0	0	110.2	C666	S651-C666 CarbonylContact C-O 3.56Å; S651-C666 WeakPolarHBondContact CA-O 3.28Å
652	I	90.4	Very high	88.8	Confident	51 Å²	51	59.1 Å²	59.1	26%	0.262	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	125.1	169.1	-57.4	171.6	0	0	0	105.8	D654 L655 P665 C666 V674 P675	I652-D654 PolarHBondContact O-N 3.21Å; I652-L655 HydrophobicContact CD1-CD1 4.42Å; I652-P665 WeakPolarHBondContact O-CA 3.04Å; I652-C666 HydrophobicContact CB-CB 4.15Å; I652-C666 HydrophobicContact CD1-CB 4.4Å; I652-C666 PolarHBondContact N-O 3.18Å; I652-C666 PolarHBondContact O-N 3.44Å; I652-V674 HydrophobicContact CD1-CG1 4.46Å; I652-P675 HydrophobicContact CD1-CG 4.33Å
653	V	91.1	Very high	88.9	Confident	126 Å²	126	61.1 Å²	61.1	76%	0.764	33%	0.327	S	S	*	.	S	Bend	trans	-63.7	-42.6	-172.7	-179.8	0	0	0	0	111.9	P665	V653-P665 WeakPolarHBondContact O-CA 3.43Å
654	D	93.5	Very high	89	Confident	30 Å²	30	60 Å²	60	16%	0.16	32%	0.323	C	S	.	.			trans	-149.8	124.5	174.9	176.9	29.5	0	0	0	109.8	I652 S656 Y657 G658 P663 I664	I652-D654 PolarHBondContact O-N 3.21Å; D654-S656 VanDerWaalsContact CG-OG 3.23Å; D654-S656 WeakPolarHBondContact OD1-CB 3.39Å; D654-S656 PolarHBondContact OD1-N 2.87Å; D654-S656 PolarHBondContact OD1-OG 3.45Å; D654-S656 PolarHBondContact OD2-OG 2.53Å; D654-Y657 PolarHBondContact OD2-N 2.9Å; D654-Y657 VanDerWaalsContact OD2-N 3.11Å; D654-G658 PolarHBondContact OD2-N 2.8Å; D654-P663 HydrophobicContact CB-CB 3.85Å; D654-I664 PolarHBondContact OD1-N 3.25Å
655	L	92.3	Very high	89.3	Confident	22 Å²	22	55.3 Å²	55.3	12%	0.115	31%	0.308	C	S	.	.	S	Bend	trans	-90.8	-7.8	176.3	-168.8	132.1	0	0	0	112.1	I652 I664 C666 P675 I678 Y680	I652-L655 HydrophobicContact CD1-CD1 4.42Å; L655-I664 WeakPolarHBondContact CB-O 3.27Å; L655-I664 PolarHBondContact N-O 2.81Å; L655-C666 HydrophobicContact CB-CB 4.39Å; L655-C666 HydrophobicContact CD1-CB 3.83Å; L655-P675 HydrophobicContact CD1-CB 4.43Å; L655-P675 HydrophobicContact CD1-CG 4.3Å; L655-I678 HydrophobicContact CD2-CG2 4.21Å; L655-Y680 HydrophobicContact CD2-CD2 4.13Å
656	S	92.1	Very high	89.7	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.299	C	S	.	.	S	Bend	trans	-87.7	-10.9	174.7	78.4	0	0	0	0	114.2	D654 G658 K659	D654-S656 VanDerWaalsContact CG-OG 3.23Å; D654-S656 WeakPolarHBondContact OD1-CB 3.39Å; D654-S656 PolarHBondContact OD1-N 2.87Å; D654-S656 PolarHBondContact OD1-OG 3.45Å; D654-S656 PolarHBondContact OD2-OG 2.53Å; S656-G658 VanDerWaalsContact C-N 3.28Å; S656-G658 PolarHBondContact O-N 3.25Å; S656-K659 WeakPolarHBondContact O-CB 3.49Å; S656-K659 WeakPolarHBondContact O-CG 3.34Å; S656-K659 PolarHBondContact O-N 3.37Å; S656-K659 VanDerWaalsContact O-N 3.11Å
657	Y	91.3	Very high	90.3	Very high	124 Å²	124	48.9 Å²	48.9	49%	0.486	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	38	-175.9	-49.6	-73.3	0	0	0	113.9	D654 K659	D654-Y657 PolarHBondContact OD2-N 2.9Å; D654-Y657 VanDerWaalsContact OD2-N 3.11Å; Y657-K659 VanDerWaalsContact C-N 3.26Å; Y657-K659 PolarHBondContact O-N 2.76Å
658	G	90.2	Very high	90.9	Very high	60 Å²	60	43.5 Å²	43.5	62%	0.619	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.6	8.4	-177.9	0	0	0	0	0	114.9	D654 S656 E660	D654-G658 PolarHBondContact OD2-N 2.8Å; S656-G658 VanDerWaalsContact C-N 3.28Å; S656-G658 PolarHBondContact O-N 3.25Å; G658-E660 VanDerWaalsContact C-N 3.29Å; G658-E660 PolarHBondContact O-N 3.41Å
659	K	91.4	Very high	91.1	Very high	92 Å²	92	40.5 Å²	40.5	40%	0.4	23%	0.233	S	C	.	.			trans	-76.8	-10.3	-179.2	-61.7	176	-176.8	-173.8	0	113.7	S656 Y657 D679 Y680 P682	S656-K659 WeakPolarHBondContact O-CB 3.49Å; S656-K659 WeakPolarHBondContact O-CG 3.34Å; S656-K659 PolarHBondContact O-N 3.37Å; S656-K659 VanDerWaalsContact O-N 3.11Å; Y657-K659 VanDerWaalsContact C-N 3.26Å; Y657-K659 PolarHBondContact O-N 2.76Å; K659-D679 IonicContact NZ-OD1 3.72Å; K659-D679 PolarHBondContact NZ-OD1 2.93Å; K659-Y680 HydrophobicContact CB-CD1 4.39Å; K659-Y680 HydrophobicContact CD-CD1 4.43Å; K659-Y680 WeakPolarHBondContact CD-O 3.36Å; K659-Y680 WeakPolarHBondContact CE-O 3.47Å; K659-Y680 PolarHBondContact NZ-O 2.83Å; K659-P682 HydrophobicContact CB-CG 4.28Å
660	E	93.3	Very high	91	Very high	26 Å²	26	38.5 Å²	38.5	12%	0.121	22%	0.223	C	C	.	.	S	Bend	trans	-114.9	162.8	178	-74.3	-79.1	-157	0	0	112.4	G658 V662 I664 Y680 P682 L774	G658-E660 VanDerWaalsContact C-N 3.29Å; G658-E660 PolarHBondContact O-N 3.41Å; E660-V662 PolarHBondContact O-N 3.31Å; E660-I664 HydrophobicContact CG-CD1 4.28Å; E660-Y680 HydrophobicContact CG-CE1 3.84Å; E660-Y680 PolarHBondContact OE1-OH 3.31Å; E660-P682 HydrophobicContact CG-CB 4.3Å; E660-P682 WeakPolarHBondContact OE1-CB 3.3Å; E660-L774 HydrophobicContact CB-CB 4.48Å; E660-L774 HydrophobicContact CB-CD2 4.37Å; E660-L774 VanDerWaalsContact CD-CB 3.5Å; E660-L774 HydrophobicContact CG-CB 4.35Å; E660-L774 HydrophobicContact CG-CD2 4.3Å; E660-L774 VanDerWaalsContact OE2-CB 3.27Å; E660-L774 WeakPolarHBondContact OE2-CB 3.47Å; E660-L774 PolarHBondContact OE2-N 3.02Å
661	N	90.5	Very high	91	Very high	30 Å²	30	39.5 Å²	39.5	16%	0.16	23%	0.227	C	C	.	.	S	Bend	trans	-72.7	-11.7	-178.5	-50.3	-68.4	0	0	0	114.3	K569 G570 Q772 L774 W775	K569-N661 HydrophobicContact CD-CB 4.42Å; K569-N661 WeakPolarHBondContact CE-OD1 3.19Å; K569-N661 HydrophobicContact CG-CB 4.23Å; K569-N661 PolarHBondContact NZ-OD1 2.93Å; G570-N661 PolarHBondContact N-O 2.95Å; N661-Q772 PolarHBondContact ND2-O 2.85Å; N661-L774 VanDerWaalsContact CB-O 3.32Å; N661-L774 WeakPolarHBondContact CB-O 3.43Å; N661-L774 PolarHBondContact ND2-O 3.04Å; N661-W775 HydrophobicContact CB-CD2 4.4Å; N661-W775 PolarHBondContact ND2-NE1 3.17Å
662	V	91.3	Very high	90.9	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.006	23%	0.234	C	C	.	.	S	Bend	trans	-138	139.1	176.4	-73.5	0	0	0	0	108.2	E660 L774	E660-V662 PolarHBondContact O-N 3.31Å; V662-L774 HydrophobicContact CG2-CD2 3.89Å; V662-L774 HydrophobicContact CG2-CG 3.64Å
663	P	92.8	Very high	90.8	Very high	60 Å²	60	43.6 Å²	43.6	39%	0.39	24%	0.241	S	C	.	.			trans	-66.3	145.7	178.6	28.2	-34.7	0	0	0	110.9	D654 P665	D654-P663 HydrophobicContact CB-CB 3.85Å; P663-P665 VanDerWaalsContact C-CD 3.48Å; P663-P665 WeakPolarHBondContact O-CD 3.46Å
664	I	93.8	Very high	90.5	Very high	13 Å²	13	41.7 Å²	41.7	7%	0.067	23%	0.229	C	C	.	.			trans	-108.2	83.6	177.4	-52.9	-177.4	0	0	0	108.5	D654 L655 E660 Y680 L774 V780	D654-I664 PolarHBondContact OD1-N 3.25Å; L655-I664 WeakPolarHBondContact CB-O 3.27Å; L655-I664 PolarHBondContact N-O 2.81Å; E660-I664 HydrophobicContact CG-CD1 4.28Å; I664-Y680 HydrophobicContact CD1-CE2 4.09Å; I664-Y680 VanDerWaalsContact CD1-OH 3.26Å; I664-Y680 WeakPolarHBondContact CD1-OH 3.4Å; I664-L774 HydrophobicContact CD1-CD2 3.62Å; I664-L774 HydrophobicContact CG1-CD2 3.84Å; I664-V780 HydrophobicContact CG2-CG2 3.94Å
665	P	93.7	Very high	90.1	Very high	24 Å²	24	41.6 Å²	41.6	16%	0.156	23%	0.231	C	C	.	.			trans	-60.8	146.5	175.7	24.7	-35.2	0	0	0	111.5	I652 V653 P663 L778 Q779 V780 L793	I652-P665 WeakPolarHBondContact O-CA 3.04Å; V653-P665 WeakPolarHBondContact O-CA 3.43Å; P663-P665 VanDerWaalsContact C-CD 3.48Å; P663-P665 WeakPolarHBondContact O-CD 3.46Å; P665-L778 WeakPolarHBondContact CD-O 3.1Å; P665-Q779 HydrophobicContact CG-CB 4.21Å; P665-Q779 HydrophobicContact CG-CG 4.33Å; P665-Q779 CarbonylContact O-C 3.46Å; P665-Q779 WeakPolarHBondContact O-CA 3.15Å; P665-V780 PolarHBondContact O-N 3.35Å; P665-L793 HydrophobicContact CG-CD1 4.22Å
666	C	93.8	Very high	89.7	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.014	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	126	173.2	-178.7	0	0	0	0	110.7	S651 I652 L655 P675 V780 W788	S651-C666 CarbonylContact C-O 3.56Å; S651-C666 WeakPolarHBondContact CA-O 3.28Å; I652-C666 HydrophobicContact CB-CB 4.15Å; I652-C666 HydrophobicContact CD1-CB 4.4Å; I652-C666 PolarHBondContact N-O 3.18Å; I652-C666 PolarHBondContact O-N 3.44Å; L655-C666 HydrophobicContact CB-CB 4.39Å; L655-C666 HydrophobicContact CD1-CB 3.83Å; C666-P675 VanDerWaalsContact SG-CG 3.52Å; C666-V780 CarbonylContact C-O 3.55Å; C666-V780 VanDerWaalsContact CA-O 3.28Å; C666-V780 WeakPolarHBondContact CA-O 3.2Å; C666-V780 HydrophobicContact CB-CB 3.91Å; C666-V780 HydrophobicContact CB-CG1 4.32Å; C666-V780 VanDerWaalsContact SG-CG1 3.55Å; C666-W788 VanDerWaalsContact SG-CZ3 3.52Å
667	V	92.3	Very high	89.3	Confident	7 Å²	7	52.7 Å²	52.7	4%	0.042	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	143.4	-176.3	-58.7	0	0	0	0	113.3	T648 T650 Q779 V780 F781 K782	T648-V667 HydrophobicContact CG2-CB 3.93Å; T648-V667 HydrophobicContact CG2-CG1 4.01Å; T650-V667 WeakPolarHBondContact O-CA 3.4Å; V667-Q779 VanDerWaalsContact CG2-CD 3.47Å; V667-Q779 HydrophobicContact CG2-CG 3.99Å; V667-V780 PolarHBondContact N-O 2.65Å; V667-F781 HydrophobicContact CG2-CB 4.02Å; V667-F781 VanDerWaalsContact O-CA 3.26Å; V667-F781 WeakPolarHBondContact O-CA 3.42Å; V667-K782 PolarHBondContact O-N 3.41Å; V667-K782 VanDerWaalsContact O-N 3.1Å
668	N	91.5	Very high	88.8	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	126.3	169.7	-161.5	-26	0	0	0	110.2	T648 L649 T650 V670 D671 E673 K782 W788	T648-N668 CarbonylContact C-O 3.52Å; T648-N668 WeakPolarHBondContact CA-O 3.27Å; L649-N668 PolarHBondContact N-O 3.38Å; T650-N668 PolarHBondContact N-O 3.03Å; T650-N668 PolarHBondContact O-N 3.13Å; N668-V670 PolarHBondContact OD1-N 3.43Å; N668-D671 PolarHBondContact ND2-O 2.96Å; N668-D671 VanDerWaalsContact ND2-O 3.14Å; N668-D671 PolarHBondContact ND2-OD1 3.39Å; N668-D671 PolarHBondContact OD1-N 2.88Å; N668-D671 PolarHBondContact OD1-O 3.06Å; N668-D671 VanDerWaalsContact OD1-O 3.09Å; N668-E673 PolarHBondContact ND2-N 3.28Å; N668-E673 PolarHBondContact ND2-O 2.86Å; N668-K782 HydrophobicContact CB-CB 4.12Å; N668-K782 VanDerWaalsContact CG-CB 3.43Å; N668-K782 WeakPolarHBondContact OD1-CB 3.43Å; N668-K782 WeakPolarHBondContact OD1-CG 3.01Å; N668-W788 HydrophobicContact CB-CH2 4.02Å; N668-W788 HydrophobicContact CB-CZ3 4.43Å
669	S	88.2	Confident	88.6	Confident	7 Å²	7	53 Å²	53	5%	0.049	29%	0.288	C	S	.	.	S	Bend	trans	-116.2	-6.8	176.4	-58.9	0	0	0	0	112.6	L514 K647	L514-S669 VanDerWaalsContact O-CB 3.24Å; L514-S669 WeakPolarHBondContact O-CB 3.37Å; K647-S669 WeakPolarHBondContact O-CB 3.34Å; K647-S669 PolarHBondContact O-OG 3.27Å
670	V	83.8	Confident	88.6	Confident	23 Å²	23	50.6 Å²	50.6	14%	0.139	28%	0.276	C	S	.	.	S	Bend	trans	-104.9	-45.4	-168.4	-179.3	0	0	0	0	111.5	L511 E515 N668 K782 A784	L511-V670 HydrophobicContact CD2-CG1 3.96Å; E515-V670 HydrophobicContact CG-CG2 3.92Å; N668-V670 PolarHBondContact OD1-N 3.43Å; V670-K782 HydrophobicContact CB-CG 4.07Å; V670-K782 HydrophobicContact CG2-CG 4.38Å; V670-K782 WeakPolarHBondContact CG2-O 3.48Å; V670-A784 HydrophobicContact CG1-CB 4.03Å; V670-A784 HydrophobicContact CG2-CB 4.49Å
671	D	85.6	Confident	88.5	Confident	56 Å²	56	50.8 Å²	50.8	30%	0.299	28%	0.279	S	S	.	.	S	Bend	trans	-147.2	-169	-177.2	59.1	51.1	0	0	0	111.3	L649 N668 E673 K782	L649-D671 WeakPolarHBondContact CB-O 3.46Å; L649-D671 VanDerWaalsContact CD1-O 3.23Å; L649-D671 WeakPolarHBondContact CD1-O 3.24Å; N668-D671 PolarHBondContact ND2-O 2.96Å; N668-D671 VanDerWaalsContact ND2-O 3.14Å; N668-D671 PolarHBondContact ND2-OD1 3.39Å; N668-D671 PolarHBondContact OD1-N 2.88Å; N668-D671 PolarHBondContact OD1-O 3.06Å; N668-D671 VanDerWaalsContact OD1-O 3.09Å; D671-E673 WeakPolarHBondContact OD1-CB 3.44Å; D671-E673 PolarHBondContact OD1-N 2.99Å; D671-K782 WeakPolarHBondContact OD1-CE 3.46Å; D671-K782 WeakPolarHBondContact OD2-CE 3.48Å
672	N	86.5	Confident	88.5	Confident	125 Å²	125	51.1 Å²	51.1	67%	0.668	28%	0.283	S	S	*	.	S	Bend	trans	-103.8	20.2	-179.6	-60.3	-31.3	0	0	0	112.5
673	E	87.6	Confident	88.4	Confident	88 Å²	88	55 Å²	55	41%	0.411	30%	0.301	S	S	.	.			trans	-71.1	136.1	173.8	-164.2	-171.9	100.5	0	0	110.4	N668 D671 K782 W788	N668-E673 PolarHBondContact ND2-N 3.28Å; N668-E673 PolarHBondContact ND2-O 2.86Å; D671-E673 WeakPolarHBondContact OD1-CB 3.44Å; D671-E673 PolarHBondContact OD1-N 2.99Å; E673-K782 IonicContact OE1-NZ 3.93Å; E673-K782 PolarHBondContact OE1-NZ 3.04Å; E673-K782 IonicContact OE2-NZ 2.72Å; E673-K782 PolarHBondContact OE2-NZ 2.72Å; E673-W788 HydrophobicContact CB-CZ2 4.36Å; E673-W788 HydrophobicContact CG-CZ2 4.4Å; E673-W788 WeakPolarHBondContact O-CH2 3.26Å; E673-W788 WeakPolarHBondContact O-CZ2 3.11Å; E673-W788 PolarHBondContact OE1-NE1 2.85Å
674	V	84.5	Confident	88.2	Confident	85 Å²	85	54.7 Å²	54.7	52%	0.515	29%	0.292	S	S	.	.			trans	-106.8	140.8	172.1	-169.4	0	0	0	0	107.2	T650 I652	T650-V674 HydrophobicContact CG2-CG2 4.21Å; I652-V674 HydrophobicContact CD1-CG1 4.46Å
675	P	85.6	Confident	87.9	Confident	29 Å²	29	58.6 Å²	58.6	19%	0.188	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-55.3	149.4	172.2	-22	32.2	0	0	0	111.5	I652 L655 C666 W788	I652-P675 HydrophobicContact CD1-CG 4.33Å; L655-P675 HydrophobicContact CD1-CB 4.43Å; L655-P675 HydrophobicContact CD1-CG 4.3Å; C666-P675 VanDerWaalsContact SG-CG 3.52Å; P675-W788 HydrophobicContact CG-CD2 4.21Å; P675-W788 HydrophobicContact CG-CE3 4.3Å; P675-W788 HydrophobicContact CG-CH2 3.85Å; P675-W788 HydrophobicContact CG-CZ2 3.75Å; P675-W788 HydrophobicContact CG-CZ3 4.13Å
676	G	83.3	Confident	87.7	Confident	64 Å²	64	60.1 Å²	60.1	66%	0.66	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-60.7	156.1	167.2	0	0	0	0	0	111.2	I678	G676-I678 PolarHBondContact O-N 2.96Å
677	Y	84.4	Confident	87.5	Confident	190 Å²	190	63 Å²	63	75%	0.745	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-62	134.6	170.2	175.1	-99.6	0	0	0	110
678	I	81.4	Confident	86.9	Confident	89 Å²	89	65 Å²	65	46%	0.456	36%	0.356	S	S	.	.			trans	-136.2	131.5	178.4	-173.5	170.7	0	0	0	108.3	L655 G676 Y680	L655-I678 HydrophobicContact CD2-CG2 4.21Å; G676-I678 PolarHBondContact O-N 2.96Å; I678-Y680 VanDerWaalsContact C-N 3.33Å; I678-Y680 PolarHBondContact O-N 3.1Å; I678-Y680 VanDerWaalsContact O-N 3.08Å
679	D	85.9	Confident	86.4	Confident	103 Å²	103	72.1 Å²	72.1	55%	0.551	39%	0.394	S	S	*	.			trans	-78.8	90.4	165.1	-173.3	18.5	0	0	0	108.4	K659 T681	K659-D679 IonicContact NZ-OD1 3.72Å; K659-D679 PolarHBondContact NZ-OD1 2.93Å; D679-T681 PolarHBondContact O-N 2.98Å
680	Y	91.2	Very high	86.2	Confident	41 Å²	41	73 Å²	73	16%	0.161	40%	0.399	C	S	.	.			trans	-59.2	130.6	-177.3	-174.8	-85.5	0	0	0	110.9	L655 K659 E660 I664 I678 P682	L655-Y680 HydrophobicContact CD2-CD2 4.13Å; K659-Y680 HydrophobicContact CB-CD1 4.39Å; K659-Y680 HydrophobicContact CD-CD1 4.43Å; K659-Y680 WeakPolarHBondContact CD-O 3.36Å; K659-Y680 WeakPolarHBondContact CE-O 3.47Å; K659-Y680 PolarHBondContact NZ-O 2.83Å; E660-Y680 HydrophobicContact CG-CE1 3.84Å; E660-Y680 PolarHBondContact OE1-OH 3.31Å; I664-Y680 HydrophobicContact CD1-CE2 4.09Å; I664-Y680 VanDerWaalsContact CD1-OH 3.26Å; I664-Y680 WeakPolarHBondContact CD1-OH 3.4Å; I678-Y680 VanDerWaalsContact C-N 3.33Å; I678-Y680 PolarHBondContact O-N 3.1Å; I678-Y680 VanDerWaalsContact O-N 3.08Å; Y680-P682 HydrophobicContact CE1-CB 4.47Å
681	T	91.3	Very high	85.9	Confident	30 Å²	30	77.6 Å²	77.6	18%	0.184	43%	0.43	C	S	.	.			trans	-130	126.3	173.1	174.8	0	0	0	0	111.6	D679 Q683 A806	D679-T681 PolarHBondContact O-N 2.98Å; T681-Q683 WeakPolarHBondContact CG2-O 3.36Å; T681-Q683 PolarHBondContact O-N 3.3Å; T681-Q683 PolarHBondContact OG1-N 2.8Å; T681-Q683 PolarHBondContact OG1-O 2.84Å; T681-A806 WeakPolarHBondContact O-CB 3.35Å
682	P	90.8	Very high	85.5	Confident	37 Å²	37	78.1 Å²	78.1	24%	0.24	43%	0.432	C	S	.	.	S	Bend	trans	-77.6	-8.6	168.9	34.3	-36.2	0	0	0	112.2	K659 E660 Y680	K659-P682 HydrophobicContact CB-CG 4.28Å; E660-P682 HydrophobicContact CG-CB 4.3Å; E660-P682 WeakPolarHBondContact OE1-CB 3.3Å; Y680-P682 HydrophobicContact CE1-CB 4.47Å
683	Q	89.3	Confident	85	Confident	82 Å²	82	77.4 Å²	77.4	38%	0.383	43%	0.428	S	S	.	.	S	Bend	trans	-104.6	145.3	-177.8	-56.4	-170.8	11.6	0	0	111.4	T681	T681-Q683 WeakPolarHBondContact CG2-O 3.36Å; T681-Q683 PolarHBondContact O-N 3.3Å; T681-Q683 PolarHBondContact OG1-N 2.8Å; T681-Q683 PolarHBondContact OG1-O 2.84Å
684	R	88.4	Confident	84.4	Confident	53 Å²	53	80.1 Å²	80.1	20%	0.2	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	130.1	164.4	-75.1	-177.7	-68.6	-87.2	-1	110	Y805 G807 I809 V1327	R684-Y805 PolarHBondContact NH1-O 3.41Å; R684-G807 CarbonylContact C-O 3.59Å; R684-G807 VanDerWaalsContact CA-O 3.29Å; R684-G807 WeakPolarHBondContact CA-O 3.32Å; R684-I809 HydrophobicContact CB-CD1 3.86Å; R684-I809 HydrophobicContact CB-CG1 4.02Å; R684-I809 HydrophobicContact CG-CG1 4.46Å; R684-V1327 PolarHBondContact NE-O 3.34Å; R684-V1327 PolarHBondContact NH1-O 2.84Å; R684-V1327 PolarHBondContact NH2-O 2.76Å
685	Q	87.9	Confident	84.2	Confident	95 Å²	95	79.2 Å²	79.2	44%	0.444	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	119	-175.8	-66.3	-180	-10.7	0	0	110.2	I687 G807 A808 I809	Q685-I687 PolarHBondContact O-N 2.77Å; Q685-G807 PolarHBondContact N-O 2.87Å; Q685-A808 CarbonylContact O-C 3.31Å; Q685-A808 WeakPolarHBondContact O-CA 3.32Å; Q685-I809 PolarHBondContact O-N 3.28Å
686	P	89.5	Confident	84	Confident	56 Å²	56	79.5 Å²	79.5	36%	0.364	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	128.3	174.4	30	-35.2	0	0	0	110.8	V690 L692	P686-V690 HydrophobicContact CB-CB 3.93Å; P686-V690 HydrophobicContact CB-CG1 4.25Å; P686-V690 HydrophobicContact CB-CG2 4.5Å; P686-L692 HydrophobicContact CB-CD1 4.02Å; P686-L692 HydrophobicContact CB-CG 4.49Å; P686-L692 HydrophobicContact CG-CD1 3.75Å
687	I	88.2	Confident	83.9	Confident	64 Å²	64	84.6 Å²	84.6	33%	0.328	44%	0.437	S	S	.	.			trans	-108.1	139.6	174.2	-53.3	-57.7	0	0	0	108.3	Q685 V690 A808 I809 Y810 M814	Q685-I687 PolarHBondContact O-N 2.77Å; I687-V690 WeakPolarHBondContact O-CG2 3.37Å; I687-A808 HydrophobicContact CG1-CB 3.69Å; I687-I809 PolarHBondContact N-O 2.93Å; I687-Y810 HydrophobicContact CB-CD1 3.92Å; I687-Y810 HydrophobicContact CB-CE1 3.83Å; I687-Y810 HydrophobicContact CG1-CE1 4.12Å; I687-Y810 HydrophobicContact CG2-CD1 4.21Å; I687-Y810 HydrophobicContact CG2-CE1 3.86Å; I687-M814 HydrophobicContact CG2-SD 4.41Å
688	G	80.9	Confident	83.7	Confident	48 Å²	48	82.2 Å²	82.2	50%	0.495	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.1	-139.1	-175.8	0	0	0	0	0	113.3
689	N	81	Confident	83.8	Confident	149 Å²	149	79 Å²	79	80%	0.797	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	25.2	-167.3	-70	-43.6	0	0	0	114.2	P691	N689-P691 WeakPolarHBondContact O-CD 3.49Å
690	V	83.4	Confident	83.7	Confident	26 Å²	26	77.9 Å²	77.9	16%	0.158	41%	0.411	C	S	.	.			trans	-53.2	117.9	-178.5	174.5	0	0	0	0	111.7	P686 I687 L692 I809 Y810	P686-V690 HydrophobicContact CB-CB 3.93Å; P686-V690 HydrophobicContact CB-CG1 4.25Å; P686-V690 HydrophobicContact CB-CG2 4.5Å; I687-V690 WeakPolarHBondContact O-CG2 3.37Å; V690-L692 HydrophobicContact CG1-CD2 3.94Å; V690-L692 HydrophobicContact CG1-CG 4.15Å; V690-L692 PolarHBondContact O-N 2.72Å; V690-I809 HydrophobicContact CG1-CG2 3.91Å; V690-I809 HydrophobicContact CG2-CG2 4.22Å; V690-Y810 VanDerWaalsContact CG2-C 3.47Å
691	P	76.9	Confident	83.8	Confident	119 Å²	119	78.6 Å²	78.6	77%	0.773	42%	0.421	S	S	*	.			trans	-80.8	76.1	-169.5	32.2	-36.5	0	0	0	112.7	N689	N689-P691 WeakPolarHBondContact O-CD 3.49Å
692	L	78.5	Confident	84	Confident	67 Å²	67	77.3 Å²	77.3	35%	0.351	41%	0.414	S	S	.	.			trans	-77.9	123.1	175.5	-61.4	-173.7	0	0	0	112.5	P686 V690 K694	P686-L692 HydrophobicContact CB-CD1 4.02Å; P686-L692 HydrophobicContact CB-CG 4.49Å; P686-L692 HydrophobicContact CG-CD1 3.75Å; V690-L692 HydrophobicContact CG1-CD2 3.94Å; V690-L692 HydrophobicContact CG1-CG 4.15Å; V690-L692 PolarHBondContact O-N 2.72Å; L692-K694 HydrophobicContact CB-CG 4.39Å; L692-K694 PolarHBondContact O-N 2.73Å; L692-K694 VanDerWaalsContact O-N 3.13Å
693	L	75.6	Confident	84.3	Confident	111 Å²	111	81.6 Å²	81.6	58%	0.581	44%	0.435	S	S	*	.			trans	-69.1	102.5	169	-76.9	161.6	0	0	0	110.5
694	K	74.2	Confident	84.6	Confident	144 Å²	144	78 Å²	78	63%	0.626	42%	0.419	S	S	*	.			trans	-102	-5.3	-178.1	-65.7	179.5	-175.8	178.8	0	115	L692 S696	L692-K694 HydrophobicContact CB-CG 4.39Å; L692-K694 PolarHBondContact O-N 2.73Å; L692-K694 VanDerWaalsContact O-N 3.13Å; K694-S696 PolarHBondContact O-N 3.44Å
695	D	80.6	Confident	84.8	Confident	66 Å²	66	81.8 Å²	81.8	35%	0.353	45%	0.448	S	S	.	.			trans	-74.7	116.5	179.4	-177.4	-4.9	0	0	0	110.5	K697 F698	D695-K697 PolarHBondContact O-N 3.22Å; D695-K697 WeakPolarHBondContact OD1-CB 3.38Å; D695-K697 VanDerWaalsContact OD1-CG 3.29Å; D695-K697 WeakPolarHBondContact OD1-CG 3.41Å; D695-K697 PolarHBondContact OD1-N 3.1Å; D695-K697 IonicContact OD1-NZ 3.28Å; D695-K697 PolarHBondContact OD1-NZ 2.95Å; D695-K697 IonicContact OD2-NZ 2.87Å; D695-K697 PolarHBondContact OD2-NZ 2.86Å; D695-F698 HydrophobicContact CB-CD2 3.88Å; D695-F698 HydrophobicContact CB-CE2 4.04Å; D695-F698 PolarHBondContact O-N 3.41Å; D695-F698 VanDerWaalsContact O-N 3.1Å
696	S	80.8	Confident	85	Confident	35 Å²	35	79.1 Å²	79.1	25%	0.245	44%	0.436	C	S	.	.	G	3₁₀ helix	trans	-56.4	-21	-179.7	-174.7	0	0	0	0	113.5	K694 F698 L699 N758	K694-S696 PolarHBondContact O-N 3.44Å; S696-F698 PolarHBondContact O-N 2.97Å; S696-L699 VanDerWaalsContact O-CB 3.31Å; S696-L699 WeakPolarHBondContact O-CB 3.45Å; S696-L699 WeakPolarHBondContact O-CG 3.04Å; S696-L699 PolarHBondContact O-N 3.11Å; S696-N758 PolarHBondContact O-ND2 2.64Å; S696-N758 PolarHBondContact OG-ND2 2.89Å; S696-N758 PolarHBondContact OG-OD1 2.92Å
697	K	81.9	Confident	85.2	Confident	172 Å²	172	77.7 Å²	77.7	75%	0.748	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-63.3	-19.8	175.5	-63.8	177	-146.8	109.4	0	114.6	D695 L699	D695-K697 PolarHBondContact O-N 3.22Å; D695-K697 WeakPolarHBondContact OD1-CB 3.38Å; D695-K697 VanDerWaalsContact OD1-CG 3.29Å; D695-K697 WeakPolarHBondContact OD1-CG 3.41Å; D695-K697 PolarHBondContact OD1-N 3.1Å; D695-K697 IonicContact OD1-NZ 3.28Å; D695-K697 PolarHBondContact OD1-NZ 2.95Å; D695-K697 IonicContact OD2-NZ 2.87Å; D695-K697 PolarHBondContact OD2-NZ 2.86Å; K697-L699 VanDerWaalsContact C-N 3.34Å
698	F	80	Confident	85.5	Confident	140 Å²	140	74.7 Å²	74.7	61%	0.614	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-86.9	-4.2	175	-65.1	-87.4	0	0	0	113.1	D695 S696 V700	D695-F698 HydrophobicContact CB-CD2 3.88Å; D695-F698 HydrophobicContact CB-CE2 4.04Å; D695-F698 PolarHBondContact O-N 3.41Å; D695-F698 VanDerWaalsContact O-N 3.1Å; S696-F698 PolarHBondContact O-N 2.97Å; F698-V700 PolarHBondContact O-N 3.16Å
699	L	82.5	Confident	86	Confident	22 Å²	22	76.3 Å²	76.3	12%	0.115	40%	0.402	C	S	.	.			trans	-81.5	101.2	178.9	-54.6	-179.3	0	0	0	110.4	S696 K697 C701 L1330 P1332	S696-L699 VanDerWaalsContact O-CB 3.31Å; S696-L699 WeakPolarHBondContact O-CB 3.45Å; S696-L699 WeakPolarHBondContact O-CG 3.04Å; S696-L699 PolarHBondContact O-N 3.11Å; K697-L699 VanDerWaalsContact C-N 3.34Å; L699-C701 PolarHBondContact O-N 2.61Å; L699-L1330 WeakPolarHBondContact CD2-O 3.44Å; L699-P1332 HydrophobicContact CD1-CG 4.18Å
700	V	85.2	Confident	86.5	Confident	79 Å²	79	71.4 Å²	71.4	48%	0.479	38%	0.375	S	S	.	.			trans	-60.7	129.5	167.1	-174.4	0	0	0	0	108.6	F698 L719 N756	F698-V700 PolarHBondContact O-N 3.16Å; V700-L719 HydrophobicContact CB-CD1 3.93Å; V700-L719 HydrophobicContact CG1-CD1 3.88Å; V700-L719 HydrophobicContact CG2-CD1 4.17Å; V700-N756 PolarHBondContact O-ND2 3.1Å
701	C	93.4	Very high	86.9	Confident	55 Å²	55	71.8 Å²	71.8	37%	0.372	37%	0.374	S	S	.	.			trans	-126.7	173.5	179.8	67.4	0	0	0	0	111.9	L699 N758 C759	L699-C701 PolarHBondContact O-N 2.61Å; C701-N758 HydrophobicContact CB-CB 3.7Å; C701-N758 VanDerWaalsContact CB-O 3.28Å; C701-N758 WeakPolarHBondContact CB-O 3.27Å; C701-N758 PolarHBondContact SG-O 2.78Å; C701-N758 VanDerWaalsContact SG-O 3.34Å; C701-C759 WeakPolarHBondContact CA-SG 3.2Å; C701-C759 HydrophobicContact CB-CB 4.42Å; C701-C759 WeakPolarHBondContact CB-SG 3.48Å
702	C	95.9	Very high	87.6	Confident	4 Å²	4	71.1 Å²	71.1	3%	0.027	37%	0.368	C	S	.	.			trans	-124.5	150.6	172.9	60.8	0	0	0	0	111.7	C704 A715 C755 C759 Q760	C702-C704 VanDerWaalsContact C-N 3.33Å; C702-C704 HydrophobicContact CB-CB 4.46Å; C702-A715 HydrophobicContact CB-CB 4.21Å; C702-C755 VanDerWaalsContact SG-SG 3.62Å; C702-C759 PolarHBondContact N-SG 3.02Å; C702-C759 VanDerWaalsContact N-SG 3.39Å; C702-C759 WeakPolarHBondContact O-CA 3.36Å; C702-Q760 PolarHBondContact O-N 3.15Å
703	D	95.8	Very high	88.3	Confident	126 Å²	126	74.7 Å²	74.7	67%	0.674	38%	0.381	S	S	*	.			trans	-91	7	176.4	56.7	-12.2	0	0	0	113	T705	D703-T705 PolarHBondContact O-N 2.78Å
704	C	95.8	Very high	89.3	Confident	8 Å²	8	69.4 Å²	69.4	5%	0.054	35%	0.353	C	S	.	.			trans	-60.4	112.1	-176.3	-72.5	0	0	0	0	113.9	C702 C708 C714 C761	C702-C704 VanDerWaalsContact C-N 3.33Å; C702-C704 HydrophobicContact CB-CB 4.46Å; C704-C708 WeakPolarHBondContact CB-SG 3.31Å; C704-C714 WeakPolarHBondContact SG-CA 3.44Å; C704-C761 WeakPolarHBondContact O-CB 3.35Å; C704-C761 PolarHBondContact O-N 3.01Å
705	T	92.6	Very high	90.3	Very high	132 Å²	132	64.3 Å²	64.3	81%	0.81	34%	0.337	S	S	*	.	S	Bend	trans	-84.1	-13.9	172.1	52.8	0	0	0	0	113.6	D703 N707	D703-T705 PolarHBondContact O-N 2.78Å; T705-N707 PolarHBondContact O-N 2.86Å
706	D	91.8	Very high	91	Very high	38 Å²	38	61.2 Å²	61.2	20%	0.203	32%	0.321	C	S	.	.	S	Bend	trans	-85	16.6	-179.5	81.3	-38	0	0	0	113.8	C708 R709 D710	D706-C708 PolarHBondContact O-N 2.88Å; D706-C708 VanDerWaalsContact OD1-CA 3.31Å; D706-C708 WeakPolarHBondContact OD1-CA 3.38Å; D706-C708 PolarHBondContact OD1-N 2.89Å; D706-R709 PolarHBondContact O-N 3.01Å; D706-R709 PolarHBondContact OD2-N 2.82Å; D706-D710 WeakPolarHBondContact OD2-CB 3.48Å; D706-D710 PolarHBondContact OD2-N 3.05Å
707	N	93.6	Very high	91.7	Very high	27 Å²	27	59.7 Å²	59.7	14%	0.144	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	31.5	-170.5	-86.1	-44.4	0	0	0	114.4	T705 R709 D762 C765 S766	T705-N707 PolarHBondContact O-N 2.86Å; N707-R709 PolarHBondContact O-N 3.27Å; N707-D762 PolarHBondContact ND2-OD2 3.48Å; N707-D762 PolarHBondContact OD1-N 2.74Å; N707-D762 PolarHBondContact OD1-OD2 2.91Å; N707-C765 VanDerWaalsContact O-CA 3.3Å; N707-C765 WeakPolarHBondContact O-CA 3.34Å; N707-S766 PolarHBondContact O-N 2.85Å; N707-S766 VanDerWaalsContact O-N 3.08Å
708	C	94.8	Very high	92.2	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.3	29.2	177.1	-52.7	0	0	0	0	113.9	C704 D706 C714 Q717 C761	C704-C708 WeakPolarHBondContact CB-SG 3.31Å; D706-C708 PolarHBondContact O-N 2.88Å; D706-C708 VanDerWaalsContact OD1-CA 3.31Å; D706-C708 WeakPolarHBondContact OD1-CA 3.38Å; D706-C708 PolarHBondContact OD1-N 2.89Å; C708-C714 HydrophobicContact CB-CB 3.79Å; C708-C714 PolarHBondContact SG-SG 2.82Å; C708-Q717 PolarHBondContact O-NE2 3.3Å; C708-C761 VanDerWaalsContact SG-SG 3.62Å
709	R	91	Very high	92.8	Very high	83 Å²	83	50 Å²	50	31%	0.313	27%	0.271	S	S	.	.			trans	-65.2	-42.9	172.8	176.7	177.5	59.9	-163.9	-12.6	110.7	E616 D620 D706 N707 R711	E616-R709 HydrophobicContact CG-CG 4.43Å; E616-R709 WeakPolarHBondContact OE2-CG 3.47Å; D620-R709 IonicContact OD1-NH2 3.41Å; D620-R709 IonicContact OD2-CZ 2.61Å; D620-R709 IonicContact OD2-NH1 3.06Å; D620-R709 PolarHBondContact OD2-NH1 2.68Å; D620-R709 IonicContact OD2-NH2 3.56Å; D620-R709 PolarHBondContact OD2-NH2 2.92Å; D706-R709 PolarHBondContact O-N 3.01Å; D706-R709 PolarHBondContact OD2-N 2.82Å; N707-R709 PolarHBondContact O-N 3.27Å; R709-R711 VanDerWaalsContact C-N 3.34Å; R709-R711 PolarHBondContact O-N 3.47Å
710	D	91.4	Very high	93.3	Very high	45 Å²	45	49 Å²	49	24%	0.241	27%	0.266	C	S	.	.	S	Bend	trans	-74.3	89.8	169.4	-168.4	-18.6	0	0	0	110.1	D706 T712 K713 C714	D706-D710 WeakPolarHBondContact OD2-CB 3.48Å; D706-D710 PolarHBondContact OD2-N 3.05Å; D710-T712 PolarHBondContact O-N 2.88Å; D710-T712 WeakPolarHBondContact OD1-CB 3.27Å; D710-T712 PolarHBondContact OD1-N 2.86Å; D710-T712 PolarHBondContact OD1-OG1 3.05Å; D710-K713 HydrophobicContact CB-CB 4.4Å; D710-K713 HydrophobicContact CB-CD 4.31Å; D710-K713 HydrophobicContact CB-CG 4.33Å; D710-K713 PolarHBondContact O-N 3.1Å; D710-K713 WeakPolarHBondContact OD2-CD 3.27Å; D710-K713 WeakPolarHBondContact OD2-CE 3.44Å; D710-K713 IonicContact OD2-NZ 3.67Å; D710-K713 PolarHBondContact OD2-NZ 3.03Å; D710-C714 PolarHBondContact O-N 2.89Å
711	R	93.1	Very high	93.6	Very high	35 Å²	35	45.5 Å²	45.5	13%	0.132	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-18.7	178.5	-38.8	-161.6	-23.3	134.4	11.3	113	R709 Q718 S735 Q736 A737 Y739	R709-R711 VanDerWaalsContact C-N 3.34Å; R709-R711 PolarHBondContact O-N 3.47Å; R711-Q718 PolarHBondContact O-NE2 3.23Å; R711-S735 PolarHBondContact NH2-O 3.17Å; R711-Q736 PolarHBondContact NH2-O 3.12Å; R711-A737 VanDerWaalsContact CZ-O 3.26Å; R711-A737 PolarHBondContact NH1-O 3.1Å; R711-A737 PolarHBondContact NH2-O 2.91Å; R711-Y739 PolarHBondContact NH1-O 2.81Å
712	T	91.6	Very high	93.4	Very high	105 Å²	105	48.1 Å²	48.1	64%	0.644	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-24.9	178.3	74.6	0	0	0	0	112.8	D710	D710-T712 PolarHBondContact O-N 2.88Å; D710-T712 WeakPolarHBondContact OD1-CB 3.27Å; D710-T712 PolarHBondContact OD1-N 2.86Å; D710-T712 PolarHBondContact OD1-OG1 3.05Å
713	K	93.5	Very high	92.9	Very high	142 Å²	142	48.4 Å²	48.4	62%	0.617	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-32.4	176.5	-64.8	-177	178.3	105.2	0	113	D710 A715	D710-K713 HydrophobicContact CB-CB 4.4Å; D710-K713 HydrophobicContact CB-CD 4.31Å; D710-K713 HydrophobicContact CB-CG 4.33Å; D710-K713 PolarHBondContact O-N 3.1Å; D710-K713 WeakPolarHBondContact OD2-CD 3.27Å; D710-K713 WeakPolarHBondContact OD2-CE 3.44Å; D710-K713 IonicContact OD2-NZ 3.67Å; D710-K713 PolarHBondContact OD2-NZ 3.03Å; K713-A715 PolarHBondContact O-N 2.84Å
714	C	95.8	Very high	92.4	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.223	C	C	.	.			trans	-68.6	104.1	-177.4	178.7	0	0	0	0	112.5	C704 C708 D710 C716 Q717 Q718	C704-C714 WeakPolarHBondContact SG-CA 3.44Å; C708-C714 HydrophobicContact CB-CB 3.79Å; C708-C714 PolarHBondContact SG-SG 2.82Å; D710-C714 PolarHBondContact O-N 2.89Å; C714-C716 VanDerWaalsContact C-N 3.27Å; C714-C716 PolarHBondContact O-N 2.91Å; C714-Q717 HydrophobicContact CB-CB 4.07Å; C714-Q717 HydrophobicContact CB-CG 4.31Å; C714-Q717 PolarHBondContact O-N 2.98Å; C714-Q717 PolarHBondContact SG-N 2.79Å; C714-Q718 PolarHBondContact O-N 2.79Å
715	A	95.1	Very high	91.8	Very high	36 Å²	36	43.8 Å²	43.8	30%	0.298	23%	0.232	S	C	.	.	H	α-helix	trans	-50.7	-42.1	177.2	0	0	0	0	0	113.4	C702 K713 Q717 Q718 L719	C702-A715 HydrophobicContact CB-CB 4.21Å; K713-A715 PolarHBondContact O-N 2.84Å; A715-Q717 PolarHBondContact O-N 3.36Å; A715-Q718 PolarHBondContact O-N 3Å; A715-Q718 VanDerWaalsContact O-N 3.16Å; A715-L719 PolarHBondContact O-N 2.68Å
716	C	95.3	Very high	90.8	Very high	2 Å²	2	42 Å²	42	1%	0.014	22%	0.216	C	C	.	.	H	α-helix	trans	-64.9	-37	178.5	-48.9	0	0	0	0	112.4	C714 T720 Y753	C714-C716 VanDerWaalsContact C-N 3.27Å; C714-C716 PolarHBondContact O-N 2.91Å; C716-T720 PolarHBondContact O-N 2.91Å; C716-T720 PolarHBondContact O-OG1 3.29Å; C716-Y753 WeakPolarHBondContact O-CB 3.36Å
717	Q	94.9	Very high	89.7	Confident	3 Å²	3	42.2 Å²	42.2	1%	0.014	22%	0.219	C	C	.	.	H	α-helix	trans	-74.1	-33.3	172.4	-74.5	-179.7	77.4	0	0	112.2	C708 C714 A715 T720 V721 N767	C708-Q717 PolarHBondContact O-NE2 3.3Å; C714-Q717 HydrophobicContact CB-CB 4.07Å; C714-Q717 HydrophobicContact CB-CG 4.31Å; C714-Q717 PolarHBondContact O-N 2.98Å; C714-Q717 PolarHBondContact SG-N 2.79Å; A715-Q717 PolarHBondContact O-N 3.36Å; Q717-T720 WeakPolarHBondContact O-CB 3.43Å; Q717-T720 PolarHBondContact O-N 2.86Å; Q717-V721 WeakPolarHBondContact O-CB 3.5Å; Q717-V721 WeakPolarHBondContact O-CG2 3.37Å; Q717-V721 PolarHBondContact O-N 3.4Å; Q717-N767 HydrophobicContact CG-CB 3.92Å
718	Q	94.2	Very high	88.6	Confident	59 Å²	59	43.7 Å²	43.7	28%	0.276	23%	0.227	S	C	.	.	H	α-helix	trans	-62.3	-40.8	173.2	-70.2	-56.1	-68.3	0	0	111.7	R711 C714 A715 T720 V721 E722	R711-Q718 PolarHBondContact O-NE2 3.23Å; C714-Q718 PolarHBondContact O-N 2.79Å; A715-Q718 PolarHBondContact O-N 3Å; A715-Q718 VanDerWaalsContact O-N 3.16Å; Q718-T720 VanDerWaalsContact C-N 3.29Å; Q718-T720 PolarHBondContact O-N 2.87Å; Q718-V721 CarbonylContact O-C 3.53Å; Q718-V721 PolarHBondContact O-N 3.49Å; Q718-V721 VanDerWaalsContact O-N 3.12Å; Q718-E722 WeakPolarHBondContact O-CB 3.21Å; Q718-E722 VanDerWaalsContact O-CG 3.31Å; Q718-E722 WeakPolarHBondContact O-CG 3.29Å; Q718-E722 PolarHBondContact O-N 3.29Å
719	L	92.1	Very high	87.5	Confident	49 Å²	49	48.7 Å²	48.7	26%	0.257	26%	0.26	S	S	.	.	H	α-helix	trans	-55.3	-43.1	171	-69	179.8	0	0	0	112.6	V700 A715 A723 Y753	V700-L719 HydrophobicContact CB-CD1 3.93Å; V700-L719 HydrophobicContact CG1-CD1 3.88Å; V700-L719 HydrophobicContact CG2-CD1 4.17Å; A715-L719 PolarHBondContact O-N 2.68Å; L719-A723 VanDerWaalsContact O-CB 3.25Å; L719-A723 WeakPolarHBondContact O-CB 3.45Å; L719-A723 PolarHBondContact O-N 3.24Å; L719-Y753 HydrophobicContact CB-CD1 4.38Å; L719-Y753 HydrophobicContact CB-CD2 3.68Å; L719-Y753 HydrophobicContact CB-CE2 4.14Å; L719-Y753 HydrophobicContact CB-CG 3.82Å; L719-Y753 HydrophobicContact CD1-CD1 3.94Å; L719-Y753 HydrophobicContact CD1-CE1 4.42Å; L719-Y753 HydrophobicContact CD1-CG 4.08Å
720	T	92.1	Very high	86.9	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.012	28%	0.279	C	S	.	.	H	α-helix	trans	-66.7	-38.6	178.2	-54.6	0	0	0	0	111.9	C716 Q717 Q718 S724 T748 V752 Y753	C716-T720 PolarHBondContact O-N 2.91Å; C716-T720 PolarHBondContact O-OG1 3.29Å; Q717-T720 WeakPolarHBondContact O-CB 3.43Å; Q717-T720 PolarHBondContact O-N 2.86Å; Q718-T720 VanDerWaalsContact C-N 3.29Å; Q718-T720 PolarHBondContact O-N 2.87Å; T720-S724 PolarHBondContact O-N 3.28Å; T720-T748 HydrophobicContact CG2-CG2 4.13Å; T720-V752 HydrophobicContact CG2-CB 4.25Å; T720-V752 HydrophobicContact CG2-CG1 4.11Å; T720-V752 HydrophobicContact CG2-CG2 4.07Å; T720-Y753 PolarHBondContact OG1-N 2.95Å
721	V	91.1	Very high	86.3	Confident	5 Å²	5	51.5 Å²	51.5	3%	0.03	29%	0.293	C	S	.	.	H	α-helix	trans	-69.4	-45.8	177.1	163.3	0	0	0	0	110.7	Q717 Q718 S724 V733	Q717-V721 WeakPolarHBondContact O-CB 3.5Å; Q717-V721 WeakPolarHBondContact O-CG2 3.37Å; Q717-V721 PolarHBondContact O-N 3.4Å; Q718-V721 CarbonylContact O-C 3.53Å; Q718-V721 PolarHBondContact O-N 3.49Å; Q718-V721 VanDerWaalsContact O-N 3.12Å; V721-S724 WeakPolarHBondContact O-CB 3.36Å; V721-S724 PolarHBondContact O-N 3.19Å; V721-S724 PolarHBondContact O-OG 3.42Å; V721-V733 HydrophobicContact CG1-CG1 3.29Å
722	E	89.2	Confident	85.8	Confident	109 Å²	109	55.1 Å²	55.1	51%	0.509	31%	0.314	S	S	.	.	H	α-helix	trans	-60.9	-46.1	175.7	-72.9	174	178.2	0	0	111.6	Q718 S724 S725	Q718-E722 WeakPolarHBondContact O-CB 3.21Å; Q718-E722 VanDerWaalsContact O-CG 3.31Å; Q718-E722 WeakPolarHBondContact O-CG 3.29Å; Q718-E722 PolarHBondContact O-N 3.29Å; E722-S724 PolarHBondContact O-N 3.16Å; E722-S724 VanDerWaalsContact O-N 3.15Å; E722-S725 VanDerWaalsContact O-CB 3.31Å; E722-S725 WeakPolarHBondContact O-CB 3.34Å; E722-S725 PolarHBondContact O-N 2.98Å; E722-S725 PolarHBondContact O-OG 2.86Å
723	A	85.7	Confident	85.5	Confident	10 Å²	10	54 Å²	54	8%	0.083	31%	0.307	C	S	.	.	H	α-helix	trans	-59	-26.7	178.3	0	0	0	0	0	113.7	L719 S725 L726 Y753	L719-A723 VanDerWaalsContact O-CB 3.25Å; L719-A723 WeakPolarHBondContact O-CB 3.45Å; L719-A723 PolarHBondContact O-N 3.24Å; A723-S725 PolarHBondContact O-N 2.95Å; A723-L726 WeakPolarHBondContact O-CB 3.5Å; A723-L726 WeakPolarHBondContact O-CG 3.47Å; A723-L726 PolarHBondContact O-N 3.25Å; A723-Y753 HydrophobicContact CB-CE2 4.26Å
724	S	85.9	Confident	85.1	Confident	5 Å²	5	49.2 Å²	49.2	4%	0.035	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-62.6	-25.6	175.8	75.9	0	0	0	0	113.7	T720 V721 E722 L726 T727 N728 D734	T720-S724 PolarHBondContact O-N 3.28Å; V721-S724 WeakPolarHBondContact O-CB 3.36Å; V721-S724 PolarHBondContact O-N 3.19Å; V721-S724 PolarHBondContact O-OG 3.42Å; E722-S724 PolarHBondContact O-N 3.16Å; E722-S724 VanDerWaalsContact O-N 3.15Å; S724-L726 PolarHBondContact O-N 2.84Å; S724-T727 PolarHBondContact O-N 3.04Å; S724-T727 VanDerWaalsContact O-N 3.09Å; S724-T727 PolarHBondContact O-OG1 3.49Å; S724-N728 PolarHBondContact O-N 3.19Å; S724-N728 PolarHBondContact O-ND2 2.93Å; S724-D734 PolarHBondContact OG-N 2.9Å
725	S	83.7	Confident	84.7	Confident	33 Å²	33	52.6 Å²	52.6	23%	0.231	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-60.9	-32.5	178.3	64.9	0	0	0	0	113	E722 A723 T727 G731	E722-S725 VanDerWaalsContact O-CB 3.31Å; E722-S725 WeakPolarHBondContact O-CB 3.34Å; E722-S725 PolarHBondContact O-N 2.98Å; E722-S725 PolarHBondContact O-OG 2.86Å; A723-S725 PolarHBondContact O-N 2.95Å; S725-T727 PolarHBondContact O-N 3.23Å; S725-G731 WeakPolarHBondContact O-CA 3.17Å
726	L	71.6	Confident	84.4	Confident	94 Å²	94	55 Å²	55	49%	0.492	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-65.6	-19	178.6	-54.3	173.4	0	0	0	112.5	A723 S724	A723-L726 WeakPolarHBondContact O-CB 3.5Å; A723-L726 WeakPolarHBondContact O-CG 3.47Å; A723-L726 PolarHBondContact O-N 3.25Å; S724-L726 PolarHBondContact O-N 2.84Å
727	T	67.8	Low	84.1	Confident	43 Å²	43	55.4 Å²	55.4	26%	0.264	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.8	-17.7	-163.3	69.1	0	0	0	0	112.9	S724 S725 V749 V836	S724-T727 PolarHBondContact O-N 3.04Å; S724-T727 VanDerWaalsContact O-N 3.09Å; S724-T727 PolarHBondContact O-OG1 3.49Å; S725-T727 PolarHBondContact O-N 3.23Å; T727-V749 HydrophobicContact CG2-CB 3.59Å; T727-V749 HydrophobicContact CG2-CG1 3.41Å; T727-V749 VanDerWaalsContact CG2-CG1 3.41Å; T727-V836 HydrophobicContact CG2-CG1 4.27Å
728	N	71.4	Confident	84	Confident	58 Å²	58	55.6 Å²	55.6	31%	0.31	32%	0.324	S	S	.	.	S	Bend	trans	-69.8	125.7	164.6	-86.8	-42.5	0	0	0	110.2	S724 N730 G731 L732	S724-N728 PolarHBondContact O-N 3.19Å; S724-N728 PolarHBondContact O-ND2 2.93Å; N728-N730 PolarHBondContact O-N 3.42Å; N728-G731 PolarHBondContact O-N 3.28Å; N728-L732 VanDerWaalsContact CB-O 3.25Å; N728-L732 WeakPolarHBondContact CB-O 3.24Å; N728-L732 PolarHBondContact ND2-O 3.03Å
729	P	70.8	Confident	84.1	Confident	105 Å²	105	53.6 Å²	53.6	68%	0.682	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-5.2	-176.1	-27.7	35.8	0	0	0	117.1
730	N	78.9	Confident	84.1	Confident	134 Å²	134	55.6 Å²	55.6	72%	0.717	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	-0.5	178.3	-62.5	-6.3	0	0	0	113	N728 L732	N728-N730 PolarHBondContact O-N 3.42Å; N730-L732 HydrophobicContact CB-CB 4.44Å; N730-L732 HydrophobicContact CB-CD1 3.98Å; N730-L732 HydrophobicContact CB-CG 3.9Å; N730-L732 PolarHBondContact O-N 3.05Å
731	G	77.8	Confident	84.2	Confident	52 Å²	52	58.7 Å²	58.7	54%	0.536	33%	0.33	S	S	.	.	S	Bend	trans	69.4	10.8	-171.1	0	0	0	0	0	114.5	S725 N728	S725-G731 WeakPolarHBondContact O-CA 3.17Å; N728-G731 PolarHBondContact O-N 3.28Å
732	L	83.2	Confident	84.4	Confident	111 Å²	111	58.7 Å²	58.7	58%	0.581	33%	0.329	S	S	*	.			trans	-90.5	139.1	-175.6	-64.1	177	0	0	0	111.4	N728 N730	N728-L732 VanDerWaalsContact CB-O 3.25Å; N728-L732 WeakPolarHBondContact CB-O 3.24Å; N728-L732 PolarHBondContact ND2-O 3.03Å; N730-L732 HydrophobicContact CB-CB 4.44Å; N730-L732 HydrophobicContact CB-CD1 3.98Å; N730-L732 HydrophobicContact CB-CG 3.9Å; N730-L732 PolarHBondContact O-N 3.05Å
733	V	85	Confident	84.7	Confident	81 Å²	81	54.5 Å²	54.5	49%	0.491	31%	0.309	S	S	.	.			trans	-64.3	127.5	169.3	167.5	0	0	0	0	110.5	V721	V721-V733 HydrophobicContact CG1-CG1 3.29Å
734	D	85.6	Confident	85.1	Confident	42 Å²	42	56.6 Å²	56.6	23%	0.225	32%	0.318	C	S	.	.			trans	-89.9	105.9	163.7	176.2	26.1	0	0	0	110.5	S724 Q736 A737	S724-D734 PolarHBondContact OG-N 2.9Å; D734-Q736 PolarHBondContact O-N 3.05Å; D734-Q736 VanDerWaalsContact O-N 3.1Å; D734-Q736 WeakPolarHBondContact OD1-CA 3.41Å; D734-Q736 VanDerWaalsContact OD1-CB 3.23Å; D734-Q736 WeakPolarHBondContact OD1-CB 3.47Å; D734-Q736 VanDerWaalsContact OD1-CG 3.23Å; D734-Q736 WeakPolarHBondContact OD1-CG 3.41Å; D734-Q736 PolarHBondContact OD1-N 3.1Å; D734-A737 HydrophobicContact CB-CB 4.38Å; D734-A737 WeakPolarHBondContact O-CB 3.46Å; D734-A737 PolarHBondContact O-N 3.15Å; D734-A737 PolarHBondContact OD2-N 2.82Å
735	S	87.9	Confident	85.2	Confident	72 Å²	72	59.6 Å²	59.6	50%	0.503	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-10.2	174.8	61.3	0	0	0	0	114.1	R711	R711-S735 PolarHBondContact NH2-O 3.17Å
736	Q	87.7	Confident	85.2	Confident	87 Å²	87	64.5 Å²	64.5	41%	0.407	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-11.7	178.6	-39.9	-62.6	-81.5	0	0	113.4	R711 D734 R740	R711-Q736 PolarHBondContact NH2-O 3.12Å; D734-Q736 PolarHBondContact O-N 3.05Å; D734-Q736 VanDerWaalsContact O-N 3.1Å; D734-Q736 WeakPolarHBondContact OD1-CA 3.41Å; D734-Q736 VanDerWaalsContact OD1-CB 3.23Å; D734-Q736 WeakPolarHBondContact OD1-CB 3.47Å; D734-Q736 VanDerWaalsContact OD1-CG 3.23Å; D734-Q736 WeakPolarHBondContact OD1-CG 3.41Å; D734-Q736 PolarHBondContact OD1-N 3.1Å; Q736-R740 VanDerWaalsContact NE2-NH2 3.19Å
737	A	90.3	Very high	85.6	Confident	9 Å²	9	65.4 Å²	65.4	7%	0.074	36%	0.359	C	S	.	.			trans	-61	159.1	-174.1	0	0	0	0	0	114.4	R711 D734 T748	R711-A737 VanDerWaalsContact CZ-O 3.26Å; R711-A737 PolarHBondContact NH1-O 3.1Å; R711-A737 PolarHBondContact NH2-O 2.91Å; D734-A737 HydrophobicContact CB-CB 4.38Å; D734-A737 WeakPolarHBondContact O-CB 3.46Å; D734-A737 PolarHBondContact O-N 3.15Å; D734-A737 PolarHBondContact OD2-N 2.82Å; A737-T748 HydrophobicContact CB-CG2 4.43Å
738	G	92.5	Very high	86.3	Confident	8 Å²	8	64 Å²	64	8%	0.082	35%	0.35	C	S	.	.	S	Bend	trans	72.1	-162.1	-174.1	0	0	0	0	0	114.1	T748	G738-T748 PolarHBondContact N-OG1 3.01Å
739	Y	95.1	Very high	86.4	Confident	17 Å²	17	62.8 Å²	62.8	7%	0.067	35%	0.345	C	S	.	.			trans	-74	145	-171.1	-55.7	-60.2	0	0	0	114.7	R711 R743 L744 V752 E754 N767 V769 V770	R711-Y739 PolarHBondContact NH1-O 2.81Å; Y739-R743 WeakPolarHBondContact CA-O 3.39Å; Y739-L744 HydrophobicContact CD1-CB 3.87Å; Y739-L744 HydrophobicContact CD1-CD1 4.43Å; Y739-L744 HydrophobicContact CE1-CB 3.98Å; Y739-V752 HydrophobicContact CD2-CG1 3.92Å; Y739-V752 HydrophobicContact CE2-CG1 3.56Å; Y739-E754 HydrophobicContact CE2-CG 4.05Å; Y739-E754 WeakPolarHBondContact CE2-OE1 3.49Å; Y739-E754 VanDerWaalsContact CZ-OE1 3.27Å; Y739-E754 PolarHBondContact OH-OE1 2.84Å; Y739-N767 WeakPolarHBondContact CD2-OD1 3.27Å; Y739-V769 HydrophobicContact CD1-CB 4.47Å; Y739-V769 HydrophobicContact CD1-CG2 3.95Å; Y739-V769 HydrophobicContact CD2-CB 4.45Å; Y739-V769 HydrophobicContact CD2-CG2 3.68Å; Y739-V769 HydrophobicContact CE1-CB 4.01Å; Y739-V769 HydrophobicContact CE1-CG1 4.4Å; Y739-V769 HydrophobicContact CE1-CG2 3.98Å; Y739-V769 HydrophobicContact CE2-CB 3.95Å; Y739-V769 HydrophobicContact CE2-CG2 3.67Å; Y739-V769 HydrophobicContact CG-CG2 3.8Å; Y739-V770 VanDerWaalsContact OH-CG2 3.31Å; Y739-V770 WeakPolarHBondContact OH-CG2 3.04Å
740	R	92.8	Very high	86.4	Confident	91 Å²	91	58.5 Å²	58.5	34%	0.343	32%	0.32	S	S	.	.	B	Isolated β-bridge	trans	-131.5	125.8	165.9	-70.5	-169.7	159.1	-171.1	-6.1	109.8	Q736 R742 R743	Q736-R740 VanDerWaalsContact NE2-NH2 3.19Å; R740-R742 PolarHBondContact O-N 3.46Å; R740-R743 PolarHBondContact N-O 3.35Å; R740-R743 PolarHBondContact O-N 3.45Å
741	Y	94.1	Very high	86.7	Confident	67 Å²	67	53.5 Å²	53.5	26%	0.263	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.8	42.8	-170.8	-45.7	-63.3	0	0	0	111.8	M612 E616 R743	M612-Y741 HydrophobicContact CB-CD1 4.02Å; M612-Y741 HydrophobicContact CB-CD2 3.59Å; M612-Y741 HydrophobicContact CB-CE1 4.04Å; M612-Y741 HydrophobicContact CB-CE2 3.61Å; M612-Y741 HydrophobicContact CB-CG 3.8Å; M612-Y741 HydrophobicContact CE-CD2 4.32Å; M612-Y741 HydrophobicContact CE-CG 3.95Å; M612-Y741 HydrophobicContact CG-CD2 4.04Å; M612-Y741 HydrophobicContact CG-CE2 4.35Å; M612-Y741 HydrophobicContact CG-CG 4.42Å; E616-Y741 HydrophobicContact CB-CD1 4.36Å; E616-Y741 HydrophobicContact CB-CE1 4.37Å; E616-Y741 WeakPolarHBondContact OE2-CE1 3.44Å; Y741-R743 PolarHBondContact O-N 2.86Å
742	R	95.5	Very high	87.3	Confident	4 Å²	4	52.9 Å²	52.9	2%	0.015	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.7	21.9	-178.2	-63.4	165.9	49.4	79.9	17.3	115.2	D629 R740 C765 R768 V769 Q772	D629-R742 HydrophobicContact CB-CB 3.85Å; D629-R742 IonicContact OD1-CZ 2.6Å; D629-R742 IonicContact OD1-NE 2.72Å; D629-R742 PolarHBondContact OD1-NE 3.18Å; D629-R742 IonicContact OD1-NH2 2.7Å; D629-R742 IonicContact OD2-CZ 3.42Å; D629-R742 VanDerWaalsContact OD2-CZ 3.28Å; D629-R742 IonicContact OD2-NE 2.69Å; D629-R742 PolarHBondContact OD2-NE 3.44Å; D629-R742 IonicContact OD2-NH2 3.05Å; D629-R742 PolarHBondContact OD2-NH2 2.93Å; R740-R742 PolarHBondContact O-N 3.46Å; R742-C765 PolarHBondContact NH1-O 2.82Å; R742-C765 VanDerWaalsContact NH1-O 3.11Å; R742-R768 PolarHBondContact NH1-O 3.33Å; R742-V769 HydrophobicContact CB-CG2 3.79Å; R742-V769 HydrophobicContact CG-CG2 4.07Å; R742-V769 WeakPolarHBondContact O-CG1 3.45Å; R742-Q772 VanDerWaalsContact NH1-NE2 3.2Å
743	R	95.1	Very high	87.7	Confident	21 Å²	21	53 Å²	53	8%	0.079	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-121.2	138.6	173.6	-62.8	-173.2	-179.2	114	3.9	112.2	D629 F631 Y739 R740 Y741 G799 T800	D629-R743 PolarHBondContact O-NH2 3.37Å; F631-R743 PolarHBondContact O-NH1 3.06Å; F631-R743 PolarHBondContact O-NH2 3.17Å; Y739-R743 WeakPolarHBondContact CA-O 3.39Å; R740-R743 PolarHBondContact N-O 3.35Å; R740-R743 PolarHBondContact O-N 3.45Å; Y741-R743 PolarHBondContact O-N 2.86Å; R743-G799 CarbonylContact C-O 3.53Å; R743-G799 WeakPolarHBondContact CA-O 3.3Å; R743-G799 WeakPolarHBondContact CB-O 3.35Å; R743-T800 PolarHBondContact NE-OG1 3.45Å
744	L	94.3	Very high	88.2	Confident	55 Å²	55	50.8 Å²	50.8	29%	0.288	26%	0.263	S	S	.	.			trans	-95.7	99.8	177	-171.9	61.9	0	0	0	109.9	Y739 Q746 V752 G799	Y739-L744 HydrophobicContact CD1-CB 3.87Å; Y739-L744 HydrophobicContact CD1-CD1 4.43Å; Y739-L744 HydrophobicContact CE1-CB 3.98Å; L744-Q746 WeakPolarHBondContact CD1-O 3.27Å; L744-Q746 WeakPolarHBondContact CG-O 3.49Å; L744-V752 HydrophobicContact CD1-CG2 4.22Å; L744-V752 HydrophobicContact CD2-CG2 4.39Å; L744-G799 PolarHBondContact N-O 2.79Å; L744-G799 WeakPolarHBondContact O-CA 3.49Å
745	S	87.9	Confident	88.7	Confident	68 Å²	68	48.8 Å²	48.8	48%	0.476	25%	0.253	S	S	.	.			trans	-81.1	-17.3	-172.5	-67.3	0	0	0	0	114.8
746	Q	83.4	Confident	88.9	Confident	136 Å²	136	46.1 Å²	46.1	64%	0.636	23%	0.233	S	C	*	.	S	Bend	trans	-142.5	147.4	-179.3	-59.1	-170.6	39	0	0	109.8	L744 T748	L744-Q746 WeakPolarHBondContact CD1-O 3.27Å; L744-Q746 WeakPolarHBondContact CG-O 3.49Å; Q746-T748 PolarHBondContact O-N 2.94Å
747	F	81.3	Confident	89.1	Confident	112 Å²	112	45.2 Å²	45.2	49%	0.491	24%	0.236	S	C	.	.			trans	-64.1	127.6	175.6	175.4	-128	0	0	0	110.6	V749 Y832 I1325	F747-V749 HydrophobicContact CD1-CG2 3.82Å; F747-V749 HydrophobicContact CE1-CB 4.31Å; F747-V749 HydrophobicContact CE1-CG2 3.53Å; F747-V749 HydrophobicContact CZ-CG2 4.3Å; F747-Y832 HydrophobicContact CE1-CE1 4.4Å; F747-Y832 AromaticContact CZ-CE1 3.85Å; F747-Y832 HydrophobicContact CZ-CE1 3.85Å; F747-I1325 HydrophobicContact CD2-CD1 3.92Å; F747-I1325 HydrophobicContact CE2-CD1 3.9Å; F747-I1325 HydrophobicContact CE2-CG1 4.34Å; F747-I1325 HydrophobicContact CE2-CG2 4.21Å
748	T	81.4	Confident	89.2	Confident	14 Å²	14	47.8 Å²	47.8	9%	0.086	25%	0.248	C	C	.	.			trans	-107.4	104.8	176	-51.9	0	0	0	0	108.1	T720 A737 G738 Q746 G750 G751	T720-T748 HydrophobicContact CG2-CG2 4.13Å; A737-T748 HydrophobicContact CB-CG2 4.43Å; G738-T748 PolarHBondContact N-OG1 3.01Å; Q746-T748 PolarHBondContact O-N 2.94Å; T748-G750 VanDerWaalsContact C-N 3.33Å; T748-G750 PolarHBondContact O-N 3.06Å; T748-G751 WeakPolarHBondContact CG2-O 3.16Å; T748-G751 PolarHBondContact O-N 2.87Å
749	V	73.3	Confident	89.3	Confident	33 Å²	33	47.9 Å²	47.9	20%	0.2	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-38.7	-169.3	169.7	0	0	0	0	112.3	T727 F747 G751 Y832 V836	T727-V749 HydrophobicContact CG2-CB 3.59Å; T727-V749 HydrophobicContact CG2-CG1 3.41Å; T727-V749 VanDerWaalsContact CG2-CG1 3.41Å; F747-V749 HydrophobicContact CD1-CG2 3.82Å; F747-V749 HydrophobicContact CE1-CB 4.31Å; F747-V749 HydrophobicContact CE1-CG2 3.53Å; F747-V749 HydrophobicContact CZ-CG2 4.3Å; V749-G751 PolarHBondContact O-N 3.02Å; V749-Y832 HydrophobicContact CG1-CE1 3.77Å; V749-V836 HydrophobicContact CG1-CG1 4.48Å; V749-V836 HydrophobicContact CG1-CG2 4.13Å
750	G	71.7	Confident	89.3	Confident	15 Å²	15	53.9 Å²	53.9	16%	0.155	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	13.1	175.2	0	0	0	0	0	115.3	T748	T748-G750 VanDerWaalsContact C-N 3.33Å; T748-G750 PolarHBondContact O-N 3.06Å
751	G	84.4	Confident	89.4	Confident	28 Å²	28	49.7 Å²	49.7	29%	0.289	26%	0.261	S	S	.	.			trans	77.9	-166.9	-175	0	0	0	0	0	113.9	T748 V749	T748-G751 WeakPolarHBondContact CG2-O 3.16Å; T748-G751 PolarHBondContact O-N 2.87Å; V749-G751 PolarHBondContact O-N 3.02Å
752	V	90.6	Very high	89.3	Confident	39 Å²	39	49.2 Å²	49.2	24%	0.236	26%	0.263	C	S	.	.			trans	-137.5	126.6	177.5	178.3	0	0	0	0	109.1	T720 Y739 L744 E754	T720-V752 HydrophobicContact CG2-CB 4.25Å; T720-V752 HydrophobicContact CG2-CG1 4.11Å; T720-V752 HydrophobicContact CG2-CG2 4.07Å; Y739-V752 HydrophobicContact CD2-CG1 3.92Å; Y739-V752 HydrophobicContact CE2-CG1 3.56Å; L744-V752 HydrophobicContact CD1-CG2 4.22Å; L744-V752 HydrophobicContact CD2-CG2 4.39Å; V752-E754 PolarHBondContact O-N 3.2Å
753	Y	92	Very high	89.1	Confident	113 Å²	113	53 Å²	53	44%	0.443	28%	0.277	S	S	.	.			trans	-89.8	95.1	180	-63.4	-95	0	0	0	109.8	C716 L719 T720 A723 N767	C716-Y753 WeakPolarHBondContact O-CB 3.36Å; L719-Y753 HydrophobicContact CB-CD1 4.38Å; L719-Y753 HydrophobicContact CB-CD2 3.68Å; L719-Y753 HydrophobicContact CB-CE2 4.14Å; L719-Y753 HydrophobicContact CB-CG 3.82Å; L719-Y753 HydrophobicContact CD1-CD1 3.94Å; L719-Y753 HydrophobicContact CD1-CE1 4.42Å; L719-Y753 HydrophobicContact CD1-CG 4.08Å; T720-Y753 PolarHBondContact OG1-N 2.95Å; A723-Y753 HydrophobicContact CB-CE2 4.26Å; Y753-N767 PolarHBondContact O-ND2 3.17Å
754	E	95.2	Very high	89	Confident	35 Å²	35	54 Å²	54	16%	0.164	28%	0.281	C	S	.	.			trans	-68.5	157.8	175.6	-58.5	-146.3	149.4	0	0	112.6	Y739 V752 N767 V769 V770 Q771	Y739-E754 HydrophobicContact CE2-CG 4.05Å; Y739-E754 WeakPolarHBondContact CE2-OE1 3.49Å; Y739-E754 VanDerWaalsContact CZ-OE1 3.27Å; Y739-E754 PolarHBondContact OH-OE1 2.84Å; V752-E754 PolarHBondContact O-N 3.2Å; E754-N767 WeakPolarHBondContact CA-O 3.48Å; E754-N767 WeakPolarHBondContact CB-O 3.3Å; E754-V769 WeakPolarHBondContact OE1-CA 3.46Å; E754-V769 PolarHBondContact OE1-N 2.99Å; E754-V769 PolarHBondContact OE2-N 3.26Å; E754-V770 PolarHBondContact OE1-N 3.41Å; E754-V770 PolarHBondContact OE2-N 3.39Å; E754-Q771 WeakPolarHBondContact OE2-CG 3.28Å; E754-Q771 PolarHBondContact OE2-N 2.92Å; E754-Q771 PolarHBondContact OE2-NE2 3.2Å
755	C	95.8	Very high	89.1	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.007	27%	0.267	C	S	.	.			trans	-71.7	145.8	168.8	-61.5	0	0	0	0	110.8	C702 C759 C761 N767 R768 Q771	C702-C755 VanDerWaalsContact SG-SG 3.62Å; C755-C759 HydrophobicContact CB-CB 4.01Å; C755-C761 VanDerWaalsContact CB-SG 3.55Å; C755-N767 PolarHBondContact N-ND2 3.11Å; C755-N767 PolarHBondContact N-O 2.83Å; C755-N767 PolarHBondContact SG-ND2 2.97Å; C755-N767 VanDerWaalsContact SG-ND2 3.42Å; C755-R768 HydrophobicContact CB-CG 3.97Å; C755-R768 PolarHBondContact O-NH1 2.79Å; C755-R768 VanDerWaalsContact O-NH1 3.09Å; C755-Q771 PolarHBondContact O-NE2 3.45Å; C755-Q771 PolarHBondContact O-OE1 2.6Å
756	N	92.6	Very high	89.3	Confident	16 Å²	16	48.9 Å²	48.9	9%	0.086	25%	0.25	C	C	.	.			trans	-121.5	-174	-171.2	50.7	43.7	0	0	0	111.8	V700 N758 C759 R768	V700-N756 PolarHBondContact O-ND2 3.1Å; N756-N758 VanDerWaalsContact C-N 3.25Å; N756-N758 PolarHBondContact O-N 2.9Å; N756-N758 PolarHBondContact OD1-N 3.34Å; N756-C759 PolarHBondContact N-SG 2.95Å; N756-C759 WeakPolarHBondContact O-CB 3.48Å; N756-C759 PolarHBondContact O-N 2.81Å; N756-C759 VanDerWaalsContact O-N 3.14Å; N756-C759 PolarHBondContact OD1-SG 3.17Å; N756-R768 PolarHBondContact O-NH1 3.22Å; N756-R768 VanDerWaalsContact O-NH1 3.09Å; N756-R768 PolarHBondContact O-NH2 3.38Å
757	S	91.2	Very high	89.9	Confident	68 Å²	68	42.4 Å²	42.4	48%	0.476	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-30.6	179.9	38.8	0	0	0	0	113.3	C759 E1334	S757-C759 PolarHBondContact O-N 3.22Å; S757-E1334 WeakPolarHBondContact CB-OE2 3.42Å; S757-E1334 PolarHBondContact OG-OE2 2.82Å
758	N	92.4	Very high	90.6	Very high	63 Å²	63	38.2 Å²	38.2	34%	0.337	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-4.5	176.1	-66.7	-10.4	0	0	0	114.2	S696 C701 N756	S696-N758 PolarHBondContact O-ND2 2.64Å; S696-N758 PolarHBondContact OG-ND2 2.89Å; S696-N758 PolarHBondContact OG-OD1 2.92Å; C701-N758 HydrophobicContact CB-CB 3.7Å; C701-N758 VanDerWaalsContact CB-O 3.28Å; C701-N758 WeakPolarHBondContact CB-O 3.27Å; C701-N758 PolarHBondContact SG-O 2.78Å; C701-N758 VanDerWaalsContact SG-O 3.34Å; N756-N758 VanDerWaalsContact C-N 3.25Å; N756-N758 PolarHBondContact O-N 2.9Å; N756-N758 PolarHBondContact OD1-N 3.34Å
759	C	94.9	Very high	91.3	Very high	9 Å²	9	37.8 Å²	37.8	6%	0.061	20%	0.198	C	C	.	.	S	Bend	trans	-90.4	138	179.9	-60.6	0	0	0	0	112.2	C701 C702 C755 N756 S757 C761	C701-C759 WeakPolarHBondContact CA-SG 3.2Å; C701-C759 HydrophobicContact CB-CB 4.42Å; C701-C759 WeakPolarHBondContact CB-SG 3.48Å; C702-C759 PolarHBondContact N-SG 3.02Å; C702-C759 VanDerWaalsContact N-SG 3.39Å; C702-C759 WeakPolarHBondContact O-CA 3.36Å; C755-C759 HydrophobicContact CB-CB 4.01Å; N756-C759 PolarHBondContact N-SG 2.95Å; N756-C759 WeakPolarHBondContact O-CB 3.48Å; N756-C759 PolarHBondContact O-N 2.81Å; N756-C759 VanDerWaalsContact O-N 3.14Å; N756-C759 PolarHBondContact OD1-SG 3.17Å; S757-C759 PolarHBondContact O-N 3.22Å; C759-C761 PolarHBondContact O-N 3.44Å
760	Q	94.7	Very high	92.2	Very high	143 Å²	143	37.2 Å²	37.2	67%	0.668	19%	0.194	S	C	*	.	S	Bend	trans	-69.6	-16.4	179.6	-62.7	-62	-38	0	0	114.1	C702	C702-Q760 PolarHBondContact O-N 3.15Å
761	C	94.8	Very high	93.2	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.02	20%	0.2	C	C	.	.	S	Bend	trans	-74.6	136.2	177.6	60.6	0	0	0	0	112.5	C704 C708 C755 C759 C765 R768	C704-C761 WeakPolarHBondContact O-CB 3.35Å; C704-C761 PolarHBondContact O-N 3.01Å; C708-C761 VanDerWaalsContact SG-SG 3.62Å; C755-C761 VanDerWaalsContact CB-SG 3.55Å; C759-C761 PolarHBondContact O-N 3.44Å; C761-C765 HydrophobicContact CB-CB 3.95Å; C761-R768 PolarHBondContact O-NE 2.7Å; C761-R768 PolarHBondContact O-NH2 2.84Å
762	D	92.9	Very high	93.5	Very high	58 Å²	58	40.3 Å²	40.3	31%	0.31	20%	0.197	S	C	.	.			trans	-77.9	-175.2	-176.9	77.8	66.1	0	0	0	113.4	N707 R764 C765 R768	N707-D762 PolarHBondContact ND2-OD2 3.48Å; N707-D762 PolarHBondContact OD1-N 2.74Å; N707-D762 PolarHBondContact OD1-OD2 2.91Å; D762-R764 PolarHBondContact O-N 3.44Å; D762-R764 VanDerWaalsContact O-N 3.16Å; D762-R764 WeakPolarHBondContact OD1-CB 3.09Å; D762-R764 VanDerWaalsContact OD1-CG 3.24Å; D762-R764 WeakPolarHBondContact OD1-CG 3.45Å; D762-R764 IonicContact OD1-CZ 3.42Å; D762-R764 PolarHBondContact OD1-N 3.16Å; D762-R764 IonicContact OD1-NE 3.27Å; D762-R764 PolarHBondContact OD1-NE 3.44Å; D762-R764 IonicContact OD2-CZ 3.67Å; D762-R764 VanDerWaalsContact OD2-CZ 3.31Å; D762-R764 IonicContact OD2-NE 2.78Å; D762-R764 PolarHBondContact OD2-NE 3.03Å; D762-R764 VanDerWaalsContact OD2-NE 3.09Å; D762-R764 IonicContact OD2-NH2 2.66Å; D762-R764 PolarHBondContact OD2-NH2 3.46Å; D762-C765 WeakPolarHBondContact O-CB 3.45Å; D762-C765 PolarHBondContact O-N 3.02Å; D762-C765 VanDerWaalsContact O-N 3.11Å; D762-R768 VanDerWaalsContact O-CD 3.29Å; D762-R768 WeakPolarHBondContact O-CD 3.32Å; D762-R768 PolarHBondContact O-NE 3.39Å; D762-R768 VanDerWaalsContact O-NE 3.09Å
763	R	91.5	Very high	93.5	Very high	82 Å²	82	39.5 Å²	39.5	31%	0.309	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-28.4	-178.6	70.8	177.8	-174.2	78.2	13.5	113.8	Q625 C765 Q772	Q625-R763 PolarHBondContact O-NH2 3.27Å; R763-C765 PolarHBondContact O-N 3.17Å; R763-Q772 PolarHBondContact O-NE2 2.86Å
764	R	92.8	Very high	93.6	Very high	42 Å²	42	34.2 Å²	34.2	16%	0.158	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-13	-178.6	-61.3	172.2	-65.7	176.3	-0.7	113.2	N623 S624 T627 D762 S766	N623-R764 PolarHBondContact O-NH1 2.95Å; N623-R764 PolarHBondContact OD1-NH1 3.41Å; N623-R764 PolarHBondContact OD1-NH2 2.82Å; N623-R764 VanDerWaalsContact OD1-NH2 3.1Å; S624-R764 WeakPolarHBondContact O-CD 3.32Å; S624-R764 PolarHBondContact O-NH1 3.36Å; T627-R764 HydrophobicContact CG2-CB 4.03Å; T627-R764 HydrophobicContact CG2-CG 4.15Å; D762-R764 PolarHBondContact O-N 3.44Å; D762-R764 VanDerWaalsContact O-N 3.16Å; D762-R764 WeakPolarHBondContact OD1-CB 3.09Å; D762-R764 VanDerWaalsContact OD1-CG 3.24Å; D762-R764 WeakPolarHBondContact OD1-CG 3.45Å; D762-R764 IonicContact OD1-CZ 3.42Å; D762-R764 PolarHBondContact OD1-N 3.16Å; D762-R764 IonicContact OD1-NE 3.27Å; D762-R764 PolarHBondContact OD1-NE 3.44Å; D762-R764 IonicContact OD2-CZ 3.67Å; D762-R764 VanDerWaalsContact OD2-CZ 3.31Å; D762-R764 IonicContact OD2-NE 2.78Å; D762-R764 PolarHBondContact OD2-NE 3.03Å; D762-R764 VanDerWaalsContact OD2-NE 3.09Å; D762-R764 IonicContact OD2-NH2 2.66Å; D762-R764 PolarHBondContact OD2-NH2 3.46Å; R764-S766 PolarHBondContact O-N 3Å
765	C	95.1	Very high	93.5	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.176	C	C	.	.			trans	-40.5	132.6	179.2	173.6	0	0	0	0	113.2	N707 R742 C761 D762 R763 N767 R768	N707-C765 VanDerWaalsContact O-CA 3.3Å; N707-C765 WeakPolarHBondContact O-CA 3.34Å; R742-C765 PolarHBondContact NH1-O 2.82Å; R742-C765 VanDerWaalsContact NH1-O 3.11Å; C761-C765 HydrophobicContact CB-CB 3.95Å; D762-C765 WeakPolarHBondContact O-CB 3.45Å; D762-C765 PolarHBondContact O-N 3.02Å; D762-C765 VanDerWaalsContact O-N 3.11Å; R763-C765 PolarHBondContact O-N 3.17Å; C765-N767 PolarHBondContact O-N 3.08Å; C765-N767 PolarHBondContact SG-N 3.19Å; C765-R768 HydrophobicContact CB-CB 4.29Å; C765-R768 HydrophobicContact CB-CG 3.78Å; C765-R768 PolarHBondContact O-N 3.23Å
766	S	93.8	Very high	93.5	Very high	16 Å²	16	35.1 Å²	35.1	11%	0.112	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-4.8	-179.3	-84.2	0	0	0	0	113.8	E616 N707 R764	E616-S766 PolarHBondContact OE1-OG 3.09Å; E616-S766 VanDerWaalsContact OE1-OG 3.05Å; N707-S766 PolarHBondContact O-N 2.85Å; N707-S766 VanDerWaalsContact O-N 3.08Å; R764-S766 PolarHBondContact O-N 3Å
767	N	96	Very high	93.6	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.9	31.2	179	-164.7	49	0	0	0	113.4	Q717 Y739 Y753 E754 C755 C765	Q717-N767 HydrophobicContact CG-CB 3.92Å; Y739-N767 WeakPolarHBondContact CD2-OD1 3.27Å; Y753-N767 PolarHBondContact O-ND2 3.17Å; E754-N767 WeakPolarHBondContact CA-O 3.48Å; E754-N767 WeakPolarHBondContact CB-O 3.3Å; C755-N767 PolarHBondContact N-ND2 3.11Å; C755-N767 PolarHBondContact N-O 2.83Å; C755-N767 PolarHBondContact SG-ND2 2.97Å; C755-N767 VanDerWaalsContact SG-ND2 3.42Å; C765-N767 PolarHBondContact O-N 3.08Å; C765-N767 PolarHBondContact SG-N 3.19Å
768	R	95.4	Very high	93.8	Very high	23 Å²	23	33.5 Å²	33.5	9%	0.087	16%	0.164	C	C	.	.			trans	-128.6	69.3	173.2	-69.9	-173.6	-174.1	-83.6	5.5	111	R742 C755 N756 C761 D762 C765 Q771 Q772	R742-R768 PolarHBondContact NH1-O 3.33Å; C755-R768 HydrophobicContact CB-CG 3.97Å; C755-R768 PolarHBondContact O-NH1 2.79Å; C755-R768 VanDerWaalsContact O-NH1 3.09Å; N756-R768 PolarHBondContact O-NH1 3.22Å; N756-R768 VanDerWaalsContact O-NH1 3.09Å; N756-R768 PolarHBondContact O-NH2 3.38Å; C761-R768 PolarHBondContact O-NE 2.7Å; C761-R768 PolarHBondContact O-NH2 2.84Å; D762-R768 VanDerWaalsContact O-CD 3.29Å; D762-R768 WeakPolarHBondContact O-CD 3.32Å; D762-R768 PolarHBondContact O-NE 3.39Å; D762-R768 VanDerWaalsContact O-NE 3.09Å; C765-R768 HydrophobicContact CB-CB 4.29Å; C765-R768 HydrophobicContact CB-CG 3.78Å; C765-R768 PolarHBondContact O-N 3.23Å; R768-Q771 HydrophobicContact CB-CG 3.98Å; R768-Q772 PolarHBondContact O-NE2 3.11Å; R768-Q772 VanDerWaalsContact O-NE2 3.16Å
769	V	95.2	Very high	93.9	Very high	5 Å²	5	31.3 Å²	31.3	3%	0.03	15%	0.151	C	C	.	.			trans	-100.6	-65.7	-168.9	-172.2	0	0	0	0	111.4	Y739 R742 E754 Q771 Q772 F801	Y739-V769 HydrophobicContact CD1-CB 4.47Å; Y739-V769 HydrophobicContact CD1-CG2 3.95Å; Y739-V769 HydrophobicContact CD2-CB 4.45Å; Y739-V769 HydrophobicContact CD2-CG2 3.68Å; Y739-V769 HydrophobicContact CE1-CB 4.01Å; Y739-V769 HydrophobicContact CE1-CG1 4.4Å; Y739-V769 HydrophobicContact CE1-CG2 3.98Å; Y739-V769 HydrophobicContact CE2-CB 3.95Å; Y739-V769 HydrophobicContact CE2-CG2 3.67Å; Y739-V769 HydrophobicContact CG-CG2 3.8Å; R742-V769 HydrophobicContact CB-CG2 3.79Å; R742-V769 HydrophobicContact CG-CG2 4.07Å; R742-V769 WeakPolarHBondContact O-CG1 3.45Å; E754-V769 WeakPolarHBondContact OE1-CA 3.46Å; E754-V769 PolarHBondContact OE1-N 2.99Å; E754-V769 PolarHBondContact OE2-N 3.26Å; V769-Q771 PolarHBondContact O-N 2.86Å; V769-Q772 PolarHBondContact O-N 2.87Å; V769-Q772 VanDerWaalsContact O-N 3.15Å; V769-F801 HydrophobicContact CG1-CB 3.84Å
770	V	94.1	Very high	93.9	Very high	21 Å²	21	31.9 Å²	31.9	13%	0.127	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-62	-33.2	-176.4	171.9	0	0	0	0	111.2	Y739 E754 Q772 G773 F801 V1327	Y739-V770 VanDerWaalsContact OH-CG2 3.31Å; Y739-V770 WeakPolarHBondContact OH-CG2 3.04Å; E754-V770 PolarHBondContact OE1-N 3.41Å; E754-V770 PolarHBondContact OE2-N 3.39Å; V770-Q772 PolarHBondContact O-N 3.09Å; V770-Q772 VanDerWaalsContact O-N 3.07Å; V770-G773 PolarHBondContact O-N 2.83Å; V770-F801 HydrophobicContact CB-CE2 4.32Å; V770-F801 HydrophobicContact CB-CZ 4.33Å; V770-F801 HydrophobicContact CG1-CE2 4.09Å; V770-F801 HydrophobicContact CG1-CZ 3.94Å; V770-F801 HydrophobicContact CG2-CD2 3.75Å; V770-F801 HydrophobicContact CG2-CE2 3.75Å; V770-F801 HydrophobicContact CG2-CG 4.26Å; V770-F801 HydrophobicContact CG2-CZ 4.25Å; V770-V1327 HydrophobicContact CG1-CG1 4.49Å
771	Q	91.6	Very high	93.8	Very high	60 Å²	60	26.6 Å²	26.6	28%	0.28	13%	0.129	S	C	.	.	G	3₁₀ helix	trans	-64.8	-8.4	179	71.8	-166.8	-112.1	0	0	115.4	E754 C755 R768 V769	E754-Q771 WeakPolarHBondContact OE2-CG 3.28Å; E754-Q771 PolarHBondContact OE2-N 2.92Å; E754-Q771 PolarHBondContact OE2-NE2 3.2Å; C755-Q771 PolarHBondContact O-NE2 3.45Å; C755-Q771 PolarHBondContact O-OE1 2.6Å; R768-Q771 HydrophobicContact CB-CG 3.98Å; V769-Q771 PolarHBondContact O-N 2.86Å
772	Q	90.7	Very high	93.7	Very high	48 Å²	48	27.2 Å²	27.2	22%	0.224	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-92	-0.9	179.3	-62.3	-174.8	-3.7	0	0	114.4	N661 R742 R763 R768 V769 V770 W775	N661-Q772 PolarHBondContact ND2-O 2.85Å; R742-Q772 VanDerWaalsContact NH1-NE2 3.2Å; R763-Q772 PolarHBondContact O-NE2 2.86Å; R768-Q772 PolarHBondContact O-NE2 3.11Å; R768-Q772 VanDerWaalsContact O-NE2 3.16Å; V769-Q772 PolarHBondContact O-N 2.87Å; V769-Q772 VanDerWaalsContact O-N 3.15Å; V770-Q772 PolarHBondContact O-N 3.09Å; V770-Q772 VanDerWaalsContact O-N 3.07Å; Q772-W775 PolarHBondContact O-NE1 3.46Å
773	G	91.4	Very high	93.6	Very high	22 Å²	22	25.1 Å²	25.1	23%	0.227	12%	0.121	C	C	.	.			trans	79.6	-170.8	176.4	0	0	0	0	0	114.3	V770 F801	V770-G773 PolarHBondContact O-N 2.83Å; G773-F801 WeakPolarHBondContact O-CE1 3.4Å
774	L	93.9	Very high	93.3	Very high	2 Å²	2	22.6 Å²	22.6	1%	0.01	12%	0.117	C	C	.	.			trans	-68.6	136.9	175.4	177.4	61.4	0	0	0	110.4	E660 N661 V662 I664 V776 L778 I802 C803	E660-L774 HydrophobicContact CB-CB 4.48Å; E660-L774 HydrophobicContact CB-CD2 4.37Å; E660-L774 VanDerWaalsContact CD-CB 3.5Å; E660-L774 HydrophobicContact CG-CB 4.35Å; E660-L774 HydrophobicContact CG-CD2 4.3Å; E660-L774 VanDerWaalsContact OE2-CB 3.27Å; E660-L774 WeakPolarHBondContact OE2-CB 3.47Å; E660-L774 PolarHBondContact OE2-N 3.02Å; N661-L774 VanDerWaalsContact CB-O 3.32Å; N661-L774 WeakPolarHBondContact CB-O 3.43Å; N661-L774 PolarHBondContact ND2-O 3.04Å; V662-L774 HydrophobicContact CG2-CD2 3.89Å; V662-L774 HydrophobicContact CG2-CG 3.64Å; I664-L774 HydrophobicContact CD1-CD2 3.62Å; I664-L774 HydrophobicContact CG1-CD2 3.84Å; L774-V776 HydrophobicContact CD1-CG2 3.79Å; L774-V776 WeakPolarHBondContact CD1-O 3.34Å; L774-L778 HydrophobicContact CD1-CD1 3.76Å; L774-L778 HydrophobicContact CD1-CG 4.23Å; L774-L778 HydrophobicContact CD2-CD1 4.47Å; L774-I802 WeakPolarHBondContact CD1-O 3.28Å; L774-C803 HydrophobicContact CD1-CB 4.22Å
775	W	93.3	Very high	92.9	Very high	43 Å²	43	30.8 Å²	30.8	16%	0.163	15%	0.148	C	C	.	.			trans	-135.2	-20	172.6	-79.4	83.8	0	0	0	113.8	P565 V566 K569 P573 I576 N661 Q772	P565-W775 HydrophobicContact CB-CH2 4.21Å; P565-W775 HydrophobicContact CB-CZ3 4.42Å; P565-W775 WeakPolarHBondContact O-CH2 3.47Å; P565-W775 WeakPolarHBondContact O-CZ3 3.47Å; V566-W775 HydrophobicContact CG2-CH2 4.39Å; K569-W775 HydrophobicContact CG-CH2 4.48Å; P573-W775 VanDerWaalsContact CD-O 3.24Å; P573-W775 WeakPolarHBondContact CD-O 3.29Å; P573-W775 HydrophobicContact CG-CB 3.84Å; P573-W775 WeakPolarHBondContact CG-O 3.44Å; I576-W775 HydrophobicContact CD1-CZ3 4.16Å; N661-W775 HydrophobicContact CB-CD2 4.4Å; N661-W775 PolarHBondContact ND2-NE1 3.17Å; Q772-W775 PolarHBondContact O-NE1 3.46Å
776	V	95	Very high	92.6	Very high	12 Å²	12	38.7 Å²	38.7	7%	0.073	18%	0.183	C	C	.	.	S	Bend	trans	-80.6	136.9	177.6	-69.8	0	0	0	0	110.9	L774 L778 I796 T800 I802	L774-V776 HydrophobicContact CD1-CG2 3.79Å; L774-V776 WeakPolarHBondContact CD1-O 3.34Å; V776-L778 HydrophobicContact CG2-CD1 4.48Å; V776-L778 HydrophobicContact CG2-CD2 4.14Å; V776-L778 HydrophobicContact CG2-CG 4.18Å; V776-L778 PolarHBondContact O-N 3.37Å; V776-L778 VanDerWaalsContact O-N 3.15Å; V776-I796 HydrophobicContact CB-CD1 3.87Å; V776-I796 HydrophobicContact CB-CG1 4.38Å; V776-I796 HydrophobicContact CG1-CD1 4.06Å; V776-I796 HydrophobicContact CG1-CG1 4.18Å; V776-I796 HydrophobicContact CG1-CG2 4.25Å; V776-I796 HydrophobicContact CG2-CD1 4Å; V776-T800 HydrophobicContact CG1-CG2 4.47Å; V776-I802 HydrophobicContact CG2-CD1 4.5Å; V776-I802 HydrophobicContact CG2-CG2 4.3Å
777	K	94.9	Very high	92.4	Very high	41 Å²	41	39.4 Å²	39.4	18%	0.178	19%	0.193	C	C	.	.			trans	-71.4	110	179.7	-61.6	-177.2	73.5	-174.4	0	110.5	N572 E642 L793 N794	N572-K777 HydrophobicContact CB-CD 4.29Å; E642-K777 IonicContact OE2-NZ 3.85Å; E642-K777 PolarHBondContact OE2-NZ 3.26Å; K777-L793 HydrophobicContact CB-CB 4.12Å; K777-L793 HydrophobicContact CB-CD1 4.32Å; K777-L793 PolarHBondContact O-N 3.46Å; K777-N794 WeakPolarHBondContact CD-OD1 3.35Å
778	L	95.4	Very high	92.1	Very high	10 Å²	10	42.9 Å²	42.9	5%	0.052	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	161.3	178.8	-60.7	179.7	0	0	0	110.7	P665 L774 V776 I790 R791 A792 I796 I802 C803	P665-L778 WeakPolarHBondContact CD-O 3.1Å; L774-L778 HydrophobicContact CD1-CD1 3.76Å; L774-L778 HydrophobicContact CD1-CG 4.23Å; L774-L778 HydrophobicContact CD2-CD1 4.47Å; V776-L778 HydrophobicContact CG2-CD1 4.48Å; V776-L778 HydrophobicContact CG2-CD2 4.14Å; V776-L778 HydrophobicContact CG2-CG 4.18Å; V776-L778 PolarHBondContact O-N 3.37Å; V776-L778 VanDerWaalsContact O-N 3.15Å; L778-I790 HydrophobicContact CB-CG2 4.1Å; L778-I790 HydrophobicContact CD1-CG2 4.21Å; L778-I790 HydrophobicContact CD2-CG2 4.39Å; L778-I790 HydrophobicContact CG-CG2 4.46Å; L778-R791 CarbonylContact C-O 3.51Å; L778-R791 WeakPolarHBondContact CA-O 3.35Å; L778-A792 HydrophobicContact CD2-CB 4.31Å; L778-I796 HydrophobicContact CD2-CD1 4.48Å; L778-I802 HydrophobicContact CD1-CG2 3.99Å; L778-I802 HydrophobicContact CD2-CG2 4.31Å; L778-C803 HydrophobicContact CD1-CB 4.49Å
779	Q	94.6	Very high	92	Very high	17 Å²	17	42.7 Å²	42.7	8%	0.079	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	130	174	173	172.6	89.2	0	0	110.1	P665 V667 I790 R791 L793	P665-Q779 HydrophobicContact CG-CB 4.21Å; P665-Q779 HydrophobicContact CG-CG 4.33Å; P665-Q779 CarbonylContact O-C 3.46Å; P665-Q779 WeakPolarHBondContact O-CA 3.15Å; V667-Q779 VanDerWaalsContact CG2-CD 3.47Å; V667-Q779 HydrophobicContact CG2-CG 3.99Å; Q779-I790 WeakPolarHBondContact O-CA 3.21Å; Q779-R791 HydrophobicContact CB-CG 4.24Å; Q779-R791 PolarHBondContact N-O 3.45Å; Q779-R791 PolarHBondContact O-N 3.49Å; Q779-R791 VanDerWaalsContact OE1-CZ 3.3Å; Q779-L793 HydrophobicContact CB-CD1 4.21Å; Q779-L793 HydrophobicContact CB-CD2 3.7Å; Q779-L793 HydrophobicContact CB-CG 3.96Å; Q779-L793 HydrophobicContact CG-CD2 4.44Å
780	V	94.3	Very high	91.9	Very high	21 Å²	21	47.8 Å²	47.8	13%	0.127	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	134	165.9	179.8	0	0	0	0	107.9	I664 P665 C666 V667 W788 G789 I790	I664-V780 HydrophobicContact CG2-CG2 3.94Å; P665-V780 PolarHBondContact O-N 3.35Å; C666-V780 CarbonylContact C-O 3.55Å; C666-V780 VanDerWaalsContact CA-O 3.28Å; C666-V780 WeakPolarHBondContact CA-O 3.2Å; C666-V780 HydrophobicContact CB-CB 3.91Å; C666-V780 HydrophobicContact CB-CG1 4.32Å; C666-V780 VanDerWaalsContact SG-CG1 3.55Å; V667-V780 PolarHBondContact N-O 2.65Å; V780-W788 HydrophobicContact CG1-CB 4.32Å; V780-W788 HydrophobicContact CG1-CE3 3.97Å; V780-G789 CarbonylContact C-O 3.53Å; V780-G789 WeakPolarHBondContact CA-O 3.45Å; V780-I790 HydrophobicContact CG2-CG1 4.36Å
781	F	93.9	Very high	91.8	Very high	32 Å²	32	48.4 Å²	48.4	14%	0.14	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	147.5	179.7	78.5	-71.6	0	0	0	112.8	V667 T783 G789 R791	V667-F781 HydrophobicContact CG2-CB 4.02Å; V667-F781 VanDerWaalsContact O-CA 3.26Å; V667-F781 WeakPolarHBondContact O-CA 3.42Å; F781-T783 HydrophobicContact CE1-CG2 4.48Å; F781-T783 HydrophobicContact CE2-CG2 3.9Å; F781-T783 HydrophobicContact CZ-CG2 3.88Å; F781-T783 PolarHBondContact O-N 2.6Å; F781-G789 WeakPolarHBondContact CD1-O 3.22Å; F781-G789 PolarHBondContact N-O 2.98Å; F781-G789 PolarHBondContact O-N 3.34Å; F781-R791 HydrophobicContact CD1-CB 3.95Å; F781-R791 HydrophobicContact CD1-CG 3.63Å; F781-R791 HydrophobicContact CE1-CB 3.72Å; F781-R791 HydrophobicContact CE1-CG 3.92Å; F781-R791 HydrophobicContact CG-CG 4.25Å
782	K	92.9	Very high	92	Very high	15 Å²	15	47.7 Å²	47.7	7%	0.065	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	120.9	173.2	-171.2	66.3	161.3	176.1	0	110	V667 N668 V670 D671 E673 W788	V667-K782 PolarHBondContact O-N 3.41Å; V667-K782 VanDerWaalsContact O-N 3.1Å; N668-K782 HydrophobicContact CB-CB 4.12Å; N668-K782 VanDerWaalsContact CG-CB 3.43Å; N668-K782 WeakPolarHBondContact OD1-CB 3.43Å; N668-K782 WeakPolarHBondContact OD1-CG 3.01Å; V670-K782 HydrophobicContact CB-CG 4.07Å; V670-K782 HydrophobicContact CG2-CG 4.38Å; V670-K782 WeakPolarHBondContact CG2-O 3.48Å; D671-K782 WeakPolarHBondContact OD1-CE 3.46Å; D671-K782 WeakPolarHBondContact OD2-CE 3.48Å; E673-K782 IonicContact OE1-NZ 3.93Å; E673-K782 PolarHBondContact OE1-NZ 3.04Å; E673-K782 IonicContact OE2-NZ 2.72Å; E673-K782 PolarHBondContact OE2-NZ 2.72Å; K782-W788 HydrophobicContact CB-CE3 4.14Å; K782-W788 HydrophobicContact CB-CH2 4.13Å; K782-W788 HydrophobicContact CB-CZ3 3.84Å; K782-W788 HydrophobicContact CD-CD2 4.19Å; K782-W788 HydrophobicContact CD-CE3 4.46Å; K782-W788 HydrophobicContact CD-CH2 4.36Å; K782-W788 HydrophobicContact CD-CZ2 4.05Å
783	T	89.7	Confident	92.1	Very high	14 Å²	14	46.2 Å²	46.2	9%	0.086	24%	0.235	C	C	.	.			trans	-90.1	155.7	166.9	74.2	0	0	0	0	109.5	E515 F781 R785 K786 G787	E515-T783 WeakPolarHBondContact OE2-CA 3.37Å; E515-T783 WeakPolarHBondContact OE2-CB 3.42Å; F781-T783 HydrophobicContact CE1-CG2 4.48Å; F781-T783 HydrophobicContact CE2-CG2 3.9Å; F781-T783 HydrophobicContact CZ-CG2 3.88Å; F781-T783 PolarHBondContact O-N 2.6Å; T783-R785 VanDerWaalsContact C-N 3.34Å; T783-R785 PolarHBondContact O-N 3.2Å; T783-K786 VanDerWaalsContact OG1-CA 3.26Å; T783-K786 WeakPolarHBondContact OG1-CA 3.29Å; T783-K786 WeakPolarHBondContact OG1-CB 3.35Å; T783-K786 PolarHBondContact OG1-N 3.05Å; T783-G787 WeakPolarHBondContact CA-O 3.43Å; T783-G787 WeakPolarHBondContact CB-O 3.44Å; T783-G787 PolarHBondContact N-O 2.82Å; T783-G787 PolarHBondContact OG1-N 3.24Å; T783-G787 VanDerWaalsContact OG1-N 3.1Å; T783-G787 PolarHBondContact OG1-O 2.87Å
784	A	84.6	Confident	92.2	Very high	29 Å²	29	45.9 Å²	45.9	24%	0.24	23%	0.228	C	C	.	.	S	Bend	trans	-82.8	-10.4	-178.2	0	0	0	0	0	114	L511 E515 V670	L511-A784 HydrophobicContact CB-CB 3.68Å; E515-A784 HydrophobicContact CG-CB 3.86Å; E515-A784 VanDerWaalsContact OE1-CB 3.26Å; E515-A784 WeakPolarHBondContact OE1-CB 3.45Å; E515-A784 PolarHBondContact OE1-N 3.02Å; E515-A784 PolarHBondContact OE2-N 3.11Å; V670-A784 HydrophobicContact CG1-CB 4.03Å; V670-A784 HydrophobicContact CG2-CB 4.49Å
785	R	85.5	Confident	92.1	Very high	214 Å²	214	47.7 Å²	47.7	81%	0.808	24%	0.243	S	C	*	.	S	Bend	trans	-143.2	-7.8	-174.2	-59.2	-170.7	-170.3	179.9	8.1	116.1	T783	T783-R785 VanDerWaalsContact C-N 3.34Å; T783-R785 PolarHBondContact O-N 3.2Å
786	K	88.2	Confident	92.2	Very high	166 Å²	166	48.1 Å²	48.1	72%	0.722	25%	0.248	S	C	*	.	S	Bend	trans	-121.1	12.2	-179.7	-65.1	-168.2	173.4	-166.4	0	113.5	T783	T783-K786 VanDerWaalsContact OG1-CA 3.26Å; T783-K786 WeakPolarHBondContact OG1-CA 3.29Å; T783-K786 WeakPolarHBondContact OG1-CB 3.35Å; T783-K786 PolarHBondContact OG1-N 3.05Å
787	G	89.2	Confident	92.1	Very high	32 Å²	32	48.2 Å²	48.2	33%	0.33	25%	0.249	S	C	.	.	S	Bend	trans	74.8	-136.2	-174.5	0	0	0	0	0	112	T783	T783-G787 WeakPolarHBondContact CA-O 3.43Å; T783-G787 WeakPolarHBondContact CB-O 3.44Å; T783-G787 PolarHBondContact N-O 2.82Å; T783-G787 PolarHBondContact OG1-N 3.24Å; T783-G787 VanDerWaalsContact OG1-N 3.1Å; T783-G787 PolarHBondContact OG1-O 2.87Å
788	W	91.4	Very high	92	Very high	73 Å²	73	53 Å²	53	28%	0.277	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	135.4	175.2	-62.8	93	0	0	0	110.7	C666 N668 E673 P675 V780 K782	C666-W788 VanDerWaalsContact SG-CZ3 3.52Å; N668-W788 HydrophobicContact CB-CH2 4.02Å; N668-W788 HydrophobicContact CB-CZ3 4.43Å; E673-W788 HydrophobicContact CB-CZ2 4.36Å; E673-W788 HydrophobicContact CG-CZ2 4.4Å; E673-W788 WeakPolarHBondContact O-CH2 3.26Å; E673-W788 WeakPolarHBondContact O-CZ2 3.11Å; E673-W788 PolarHBondContact OE1-NE1 2.85Å; P675-W788 HydrophobicContact CG-CD2 4.21Å; P675-W788 HydrophobicContact CG-CE3 4.3Å; P675-W788 HydrophobicContact CG-CH2 3.85Å; P675-W788 HydrophobicContact CG-CZ2 3.75Å; P675-W788 HydrophobicContact CG-CZ3 4.13Å; V780-W788 HydrophobicContact CG1-CB 4.32Å; V780-W788 HydrophobicContact CG1-CE3 3.97Å; K782-W788 HydrophobicContact CB-CE3 4.14Å; K782-W788 HydrophobicContact CB-CH2 4.13Å; K782-W788 HydrophobicContact CB-CZ3 3.84Å; K782-W788 HydrophobicContact CD-CD2 4.19Å; K782-W788 HydrophobicContact CD-CE3 4.46Å; K782-W788 HydrophobicContact CD-CH2 4.36Å; K782-W788 HydrophobicContact CD-CZ2 4.05Å
789	G	91.5	Very high	91.9	Very high	19 Å²	19	53.7 Å²	53.7	20%	0.196	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	173.6	176	0	0	0	0	0	111.8	V780 F781	V780-G789 CarbonylContact C-O 3.53Å; V780-G789 WeakPolarHBondContact CA-O 3.45Å; F781-G789 WeakPolarHBondContact CD1-O 3.22Å; F781-G789 PolarHBondContact N-O 2.98Å; F781-G789 PolarHBondContact O-N 3.34Å
790	I	93.2	Very high	91.9	Very high	112 Å²	112	54.3 Å²	54.3	57%	0.574	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.8	136.6	176.5	-59	176.5	0	0	0	109	L778 Q779 V780	L778-I790 HydrophobicContact CB-CG2 4.1Å; L778-I790 HydrophobicContact CD1-CG2 4.21Å; L778-I790 HydrophobicContact CD2-CG2 4.39Å; L778-I790 HydrophobicContact CG-CG2 4.46Å; Q779-I790 WeakPolarHBondContact O-CA 3.21Å; V780-I790 HydrophobicContact CG2-CG1 4.36Å
791	R	93.3	Very high	92	Very high	35 Å²	35	55.5 Å²	55.5	13%	0.132	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	152.2	171.3	62.1	-175.9	173.2	-154.5	-2.6	111.7	E515 F643 L778 Q779 F781	E515-R791 PolarHBondContact O-NH1 2.81Å; F643-R791 VanDerWaalsContact CE1-CZ 3.43Å; L778-R791 CarbonylContact C-O 3.51Å; L778-R791 WeakPolarHBondContact CA-O 3.35Å; Q779-R791 HydrophobicContact CB-CG 4.24Å; Q779-R791 PolarHBondContact N-O 3.45Å; Q779-R791 PolarHBondContact O-N 3.49Å; Q779-R791 VanDerWaalsContact OE1-CZ 3.3Å; F781-R791 HydrophobicContact CD1-CB 3.95Å; F781-R791 HydrophobicContact CD1-CG 3.63Å; F781-R791 HydrophobicContact CE1-CB 3.72Å; F781-R791 HydrophobicContact CE1-CG 3.92Å; F781-R791 HydrophobicContact CG-CG 4.25Å
792	A	94.8	Very high	92	Very high	44 Å²	44	57.2 Å²	57.2	36%	0.364	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	139.1	170.5	0	0	0	0	0	110.6	L778 I796	L778-A792 HydrophobicContact CD2-CB 4.31Å; A792-I796 HydrophobicContact CB-CD1 3.66Å; A792-I796 HydrophobicContact CB-CG1 4.23Å
793	L	94	Very high	92	Very high	18 Å²	18	59.1 Å²	59.1	9%	0.094	31%	0.312	C	S	.	.	S	Bend	trans	-85.8	-29.9	176.1	-65.4	178.6	0	0	0	112.5	E642 F643 P665 K777 Q779	E642-L793 CarbonylContact C-O 3.42Å; E642-L793 WeakPolarHBondContact CA-O 3.18Å; E642-L793 HydrophobicContact CG-CB 4.4Å; F643-L793 PolarHBondContact N-O 3.04Å; P665-L793 HydrophobicContact CG-CD1 4.22Å; K777-L793 HydrophobicContact CB-CB 4.12Å; K777-L793 HydrophobicContact CB-CD1 4.32Å; K777-L793 PolarHBondContact O-N 3.46Å; Q779-L793 HydrophobicContact CB-CD1 4.21Å; Q779-L793 HydrophobicContact CB-CD2 3.7Å; Q779-L793 HydrophobicContact CB-CG 3.96Å; Q779-L793 HydrophobicContact CG-CD2 4.44Å
794	N	93.3	Very high	92	Very high	15 Å²	15	60.2 Å²	60.2	8%	0.08	32%	0.319	C	S	.	.	S	Bend	trans	-117.9	172.3	175.3	-54.1	103	0	0	0	111.5	Y523 Q641 K777	Y523-N794 PolarHBondContact OH-ND2 3.13Å; Q641-N794 PolarHBondContact O-ND2 2.86Å; K777-N794 WeakPolarHBondContact CD-OD1 3.35Å
795	A	92	Very high	92.2	Very high	40 Å²	40	64.2 Å²	64.2	33%	0.331	33%	0.329	S	S	.	.			trans	-76.9	125.5	174.8	0	0	0	0	0	111.5	L637	L637-A795 HydrophobicContact CD2-CB 4.42Å; L637-A795 HydrophobicContact CG-CB 3.95Å
796	I	94	Very high	92.4	Very high	52 Å²	52	55.6 Å²	55.6	27%	0.267	30%	0.303	S	S	.	.			trans	-105.7	128.4	-176.4	-56.3	176	0	0	0	110.2	V776 L778 A792 T800 I802	V776-I796 HydrophobicContact CB-CD1 3.87Å; V776-I796 HydrophobicContact CB-CG1 4.38Å; V776-I796 HydrophobicContact CG1-CD1 4.06Å; V776-I796 HydrophobicContact CG1-CG1 4.18Å; V776-I796 HydrophobicContact CG1-CG2 4.25Å; V776-I796 HydrophobicContact CG2-CD1 4Å; L778-I796 HydrophobicContact CD2-CD1 4.48Å; A792-I796 HydrophobicContact CB-CD1 3.66Å; A792-I796 HydrophobicContact CB-CG1 4.23Å; I796-T800 HydrophobicContact CG2-CG2 4.29Å; I796-I802 HydrophobicContact CD1-CD1 3.88Å; I796-I802 HydrophobicContact CG2-CD1 3.87Å
797	P	94	Very high	92.5	Very high	14 Å²	14	48.7 Å²	48.7	9%	0.091	28%	0.28	C	S	.	.			trans	-66.4	144	176.6	-15.7	27.4	0	0	0	112.7	L574 L637 G799 T800	L574-P797 HydrophobicContact CD1-CG 3.91Å; L574-P797 HydrophobicContact CD2-CG 4.28Å; L637-P797 HydrophobicContact CD1-CB 4.36Å; L637-P797 HydrophobicContact CD1-CG 3.72Å; P797-G799 PolarHBondContact O-N 3.46Å; P797-T800 VanDerWaalsContact O-CB 3.31Å; P797-T800 WeakPolarHBondContact O-CB 3.2Å; P797-T800 PolarHBondContact O-N 2.91Å; P797-T800 VanDerWaalsContact O-N 3.13Å; P797-T800 PolarHBondContact O-OG1 2.84Å
798	K	92.7	Very high	92.5	Very high	141 Å²	141	49.5 Å²	49.5	61%	0.613	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	131.4	176.4	-179.1	-176.7	174.8	-174.8	0	111.7	T800	K798-T800 VanDerWaalsContact C-N 3.28Å; K798-T800 PolarHBondContact O-N 3.19Å
799	G	93.1	Very high	92.5	Very high	25 Å²	25	47.2 Å²	47.2	26%	0.258	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	2.8	176.9	0	0	0	0	0	115.1	R743 L744 P797	R743-G799 CarbonylContact C-O 3.53Å; R743-G799 WeakPolarHBondContact CA-O 3.3Å; R743-G799 WeakPolarHBondContact CB-O 3.35Å; L744-G799 PolarHBondContact N-O 2.79Å; L744-G799 WeakPolarHBondContact O-CA 3.49Å; P797-G799 PolarHBondContact O-N 3.46Å
800	T	95.2	Very high	92.4	Very high	29 Å²	29	49.8 Å²	49.8	18%	0.178	28%	0.28	C	S	.	.			trans	-67	140.3	168	-48.7	0	0	0	0	109.3	R743 V776 I796 P797 K798	R743-T800 PolarHBondContact NE-OG1 3.45Å; V776-T800 HydrophobicContact CG1-CG2 4.47Å; I796-T800 HydrophobicContact CG2-CG2 4.29Å; P797-T800 VanDerWaalsContact O-CB 3.31Å; P797-T800 WeakPolarHBondContact O-CB 3.2Å; P797-T800 PolarHBondContact O-N 2.91Å; P797-T800 VanDerWaalsContact O-N 3.13Å; P797-T800 PolarHBondContact O-OG1 2.84Å; K798-T800 VanDerWaalsContact C-N 3.28Å; K798-T800 PolarHBondContact O-N 3.19Å
801	F	94.8	Very high	92.2	Very high	46 Å²	46	46.8 Å²	46.8	20%	0.202	27%	0.266	C	S	.	.			trans	-63	140.1	172.8	175.7	-119.3	0	0	0	110.7	V769 V770 G773 C803	V769-F801 HydrophobicContact CG1-CB 3.84Å; V770-F801 HydrophobicContact CB-CE2 4.32Å; V770-F801 HydrophobicContact CB-CZ 4.33Å; V770-F801 HydrophobicContact CG1-CE2 4.09Å; V770-F801 HydrophobicContact CG1-CZ 3.94Å; V770-F801 HydrophobicContact CG2-CD2 3.75Å; V770-F801 HydrophobicContact CG2-CE2 3.75Å; V770-F801 HydrophobicContact CG2-CG 4.26Å; V770-F801 HydrophobicContact CG2-CZ 4.25Å; G773-F801 WeakPolarHBondContact O-CE1 3.4Å; F801-C803 WeakPolarHBondContact CE2-O 3.49Å
802	I	94.5	Very high	91.8	Very high	69 Å²	69	53.2 Å²	53.2	35%	0.354	30%	0.297	S	S	.	.			trans	-101.5	-80.3	-178.8	-52.6	-59.8	0	0	0	109.2	L774 V776 L778 I796	L774-I802 WeakPolarHBondContact CD1-O 3.28Å; V776-I802 HydrophobicContact CG2-CD1 4.5Å; V776-I802 HydrophobicContact CG2-CG2 4.3Å; L778-I802 HydrophobicContact CD1-CG2 3.99Å; L778-I802 HydrophobicContact CD2-CG2 4.31Å; I796-I802 HydrophobicContact CD1-CD1 3.88Å; I796-I802 HydrophobicContact CG2-CD1 3.87Å
803	C	92.1	Very high	91.5	Very high	54 Å²	54	54.7 Å²	54.7	37%	0.365	31%	0.309	S	S	.	.			trans	-149.5	170	179	60.4	0	0	0	0	110.5	L774 L778 F801	L774-C803 HydrophobicContact CD1-CB 4.22Å; L778-C803 HydrophobicContact CD1-CB 4.49Å; F801-C803 WeakPolarHBondContact CE2-O 3.49Å
804	T	90.9	Very high	91.3	Very high	37 Å²	37	57.2 Å²	57.2	23%	0.227	32%	0.321	C	S	.	.			trans	-90.6	136.1	176.1	-64.3	0	0	0	0	110.4	A806	T804-A806 HydrophobicContact CG2-CB 4.3Å; T804-A806 PolarHBondContact O-N 2.76Å
805	Y	89.5	Confident	91.1	Very high	113 Å²	113	57.5 Å²	57.5	44%	0.443	33%	0.326	S	S	.	.			trans	-70.4	108.4	160.2	-157.7	-77.6	0	0	0	108.2	R684 Y826 A828	R684-Y805 PolarHBondContact NH1-O 3.41Å; Y805-Y826 PolarHBondContact OH-O 2.96Å; Y805-A828 HydrophobicContact CD1-CB 4.25Å; Y805-A828 HydrophobicContact CE1-CB 3.73Å; Y805-A828 HydrophobicContact CE2-CB 4.42Å
806	A	89.8	Confident	90.9	Very high	33 Å²	33	60.7 Å²	60.7	27%	0.273	34%	0.341	S	S	.	.			trans	-127.1	160.3	-171.5	0	0	0	0	0	110.8	T681 T804	T681-A806 WeakPolarHBondContact O-CB 3.35Å; T804-A806 HydrophobicContact CG2-CB 4.3Å; T804-A806 PolarHBondContact O-N 2.76Å
807	G	88.7	Confident	90.7	Very high	22 Å²	22	63.1 Å²	63.1	23%	0.227	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	139.9	-162.9	-169.1	0	0	0	0	0	111.8	R684 Q685	R684-G807 CarbonylContact C-O 3.59Å; R684-G807 VanDerWaalsContact CA-O 3.29Å; R684-G807 WeakPolarHBondContact CA-O 3.32Å; Q685-G807 PolarHBondContact N-O 2.87Å
808	A	89.7	Confident	90.4	Very high	49 Å²	49	65.5 Å²	65.5	41%	0.405	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	142.7	173.2	0	0	0	0	0	111.7	Q685 I687 Y810	Q685-A808 CarbonylContact O-C 3.31Å; Q685-A808 WeakPolarHBondContact O-CA 3.32Å; I687-A808 HydrophobicContact CG1-CB 3.69Å; A808-Y810 HydrophobicContact CB-CD2 4.11Å; A808-Y810 HydrophobicContact CB-CE1 4.21Å; A808-Y810 HydrophobicContact CB-CE2 3.47Å; A808-Y810 VanDerWaalsContact CB-CE2 3.47Å
809	I	90.8	Very high	90.1	Very high	25 Å²	25	59.8 Å²	59.8	13%	0.128	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	128.1	158	-54.5	172.4	0	0	0	106.4	R684 Q685 I687 V690 L830	R684-I809 HydrophobicContact CB-CD1 3.86Å; R684-I809 HydrophobicContact CB-CG1 4.02Å; R684-I809 HydrophobicContact CG-CG1 4.46Å; Q685-I809 PolarHBondContact O-N 3.28Å; I687-I809 PolarHBondContact N-O 2.93Å; V690-I809 HydrophobicContact CG1-CG2 3.91Å; V690-I809 HydrophobicContact CG2-CG2 4.22Å; I809-L830 HydrophobicContact CG2-CD1 3.86Å
810	Y	89.5	Confident	89.8	Confident	72 Å²	72	66.9 Å²	66.9	28%	0.282	37%	0.366	S	S	.	.			trans	-110.4	162.9	175.2	-63.3	-72.6	0	0	0	110.3	I687 V690 A808 M814 E818	I687-Y810 HydrophobicContact CB-CD1 3.92Å; I687-Y810 HydrophobicContact CB-CE1 3.83Å; I687-Y810 HydrophobicContact CG1-CE1 4.12Å; I687-Y810 HydrophobicContact CG2-CD1 4.21Å; I687-Y810 HydrophobicContact CG2-CE1 3.86Å; V690-Y810 VanDerWaalsContact CG2-C 3.47Å; A808-Y810 HydrophobicContact CB-CD2 4.11Å; A808-Y810 HydrophobicContact CB-CE1 4.21Å; A808-Y810 HydrophobicContact CB-CE2 3.47Å; A808-Y810 VanDerWaalsContact CB-CE2 3.47Å; Y810-M814 HydrophobicContact CD1-CB 3.75Å; Y810-M814 HydrophobicContact CD1-SD 4.33Å; Y810-M814 HydrophobicContact CG-CB 4.19Å; Y810-E818 HydrophobicContact CD1-CG 4.35Å; Y810-E818 HydrophobicContact CE1-CG 3.73Å; Y810-E818 HydrophobicContact CE2-CG 4.35Å; Y810-E818 PolarHBondContact OH-OE1 2.8Å
811	D	88.7	Confident	89.4	Confident	50 Å²	50	70.1 Å²	70.1	27%	0.267	38%	0.383	S	S	.	.			trans	-81.1	168.3	157.4	59.4	52.3	0	0	0	110.4	A813 M814 A815	D811-A813 PolarHBondContact O-N 2.79Å; D811-A813 PolarHBondContact OD1-N 3.16Å; D811-M814 PolarHBondContact O-N 2.87Å; D811-M814 PolarHBondContact OD1-N 3.27Å; D811-A815 WeakPolarHBondContact O-CB 3.49Å; D811-A815 PolarHBondContact O-N 3.35Å
812	E	86.5	Confident	88.9	Confident	170 Å²	170	73 Å²	73	79%	0.794	41%	0.407	S	S	*	.	H	α-helix	trans	-54.3	-38.9	-176.6	-173.5	-176.6	-174.5	0	0	112.4	V816	E812-V816 WeakPolarHBondContact O-CG2 3.43Å; E812-V816 PolarHBondContact O-N 3.37Å
813	A	88.6	Confident	88.4	Confident	74 Å²	74	71.1 Å²	71.1	61%	0.612	41%	0.405	S	S	*	.	H	α-helix	trans	-71.5	-43.2	-179.2	0	0	0	0	0	112	D811 Q817	D811-A813 PolarHBondContact O-N 2.79Å; D811-A813 PolarHBondContact OD1-N 3.16Å; A813-Q817 PolarHBondContact O-N 3.11Å; A813-Q817 VanDerWaalsContact O-N 3.14Å
814	M	89.3	Confident	88.2	Confident	71 Å²	71	74 Å²	74	35%	0.35	42%	0.417	S	S	.	.	H	α-helix	trans	-67.6	-37.5	174.4	-74.9	-167.8	136.4	0	0	112.6	I687 Y810 D811 V816 Q817 E818	I687-M814 HydrophobicContact CG2-SD 4.41Å; Y810-M814 HydrophobicContact CD1-CB 3.75Å; Y810-M814 HydrophobicContact CD1-SD 4.33Å; Y810-M814 HydrophobicContact CG-CB 4.19Å; D811-M814 PolarHBondContact O-N 2.87Å; D811-M814 PolarHBondContact OD1-N 3.27Å; M814-V816 PolarHBondContact O-N 3.02Å; M814-Q817 PolarHBondContact O-N 3.05Å; M814-E818 WeakPolarHBondContact O-CB 3.18Å; M814-E818 WeakPolarHBondContact O-CG 3.37Å; M814-E818 PolarHBondContact O-N 2.89Å
815	A	88.2	Confident	87.9	Confident	21 Å²	21	79 Å²	79	17%	0.174	44%	0.438	C	S	.	.	H	α-helix	trans	-61.5	-42.6	177.4	0	0	0	0	0	112	D811 G819 Q827	D811-A815 WeakPolarHBondContact O-CB 3.49Å; D811-A815 PolarHBondContact O-N 3.35Å; A815-G819 PolarHBondContact O-N 2.92Å; A815-Q827 PolarHBondContact O-NE2 3.11Å
816	V	88.5	Confident	87.7	Confident	107 Å²	107	83.4 Å²	83.4	65%	0.648	46%	0.455	S	S	*	.	H	α-helix	trans	-66.2	-39.7	174.9	171.1	0	0	0	0	111.9	E812 M814 F820	E812-V816 WeakPolarHBondContact O-CG2 3.43Å; E812-V816 PolarHBondContact O-N 3.37Å; M814-V816 PolarHBondContact O-N 3.02Å; V816-F820 PolarHBondContact O-N 3.47Å; V816-F820 VanDerWaalsContact O-N 3.15Å
817	Q	90.2	Very high	87.5	Confident	103 Å²	103	85.7 Å²	85.7	48%	0.481	46%	0.46	S	S	.	.	H	α-helix	trans	-67.4	-50.2	178.6	-175.4	61.9	46.6	0	0	112	A813 M814 G819 F820 D821	A813-Q817 PolarHBondContact O-N 3.11Å; A813-Q817 VanDerWaalsContact O-N 3.14Å; M814-Q817 PolarHBondContact O-N 3.05Å; Q817-G819 VanDerWaalsContact C-N 3.29Å; Q817-G819 PolarHBondContact O-N 3.48Å; Q817-F820 WeakPolarHBondContact O-CB 3.13Å; Q817-F820 PolarHBondContact O-N 3Å; Q817-D821 VanDerWaalsContact NE2-CG 3.33Å; Q817-D821 PolarHBondContact NE2-OD1 3.5Å; Q817-D821 PolarHBondContact NE2-OD2 2.84Å; Q817-D821 PolarHBondContact O-N 2.83Å
818	E	86.8	Confident	87.4	Confident	64 Å²	64	86.8 Å²	86.8	30%	0.299	47%	0.467	S	S	.	.	H	α-helix	trans	-65.1	-34.1	177.9	-67.1	-83.1	-165	0	0	111.5	Y810 M814 F820 D821 C822 G823	Y810-E818 HydrophobicContact CD1-CG 4.35Å; Y810-E818 HydrophobicContact CE1-CG 3.73Å; Y810-E818 HydrophobicContact CE2-CG 4.35Å; Y810-E818 PolarHBondContact OH-OE1 2.8Å; M814-E818 WeakPolarHBondContact O-CB 3.18Å; M814-E818 WeakPolarHBondContact O-CG 3.37Å; M814-E818 PolarHBondContact O-N 2.89Å; E818-F820 VanDerWaalsContact C-N 3.26Å; E818-F820 PolarHBondContact O-N 3.45Å; E818-D821 PolarHBondContact O-N 3.38Å; E818-C822 WeakPolarHBondContact O-CA 3.41Å; E818-C822 WeakPolarHBondContact O-CB 3.1Å; E818-C822 PolarHBondContact O-N 2.85Å; E818-G823 PolarHBondContact O-N 2.87Å
819	G	87.4	Confident	87.1	Confident	22 Å²	22	92.4 Å²	92.4	23%	0.227	49%	0.485	C	S	.	.	H	α-helix	trans	-63.4	-29.6	172.2	0	0	0	0	0	113.5	A815 Q817 G823 Q827	A815-G819 PolarHBondContact O-N 2.92Å; Q817-G819 VanDerWaalsContact C-N 3.29Å; Q817-G819 PolarHBondContact O-N 3.48Å; G819-G823 WeakPolarHBondContact O-CA 3.5Å; G819-G823 PolarHBondContact O-N 2.81Å; G819-Q827 VanDerWaalsContact CA-NE2 3.32Å
820	F	86.7	Confident	86.5	Confident	173 Å²	173	94 Å²	94	76%	0.759	49%	0.493	S	S	*	.	H	α-helix	trans	-81.7	-40.8	174.1	-177.3	-90.6	0	0	0	112.7	V816 Q817 E818	V816-F820 PolarHBondContact O-N 3.47Å; V816-F820 VanDerWaalsContact O-N 3.15Å; Q817-F820 WeakPolarHBondContact O-CB 3.13Å; Q817-F820 PolarHBondContact O-N 3Å; E818-F820 VanDerWaalsContact C-N 3.26Å; E818-F820 PolarHBondContact O-N 3.45Å
821	D	87.1	Confident	85.7	Confident	97 Å²	97	94.8 Å²	94.8	52%	0.519	50%	0.502	S	S	.	.	H	α-helix	trans	-80.9	-34.3	-175.3	-71.8	-28.6	0	0	0	113.4	Q817 E818	Q817-D821 VanDerWaalsContact NE2-CG 3.33Å; Q817-D821 PolarHBondContact NE2-OD1 3.5Å; Q817-D821 PolarHBondContact NE2-OD2 2.84Å; Q817-D821 PolarHBondContact O-N 2.83Å; E818-D821 PolarHBondContact O-N 3.38Å
822	C	84	Confident	84.5	Confident	106 Å²	106	97.2 Å²	97.2	72%	0.716	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.2	-16.7	-170.4	-74	0	0	0	0	114.9	E818	E818-C822 WeakPolarHBondContact O-CA 3.41Å; E818-C822 WeakPolarHBondContact O-CB 3.1Å; E818-C822 PolarHBondContact O-N 2.85Å
823	G	84.3	Confident	83.3	Confident	30 Å²	30	92.7 Å²	92.7	31%	0.309	49%	0.489	S	S	.	.			trans	106.9	155.5	-178.7	0	0	0	0	0	113.8	E818 G819 E825	E818-G823 PolarHBondContact O-N 2.87Å; G819-G823 WeakPolarHBondContact O-CA 3.5Å; G819-G823 PolarHBondContact O-N 2.81Å; G823-E825 WeakPolarHBondContact CA-OE2 3.49Å
824	D	86.7	Confident	82	Confident	114 Å²	114	94 Å²	94	61%	0.61	48%	0.483	S	S	*	.	S	Bend	trans	-102.1	0	-176.2	72.5	-14.9	0	0	0	114	Y826 Q827	D824-Y826 PolarHBondContact O-N 3.11Å; D824-Q827 HydrophobicContact CB-CG 4.49Å; D824-Q827 PolarHBondContact O-N 2.72Å
825	E	84.4	Confident	80.6	Confident	144 Å²	144	94.4 Å²	94.4	67%	0.673	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-18.5	-169.6	-58.5	98.3	141.8	0	0	114.4	G823	G823-E825 WeakPolarHBondContact CA-OE2 3.49Å
826	Y	84.7	Confident	79.1	Confident	205 Å²	205	95.1 Å²	95.1	80%	0.804	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.5	21	178.3	-55	-84.4	0	0	0	112.9	Y805 D824	Y805-Y826 PolarHBondContact OH-O 2.96Å; D824-Y826 PolarHBondContact O-N 3.11Å
827	Q	87.6	Confident	77.5	Confident	80 Å²	80	94.5 Å²	94.5	37%	0.374	48%	0.481	S	S	.	.			trans	-90.1	150.4	171.8	-62.9	-164.7	19.9	0	0	112.1	A815 G819 D824	A815-Q827 PolarHBondContact O-NE2 3.11Å; G819-Q827 VanDerWaalsContact CA-NE2 3.32Å; D824-Q827 HydrophobicContact CB-CG 4.49Å; D824-Q827 PolarHBondContact O-N 2.72Å
828	A	84.7	Confident	75.9	Confident	46 Å²	46	94.6 Å²	94.6	38%	0.38	48%	0.48	S	S	.	.			trans	-142.9	110.8	176.1	0	0	0	0	0	110.4	Y805 L830	Y805-A828 HydrophobicContact CD1-CB 4.25Å; Y805-A828 HydrophobicContact CE1-CB 3.73Å; Y805-A828 HydrophobicContact CE2-CB 4.42Å; A828-L830 PolarHBondContact O-N 3.36Å
829	E	83.5	Confident	74.4	Confident	166 Å²	166	98.5 Å²	98.5	78%	0.776	50%	0.503	S	S	*	.			trans	-54.3	132.9	175.4	-63.8	161.4	-164.6	0	0	110.9	P1326	E829-P1326 WeakPolarHBondContact O-CG 3.39Å
830	L	79.3	Confident	72.8	Confident	59 Å²	59	100.7 Å²	100.7	31%	0.309	51%	0.506	S	S	.	.			trans	-96.5	-7.4	-179.3	-57.7	-173.5	0	0	0	112.7	I809 A828 Y832 P1326 V1328	I809-L830 HydrophobicContact CG2-CD1 3.86Å; A828-L830 PolarHBondContact O-N 3.36Å; L830-Y832 PolarHBondContact O-N 2.86Å; L830-Y832 VanDerWaalsContact O-N 3.1Å; L830-P1326 HydrophobicContact CD2-CB 3.59Å; L830-V1328 HydrophobicContact CB-CG2 4.24Å
831	D	71.9	Confident	71.1	Confident	88 Å²	88	100.3 Å²	100.3	47%	0.471	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	11.7	-162.1	-56.1	26.2	0	0	0	113.6	I833 E834 T835	D831-I833 VanDerWaalsContact C-N 3.32Å; D831-I833 PolarHBondContact O-N 2.77Å; D831-E834 CarbonylContact O-C 3.51Å; D831-E834 PolarHBondContact O-N 3.5Å; D831-T835 WeakPolarHBondContact O-CB 3.32Å; D831-T835 PolarHBondContact O-N 3.39Å; D831-T835 PolarHBondContact O-OG1 3.25Å
832	Y	63.5	Low	69.5	Low	102 Å²	102	97.2 Å²	97.2	40%	0.4	50%	0.498	S	S	.	.	H	α-helix	trans	-63	-38.4	-176.3	-175.1	-112.3	0	0	0	112.4	F747 V749 L830 T835 V836	F747-Y832 HydrophobicContact CE1-CE1 4.4Å; F747-Y832 AromaticContact CZ-CE1 3.85Å; F747-Y832 HydrophobicContact CZ-CE1 3.85Å; V749-Y832 HydrophobicContact CG1-CE1 3.77Å; L830-Y832 PolarHBondContact O-N 2.86Å; L830-Y832 VanDerWaalsContact O-N 3.1Å; Y832-T835 PolarHBondContact O-N 3.09Å; Y832-V836 HydrophobicContact CE1-CG2 4.46Å; Y832-V836 HydrophobicContact CE2-CG2 4.43Å; Y832-V836 WeakPolarHBondContact O-CG2 3.04Å; Y832-V836 PolarHBondContact O-N 2.59Å; Y832-V836 VanDerWaalsContact O-N 3.14Å
833	I	62.4	Low	67.8	Low	74 Å²	74	101.4 Å²	101.4	38%	0.379	50%	0.5	S	S	.	.	H	α-helix	trans	-64.6	-53.1	173.2	-62.5	176.6	0	0	0	109	D831 T835 V836 E837	D831-I833 VanDerWaalsContact C-N 3.32Å; D831-I833 PolarHBondContact O-N 2.77Å; I833-T835 PolarHBondContact O-N 3.29Å; I833-T835 VanDerWaalsContact O-N 3.17Å; I833-V836 CarbonylContact O-C 3.58Å; I833-V836 WeakPolarHBondContact O-CA 3.47Å; I833-V836 PolarHBondContact O-N 2.92Å; I833-E837 HydrophobicContact CG2-CG 4.13Å; I833-E837 VanDerWaalsContact O-CG 3.31Å; I833-E837 WeakPolarHBondContact O-CG 3.46Å; I833-E837 PolarHBondContact O-N 2.85Å
834	E	60.7	Low	66.1	Low	102 Å²	102	107.8 Å²	107.8	48%	0.477	52%	0.522	S	S	.	.	H	α-helix	trans	-56.2	-35	177.7	-71.6	-160.7	-168.2	0	0	113.2	D831 E837 K838	D831-E834 CarbonylContact O-C 3.51Å; D831-E834 PolarHBondContact O-N 3.5Å; E834-E837 CarbonylContact O-C 3.6Å; E834-E837 PolarHBondContact O-N 2.58Å; E834-K838 HydrophobicContact CB-CD 4.39Å; E834-K838 VanDerWaalsContact O-CB 3.24Å; E834-K838 WeakPolarHBondContact O-CB 3.42Å; E834-K838 WeakPolarHBondContact O-CD 3.43Å; E834-K838 WeakPolarHBondContact O-CG 3.12Å; E834-K838 PolarHBondContact O-N 2.85Å; E834-K838 WeakPolarHBondContact OE2-CE 3.32Å; E834-K838 IonicContact OE2-NZ 2.8Å; E834-K838 PolarHBondContact OE2-NZ 3.32Å
835	T	59.6	Low	64.4	Low	80 Å²	80	107.3 Å²	107.3	49%	0.491	53%	0.527	S	S	.	.	H	α-helix	trans	-65.7	-44.5	176.5	-56.3	0	0	0	0	111.1	D831 Y832 I833 E837 K838 D839	D831-T835 WeakPolarHBondContact O-CB 3.32Å; D831-T835 PolarHBondContact O-N 3.39Å; D831-T835 PolarHBondContact O-OG1 3.25Å; Y832-T835 PolarHBondContact O-N 3.09Å; I833-T835 PolarHBondContact O-N 3.29Å; I833-T835 VanDerWaalsContact O-N 3.17Å; T835-E837 VanDerWaalsContact C-N 3.25Å; T835-E837 PolarHBondContact O-N 3.37Å; T835-K838 PolarHBondContact O-N 3.14Å; T835-D839 PolarHBondContact O-N 2.73Å; T835-D839 VanDerWaalsContact O-N 3.15Å
836	V	57	Low	62.4	Low	35 Å²	35	105.5 Å²	105.5	21%	0.212	53%	0.526	C	S	.	.	H	α-helix	trans	-69.5	-21.9	175.2	173.7	0	0	0	0	112.2	T727 V749 Y832 I833	T727-V836 HydrophobicContact CG2-CG1 4.27Å; V749-V836 HydrophobicContact CG1-CG1 4.48Å; V749-V836 HydrophobicContact CG1-CG2 4.13Å; Y832-V836 HydrophobicContact CE1-CG2 4.46Å; Y832-V836 HydrophobicContact CE2-CG2 4.43Å; Y832-V836 WeakPolarHBondContact O-CG2 3.04Å; Y832-V836 PolarHBondContact O-N 2.59Å; Y832-V836 VanDerWaalsContact O-N 3.14Å; I833-V836 CarbonylContact O-C 3.58Å; I833-V836 WeakPolarHBondContact O-CA 3.47Å; I833-V836 PolarHBondContact O-N 2.92Å
837	E	55.9	Low	60.7	Low	94 Å²	94	100.2 Å²	100.2	44%	0.439	52%	0.515	S	S	.	.	H	α-helix	trans	-89.5	-33.1	174.4	-59.2	-146.6	108.6	0	0	113.6	I833 E834 T835 D839 K840	I833-E837 HydrophobicContact CG2-CG 4.13Å; I833-E837 VanDerWaalsContact O-CG 3.31Å; I833-E837 WeakPolarHBondContact O-CG 3.46Å; I833-E837 PolarHBondContact O-N 2.85Å; E834-E837 CarbonylContact O-C 3.6Å; E834-E837 PolarHBondContact O-N 2.58Å; T835-E837 VanDerWaalsContact C-N 3.25Å; T835-E837 PolarHBondContact O-N 3.37Å; E837-D839 VanDerWaalsContact C-N 3.28Å; E837-D839 PolarHBondContact O-N 2.92Å; E837-K840 HydrophobicContact CB-CD 4.37Å; E837-K840 WeakPolarHBondContact O-CA 3.47Å; E837-K840 WeakPolarHBondContact O-CB 3.34Å; E837-K840 WeakPolarHBondContact O-CG 3.49Å; E837-K840 PolarHBondContact O-N 3.32Å; E837-K840 IonicContact OE1-NZ 2.63Å; E837-K840 PolarHBondContact OE1-NZ 3.22Å
838	K	56.8	Low	58.7	Low	105 Å²	105	103.1 Å²	103.1	46%	0.457	53%	0.529	S	S	.	.	H	α-helix	trans	-66.7	-29.1	171.6	-74.7	159.7	179.4	162.8	0	111.7	E834 T835 K840 E841	E834-K838 HydrophobicContact CB-CD 4.39Å; E834-K838 VanDerWaalsContact O-CB 3.24Å; E834-K838 WeakPolarHBondContact O-CB 3.42Å; E834-K838 WeakPolarHBondContact O-CD 3.43Å; E834-K838 WeakPolarHBondContact O-CG 3.12Å; E834-K838 PolarHBondContact O-N 2.85Å; E834-K838 WeakPolarHBondContact OE2-CE 3.32Å; E834-K838 IonicContact OE2-NZ 2.8Å; E834-K838 PolarHBondContact OE2-NZ 3.32Å; T835-K838 PolarHBondContact O-N 3.14Å; K838-K840 PolarHBondContact O-N 3.21Å; K838-K840 VanDerWaalsContact O-N 3.11Å; K838-E841 WeakPolarHBondContact O-CB 3.47Å; K838-E841 PolarHBondContact O-N 3.15Å
839	D	54.3	Low	56.9	Low	146 Å²	146	104.7 Å²	104.7	78%	0.781	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-12.5	165.9	-95.1	-9.4	0	0	0	113.4	T835 E837	T835-D839 PolarHBondContact O-N 2.73Å; T835-D839 VanDerWaalsContact O-N 3.15Å; E837-D839 VanDerWaalsContact C-N 3.28Å; E837-D839 PolarHBondContact O-N 2.92Å
840	K	53.8	Low	55.2	Low	69 Å²	69	102 Å²	102	30%	0.3	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-20.1	170.9	-44.7	167.9	-173.8	176.4	0	113.1	E837 K838 G842 Y843	E837-K840 HydrophobicContact CB-CD 4.37Å; E837-K840 WeakPolarHBondContact O-CA 3.47Å; E837-K840 WeakPolarHBondContact O-CB 3.34Å; E837-K840 WeakPolarHBondContact O-CG 3.49Å; E837-K840 PolarHBondContact O-N 3.32Å; E837-K840 IonicContact OE1-NZ 2.63Å; E837-K840 PolarHBondContact OE1-NZ 3.22Å; K838-K840 PolarHBondContact O-N 3.21Å; K838-K840 VanDerWaalsContact O-N 3.11Å; K840-G842 VanDerWaalsContact C-N 3.28Å; K840-G842 PolarHBondContact O-N 3.38Å; K840-Y843 WeakPolarHBondContact O-CB 3.49Å; K840-Y843 PolarHBondContact O-N 3.43Å
841	E	51.4	Low	53.9	Low	164 Å²	164	104.2 Å²	104.2	77%	0.766	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	79.9	-178.1	-70.5	-163.2	125.4	0	0	111.4	K838	K838-E841 WeakPolarHBondContact O-CB 3.47Å; K838-E841 PolarHBondContact O-N 3.15Å
842	G	52.1	Low	52.9	Low	33 Å²	33	106.4 Å²	106.4	34%	0.34	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	150.6	-22.9	-172.6	0	0	0	0	0	112.5	K840 S845 T846	K840-G842 VanDerWaalsContact C-N 3.28Å; K840-G842 PolarHBondContact O-N 3.38Å; G842-S845 WeakPolarHBondContact CA-OG 3.47Å; G842-S845 PolarHBondContact O-OG 2.88Å; G842-T846 PolarHBondContact O-OG1 3.42Å
843	Y	50	Low	52.3	Low	194 Å²	194	104.4 Å²	104.4	76%	0.761	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-45.9	172.8	-157.1	-100.5	0	0	0	110.5	K840 S845 T846	K840-Y843 WeakPolarHBondContact O-CB 3.49Å; K840-Y843 PolarHBondContact O-N 3.43Å; Y843-S845 PolarHBondContact O-N 3.49Å; Y843-T846 PolarHBondContact O-N 3.1Å
844	E	48	Very low	51.8	Low	164 Å²	164	106.1 Å²	106.1	77%	0.766	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-69.6	-28.6	177	-62.1	-160.3	161.6	0	0	113.5	T846 V847	E844-T846 PolarHBondContact O-N 2.86Å; E844-T846 VanDerWaalsContact O-N 3.1Å; E844-V847 PolarHBondContact O-N 3.49Å
845	S	51.1	Low	51.1	Low	103 Å²	103	106 Å²	106	72%	0.72	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-71.5	-1	175.2	65.8	0	0	0	0	114.1	G842 Y843	G842-S845 WeakPolarHBondContact CA-OG 3.47Å; G842-S845 PolarHBondContact O-OG 2.88Å; Y843-S845 PolarHBondContact O-N 3.49Å
846	T	42.8	Very low	50.4	Low	106 Å²	106	109.5 Å²	109.5	65%	0.65	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-120.9	16	177.9	-32.1	0	0	0	0	112.1	G842 Y843 E844 E848	G842-T846 PolarHBondContact O-OG1 3.42Å; Y843-T846 PolarHBondContact O-N 3.1Å; E844-T846 PolarHBondContact O-N 2.86Å; E844-T846 VanDerWaalsContact O-N 3.1Å; T846-E848 VanDerWaalsContact C-N 3.33Å; T846-E848 PolarHBondContact O-N 2.87Å; T846-E848 VanDerWaalsContact O-N 3.07Å
847	V	48.6	Very low	50	Low	94 Å²	94	111.6 Å²	111.6	57%	0.57	57%	0.572	S	S	*	*			trans	-77.6	89.5	165.6	-178.1	0	0	0	0	108	E844 D849	E844-V847 PolarHBondContact O-N 3.49Å; V847-D849 PolarHBondContact O-N 3.46Å
848	E	44.4	Very low	49.5	Very low	142 Å²	142	111.5 Å²	111.5	66%	0.664	58%	0.578	S	S	*	*			trans	-46.4	128.4	157.1	-70.4	172.7	170.6	0	0	108.2	T846 L850 I853	T846-E848 VanDerWaalsContact C-N 3.33Å; T846-E848 PolarHBondContact O-N 2.87Å; T846-E848 VanDerWaalsContact O-N 3.07Å; E848-L850 PolarHBondContact O-N 2.89Å; E848-I853 HydrophobicContact CB-CD1 3.74Å; E848-I853 HydrophobicContact CB-CG1 4.25Å
849	D	47	Very low	49.1	Very low	79 Å²	79	111.3 Å²	111.3	42%	0.422	59%	0.586	S	S	.	*			trans	-58.6	117.4	-172.3	-171.2	-25.3	0	0	0	108.9	V847 N851 E852 I853	V847-D849 PolarHBondContact O-N 3.46Å; D849-N851 PolarHBondContact O-N 3.24Å; D849-N851 VanDerWaalsContact OD1-CB 3.3Å; D849-N851 WeakPolarHBondContact OD1-CB 3.4Å; D849-N851 PolarHBondContact OD1-N 2.88Å; D849-N851 PolarHBondContact OD1-ND2 2.89Å; D849-E852 HydrophobicContact CB-CB 4.26Å; D849-E852 HydrophobicContact CB-CG 4.17Å; D849-E852 WeakPolarHBondContact O-CA 3.33Å; D849-E852 WeakPolarHBondContact O-CB 3.27Å; D849-E852 PolarHBondContact O-N 3.4Å; D849-I853 PolarHBondContact O-N 3.1Å
850	L	49	Very low	48.5	Very low	110 Å²	110	108.3 Å²	108.3	58%	0.576	58%	0.581	S	S	*	*	H	α-helix	trans	-61.4	-20.1	-177.3	-80	166	0	0	0	111.8	E848 I853 L854	E848-L850 PolarHBondContact O-N 2.89Å; L850-I853 HydrophobicContact CD2-CD1 4.18Å; L850-L854 WeakPolarHBondContact O-CB 3.43Å; L850-L854 VanDerWaalsContact O-CD1 3.26Å; L850-L854 WeakPolarHBondContact O-CD1 3.4Å; L850-L854 PolarHBondContact O-N 2.82Å
851	N	51.6	Low	48	Very low	104 Å²	104	111.9 Å²	111.9	56%	0.556	60%	0.603	S	S	*	*	H	α-helix	trans	-73.4	-37.8	169.8	-56.5	-75.3	0	0	0	112.1	D849 L854 N855	D849-N851 PolarHBondContact O-N 3.24Å; D849-N851 VanDerWaalsContact OD1-CB 3.3Å; D849-N851 WeakPolarHBondContact OD1-CB 3.4Å; D849-N851 PolarHBondContact OD1-N 2.88Å; D849-N851 PolarHBondContact OD1-ND2 2.89Å; N851-L854 PolarHBondContact O-N 2.72Å; N851-N855 VanDerWaalsContact O-CB 3.25Å; N851-N855 WeakPolarHBondContact O-CB 3.5Å; N851-N855 PolarHBondContact O-N 3.32Å; N851-N855 PolarHBondContact O-ND2 3.07Å
852	E	50.9	Low	47.3	Very low	134 Å²	134	108.5 Å²	108.5	63%	0.626	60%	0.597	S	S	*	*	H	α-helix	trans	-67.4	-41.8	171.2	-69.1	-165.5	134.4	0	0	111	D849 L854 N855 E856	D849-E852 HydrophobicContact CB-CB 4.26Å; D849-E852 HydrophobicContact CB-CG 4.17Å; D849-E852 WeakPolarHBondContact O-CA 3.33Å; D849-E852 WeakPolarHBondContact O-CB 3.27Å; D849-E852 PolarHBondContact O-N 3.4Å; E852-L854 PolarHBondContact O-N 3.22Å; E852-N855 PolarHBondContact O-N 2.98Å; E852-N855 VanDerWaalsContact O-N 3.17Å; E852-E856 PolarHBondContact O-N 2.81Å
853	I	51.9	Low	46.6	Very low	61 Å²	61	113.4 Å²	113.4	31%	0.313	62%	0.616	S	S	.	*	H	α-helix	trans	-61.1	-42.6	173.7	-64.2	173.5	0	0	0	111.4	E848 D849 L850 T857	E848-I853 HydrophobicContact CB-CD1 3.74Å; E848-I853 HydrophobicContact CB-CG1 4.25Å; D849-I853 PolarHBondContact O-N 3.1Å; L850-I853 HydrophobicContact CD2-CD1 4.18Å; I853-T857 WeakPolarHBondContact O-CB 3.2Å; I853-T857 PolarHBondContact O-N 3.08Å; I853-T857 PolarHBondContact O-OG1 3.5Å
854	L	50.4	Low	45.8	Very low	110 Å²	110	110.9 Å²	110.9	58%	0.576	62%	0.62	S	S	*	*	H	α-helix	trans	-65.7	-37.7	175	-100.9	71.1	0	0	0	112.2	L850 N851 E852 T858	L850-L854 WeakPolarHBondContact O-CB 3.43Å; L850-L854 VanDerWaalsContact O-CD1 3.26Å; L850-L854 WeakPolarHBondContact O-CD1 3.4Å; L850-L854 PolarHBondContact O-N 2.82Å; N851-L854 PolarHBondContact O-N 2.72Å; E852-L854 PolarHBondContact O-N 3.22Å; L854-T858 WeakPolarHBondContact O-CB 3.34Å; L854-T858 WeakPolarHBondContact O-CG2 3.43Å; L854-T858 PolarHBondContact O-N 2.92Å; L854-T858 PolarHBondContact O-OG1 3.38Å
855	N	45.8	Very low	45	Very low	100 Å²	100	113 Å²	113	54%	0.535	63%	0.627	S	S	.	*	H	α-helix	trans	-71.4	-44.1	178.8	-73.1	-28.8	0	0	0	111.9	N851 E852 T858 V859	N851-N855 VanDerWaalsContact O-CB 3.25Å; N851-N855 WeakPolarHBondContact O-CB 3.5Å; N851-N855 PolarHBondContact O-N 3.32Å; N851-N855 PolarHBondContact O-ND2 3.07Å; E852-N855 PolarHBondContact O-N 2.98Å; E852-N855 VanDerWaalsContact O-N 3.17Å; N855-T858 WeakPolarHBondContact CA-OG1 3.26Å; N855-T858 PolarHBondContact O-N 3.38Å; N855-T858 PolarHBondContact O-OG1 3.12Å; N855-V859 WeakPolarHBondContact O-CB 3.4Å; N855-V859 VanDerWaalsContact O-CG2 3.31Å; N855-V859 WeakPolarHBondContact O-CG2 3.28Å; N855-V859 PolarHBondContact O-N 2.89Å
856	E	46.8	Very low	44.2	Very low	152 Å²	152	117.1 Å²	117.1	71%	0.71	63%	0.632	S	S	*	*	H	α-helix	trans	-66.5	-38.6	174.1	-68.8	-151.2	139.9	0	0	111.8	E852 T858 V859 A860	E852-E856 PolarHBondContact O-N 2.81Å; E856-T858 VanDerWaalsContact C-N 3.29Å; E856-T858 PolarHBondContact O-N 2.96Å; E856-V859 PolarHBondContact O-N 3.44Å; E856-A860 VanDerWaalsContact O-CB 3.23Å; E856-A860 WeakPolarHBondContact O-CB 3.37Å; E856-A860 PolarHBondContact O-N 3.37Å
857	T	47.9	Very low	43.8	Very low	80 Å²	80	121 Å²	121	49%	0.491	64%	0.641	S	S	.	*	H	α-helix	trans	-64.9	-32.1	175.6	-57.9	0	0	0	0	112.2	I853 L861	I853-T857 WeakPolarHBondContact O-CB 3.2Å; I853-T857 PolarHBondContact O-N 3.08Å; I853-T857 PolarHBondContact O-OG1 3.5Å; T857-L861 WeakPolarHBondContact O-CD1 3.35Å; T857-L861 WeakPolarHBondContact O-CG 3.43Å
858	T	46	Very low	42.9	Very low	92 Å²	92	120.7 Å²	120.7	56%	0.564	64%	0.642	S	S	*	*	H	α-helix	trans	-81.8	-32.3	175.6	47.7	0	0	0	0	113.1	L854 N855 E856	L854-T858 WeakPolarHBondContact O-CB 3.34Å; L854-T858 WeakPolarHBondContact O-CG2 3.43Å; L854-T858 PolarHBondContact O-N 2.92Å; L854-T858 PolarHBondContact O-OG1 3.38Å; N855-T858 WeakPolarHBondContact CA-OG1 3.26Å; N855-T858 PolarHBondContact O-N 3.38Å; N855-T858 PolarHBondContact O-OG1 3.12Å; E856-T858 VanDerWaalsContact C-N 3.29Å; E856-T858 PolarHBondContact O-N 2.96Å
859	V	47.2	Very low	42.4	Very low	101 Å²	101	120.1 Å²	120.1	61%	0.612	64%	0.644	S	S	*	*	H	α-helix	trans	-69.5	-42.7	172.4	171	0	0	0	0	111.5	N855 E856 L861 S862	N855-V859 WeakPolarHBondContact O-CB 3.4Å; N855-V859 VanDerWaalsContact O-CG2 3.31Å; N855-V859 WeakPolarHBondContact O-CG2 3.28Å; N855-V859 PolarHBondContact O-N 2.89Å; E856-V859 PolarHBondContact O-N 3.44Å; V859-L861 PolarHBondContact O-N 2.65Å; V859-L861 VanDerWaalsContact O-N 3.11Å; V859-S862 WeakPolarHBondContact O-CB 3.33Å; V859-S862 PolarHBondContact O-N 2.71Å; V859-S862 PolarHBondContact O-OG 3.23Å
860	A	42.8	Very low	41.9	Very low	83 Å²	83	125.1 Å²	125.1	69%	0.686	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	-13.1	179.1	0	0	0	0	0	114.4	E856	E856-A860 VanDerWaalsContact O-CB 3.23Å; E856-A860 WeakPolarHBondContact O-CB 3.37Å; E856-A860 PolarHBondContact O-N 3.37Å
861	L	43.2	Very low	40.9	Very low	143 Å²	143	126.2 Å²	126.2	75%	0.749	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	3.8	174.5	-74.4	171.3	0	0	0	113.9	T857 V859	T857-L861 WeakPolarHBondContact O-CD1 3.35Å; T857-L861 WeakPolarHBondContact O-CG 3.43Å; V859-L861 PolarHBondContact O-N 2.65Å; V859-L861 VanDerWaalsContact O-N 3.11Å
862	S	36.1	Very low	40.1	Very low	93 Å²	93	130.7 Å²	130.7	65%	0.65	69%	0.686	S	S	*	*	S	Bend	trans	-81.7	-22	180	66.6	0	0	0	0	114.2	V859	V859-S862 WeakPolarHBondContact O-CB 3.33Å; V859-S862 PolarHBondContact O-N 2.71Å; V859-S862 PolarHBondContact O-OG 3.23Å
863	D	36.8	Very low	39	Very low	137 Å²	137	129.6 Å²	129.6	73%	0.733	69%	0.688	S	S	*	*	S	Bend	trans	-84.2	144.9	180	-109.1	-40.4	0	0	0	113.3
864	T	34.1	Very low	38.3	Very low	140 Å²	140	131.7 Å²	131.7	86%	0.859	71%	0.708	S	S	*	*			trans	72.5	50	177	70.1	0	0	0	0	118.8
865	K	31.7	Very low	37.3	Very low	208 Å²	208	133.9 Å²	133.9	90%	0.904	72%	0.715	S	S	*	*			trans	-109.2	105.8	147.5	-84.1	-173.4	179.4	172.4	0	112.4
866	K	32.6	Very low	36.6	Very low	190 Å²	190	135.5 Å²	135.5	83%	0.826	72%	0.722	S	S	*	*			trans	-145	148.4	160	-105.5	-179.8	178	175.4	0	108.7
867	F	34.1	Very low	35.8	Very low	189 Å²	189	132.9 Å²	132.9	83%	0.829	72%	0.721	S	S	*	*			trans	65.5	101.4	-163.2	-54.1	-76.4	0	0	0	111.5
868	S	31.7	Very low	35	Very low	86 Å²	86	133.4 Å²	133.4	60%	0.601	73%	0.733	S	S	*	*			cis	69.1	143.2	36.1	103.8	0	0	0	0	112.1
869	D	32.4	Very low	34.2	Very low	130 Å²	130	134.4 Å²	134.4	70%	0.695	74%	0.739	S	S	*	*			cis	-141.3	-167.1	12.6	-99.2	-57.5	0	0	0	112.5
870	E	36.1	Very low	33.3	Very low	184 Å²	184	134.7 Å²	134.7	86%	0.86	74%	0.741	S	S	*	*			trans	75	91.7	166	-50.2	-160.9	148.7	0	0	115.7
871	N	29.6	Very low	32.7	Very low	134 Å²	134	135.4 Å²	135.4	72%	0.717	73%	0.733	S	S	*	*				57.4	94.4	57	-63.8	-34	0	0	0	115.9
872	K	34.7	Very low	32	Very low	198 Å²	198	136.6 Å²	136.6	86%	0.861	74%	0.735	S	S	*	*				-170.3	110.2	118.8	-95.8	145.7	-173.7	172.2	0	108.7
873	T	28	Very low	31.7	Very low	111 Å²	111	138.8 Å²	138.8	68%	0.681	74%	0.735	S	S	*	*				68.7	78.9	63.7	72.3	0	0	0	0	114.6
874	S	35.7	Very low	31.2	Very low	104 Å²	104	137.8 Å²	137.8	73%	0.727	73%	0.734	S	S	*	*			trans	-132.4	112.9	137.2	53.2	0	0	0	0	105.5
875	H	31.2	Very low	30.8	Very low	157 Å²	157	137.9 Å²	137.9	73%	0.727	73%	0.728	S	S	*	*				65.3	133.1	82.9	-66.2	-56	0	0	0	111.7
876	I	30.5	Very low	30.4	Very low	133 Å²	133	132.4 Å²	132.4	68%	0.682	72%	0.716	S	S	*	*			cis	-142.6	128.2	-2.7	-114.3	153.6	0	0	0	105.1
877	S	29.8	Very low	30.2	Very low	98 Å²	98	128.9 Å²	128.9	69%	0.685	72%	0.715	S	S	*	*				64.2	160.5	73.7	-47.2	0	0	0	0	113
878	A	30.5	Very low	29.7	Very low	90 Å²	90	130.8 Å²	130.8	74%	0.744	72%	0.717	S	S	*	*			trans	67.2	148.4	171.5	0	0	0	0	0	115.7
879	V	30.3	Very low	29.7	Very low	114 Å²	114	132 Å²	132	69%	0.691	73%	0.726	S	S	*	*			cis	-137.1	128.2	-18.9	122.2	0	0	0	0	104.3
880	T	28.5	Very low	29.4	Very low	107 Å²	107	133.5 Å²	133.5	66%	0.656	73%	0.734	S	S	*	*				53.3	159.6	85	-13.6	0	0	0	0	113.4
881	D	28.3	Very low	29	Very low	98 Å²	98	129.3 Å²	129.3	52%	0.524	73%	0.725	S	S	.	*			trans	24.6	117.7	157.6	-53.3	-55.3	0	0	0	117.6	Q883	D881-Q883 HydrophobicContact CB-CG 4.45Å; D881-Q883 PolarHBondContact OD1-NE2 3.24Å; D881-Q883 VanDerWaalsContact OD1-NE2 3.13Å
882	Q	30.3	Very low	29	Very low	168 Å²	168	129 Å²	129	79%	0.785	73%	0.727	S	S	*	*				-139	131.1	53.4	-83.3	159.3	19.9	0	0	111.2
883	Q	28.5	Very low	28.8	Very low	139 Å²	139	124.8 Å²	124.8	65%	0.65	72%	0.719	S	S	*	*				69.8	170.6	68.4	-65.2	176.7	15.9	0	0	112.6	D881	D881-Q883 HydrophobicContact CB-CG 4.45Å; D881-Q883 PolarHBondContact OD1-NE2 3.24Å; D881-Q883 VanDerWaalsContact OD1-NE2 3.13Å
884	V	27.3	Very low	28.9	Very low	116 Å²	116	125.5 Å²	125.5	70%	0.703	72%	0.723	S	S	*	*			trans	69.4	83.7	178	-165.7	0	0	0	0	111.9
885	L	26.1	Very low	28.7	Very low	142 Å²	142	125.1 Å²	125.1	74%	0.743	72%	0.72	S	S	*	*				61	101.3	86.2	-62.2	162.9	0	0	0	110.9
886	S	23.2	Very low	28.9	Very low	92 Å²	92	124.3 Å²	124.3	64%	0.643	72%	0.722	S	S	*	*				52.6	94.6	92.8	78.5	0	0	0	0	114.8
887	S	28	Very low	28.9	Very low	116 Å²	116	124.6 Å²	124.6	81%	0.811	72%	0.724	S	S	*	*			trans	-147.7	118.5	144.3	-74.2	0	0	0	0	106.1
888	R	24.3	Very low	29.2	Very low	229 Å²	229	126.4 Å²	126.4	86%	0.864	73%	0.732	S	S	*	*				71.6	70.6	50.8	-60.4	-174	84.2	-167.3	8.3	114.3
889	S	30.9	Very low	29.5	Very low	113 Å²	113	127 Å²	127	79%	0.79	73%	0.728	S	S	*	*			trans	-171.7	97.1	145.3	51.9	0	0	0	0	108.9
890	N	25.3	Very low	29.8	Very low	161 Å²	161	128.2 Å²	128.2	86%	0.861	73%	0.729	S	S	*	*			cis	71.8	47.8	8.7	-143.2	84.4	0	0	0	116.9
891	S	28.8	Very low	30.2	Very low	96 Å²	96	128.6 Å²	128.6	67%	0.671	73%	0.727	S	S	*	*			trans	-150.4	125.1	144.5	52.2	0	0	0	0	108.9
892	T	29.9	Very low	30.6	Very low	126 Å²	126	129.7 Å²	129.7	77%	0.773	73%	0.733	S	S	*	*				47.9	125.4	93.4	7.9	0	0	0	0	113
893	T	29.4	Very low	31	Very low	111 Å²	111	127.2 Å²	127.2	68%	0.681	73%	0.725	S	S	*	*			cis	-161.2	150.6	21.8	-35.7	0	0	0	0	110.3
894	T	30.2	Very low	31.6	Very low	126 Å²	126	127.8 Å²	127.8	77%	0.773	73%	0.725	S	S	*	*			trans	43.9	136.8	155.7	46	0	0	0	0	120.8
895	S	31.9	Very low	32.2	Very low	96 Å²	96	127.6 Å²	127.6	67%	0.671	72%	0.72	S	S	*	*			cis	-173.9	157.4	5.3	45.9	0	0	0	0	111.8
896	N	34.6	Very low	32.6	Very low	140 Å²	140	129 Å²	129	75%	0.749	72%	0.723	S	S	*	*			trans	69.1	79.1	155	-60.1	-6.4	0	0	0	120.6
897	N	31.3	Very low	33.3	Very low	139 Å²	139	129.8 Å²	129.8	74%	0.743	73%	0.728	S	S	*	*				60	123.2	124	-56.3	-8.2	0	0	0	122.2
898	T	35.1	Very low	33.6	Very low	136 Å²	136	133 Å²	133	83%	0.834	73%	0.73	S	S	*	*			trans	67.6	161.5	173.9	75.8	0	0	0	0	113.7
899	P	37.1	Very low	34.1	Very low	103 Å²	103	127.2 Å²	127.2	67%	0.669	73%	0.726	S	S	*	*			cis	-140.3	-161.7	9.4	34.8	-10	0	0	0	115.2
900	I	35.9	Very low	34.4	Very low	139 Å²	139	128.5 Å²	128.5	71%	0.713	72%	0.723	S	S	*	*			trans	85	120.2	134.9	-91.2	172.5	0	0	0	122.4
901	D	38.5	Very low	34.9	Very low	114 Å²	114	125.5 Å²	125.5	61%	0.61	71%	0.708	S	S	*	*				78	110.1	128.3	-62.4	3.3	0	0	0	127.1
902	N	35.9	Very low	35.2	Very low	122 Å²	122	130 Å²	130	65%	0.652	71%	0.709	S	S	*	*				76.4	147.8	103.5	-55.8	-17.9	0	0	0	125.4
903	D	39.6	Very low	35.4	Very low	115 Å²	115	133.7 Å²	133.7	62%	0.615	71%	0.71	S	S	*	*			trans	88.7	109.1	132.3	-81.9	4.3	0	0	0	123.4
904	K	39.4	Very low	35.7	Very low	151 Å²	151	135 Å²	135	66%	0.657	71%	0.712	S	S	*	*				116.6	126.3	105.9	-84.4	-177.2	163.1	99.4	0	122.4
905	D	39.9	Very low	35.8	Very low	113 Å²	113	134.5 Å²	134.5	60%	0.604	71%	0.709	S	S	*	*				84	110.2	125.5	-58.6	-8.5	0	0	0	125
906	E	35.6	Very low	36.1	Very low	172 Å²	172	135.2 Å²	135.2	80%	0.804	71%	0.714	S	S	*	*				88.4	154.6	115.6	-72.3	-170.2	164.2	0	0	125
907	S	38.1	Very low	36.1	Very low	107 Å²	107	133.9 Å²	133.9	75%	0.748	72%	0.716	S	S	*	*			trans	82.5	83.8	155.2	65.5	0	0	0	0	121.1
908	E	33	Very low	36.4	Very low	183 Å²	183	131.6 Å²	131.6	86%	0.855	72%	0.716	S	S	*	*				45.7	144.7	113.8	-61.1	-167.9	135.2	0	0	124.5
909	S	36.4	Very low	36.4	Very low	109 Å²	109	131.1 Å²	131.1	76%	0.762	71%	0.713	S	S	*	*			trans	101.9	111	137.3	78.3	0	0	0	0	121.5
910	D	35.9	Very low	36.2	Very low	139 Å²	139	131.1 Å²	131.1	74%	0.743	72%	0.715	S	S	*	*				83.5	132.3	124.3	-100.2	26.1	0	0	0	126.4
911	N	36.4	Very low	36	Very low	99 Å²	99	131.7 Å²	131.7	53%	0.529	72%	0.719	S	S	.	*			trans	82	104.5	141.8	-73.1	-48.8	0	0	0	123.8
912	R	35.9	Very low	35.8	Very low	189 Å²	189	131.7 Å²	131.7	71%	0.713	72%	0.723	S	S	*	*				81.5	117.8	120.7	-67	170.4	-165.7	-161.7	1.2	121.7
913	R	33.3	Very low	35.6	Very low	205 Å²	205	130 Å²	130	77%	0.774	72%	0.721	S	S	*	*				59.1	113.5	126.2	-60.9	-179.6	-176.3	174.8	-0.1	119.7
914	N	35.3	Very low	35.3	Very low	138 Å²	138	131.4 Å²	131.4	74%	0.738	72%	0.724	S	S	*	*				170.3	131.4	95	-95.9	-22.9	0	0	0	115.9
915	T	33	Very low	34.8	Very low	116 Å²	116	130.4 Å²	130.4	71%	0.712	73%	0.73	S	S	*	*			trans	31.6	124	140	64.4	0	0	0	0	122.1
916	S	37.1	Very low	34.1	Very low	110 Å²	110	131.7 Å²	131.7	77%	0.769	74%	0.743	S	S	*	*				158.6	148.2	92	58.5	0	0	0	0	117
917	S	36.3	Very low	33.8	Very low	113 Å²	113	127.7 Å²	127.7	79%	0.79	74%	0.739	S	S	*	*			trans	67.8	91.8	144.2	-59.7	0	0	0	0	124.2
918	A	35.9	Very low	33.4	Very low	90 Å²	90	129.6 Å²	129.6	74%	0.744	74%	0.74	S	S	*	*				84.9	134.3	109.2	0	0	0	0	0	124.8
919	T	35.2	Very low	33.3	Very low	127 Å²	127	128 Å²	128	78%	0.779	74%	0.737	S	S	*	*			trans	86.4	74.7	142.1	43.9	0	0	0	0	124.3
920	S	32.9	Very low	33	Very low	102 Å²	102	128.7 Å²	128.7	71%	0.713	74%	0.736	S	S	*	*				95.7	145.8	104.3	83.6	0	0	0	0	123.9
921	L	32.7	Very low	32.9	Very low	151 Å²	151	129.2 Å²	129.2	79%	0.791	74%	0.739	S	S	*	*			trans	90	72.8	151.7	-65.7	176.4	0	0	0	122.6
922	V	33.2	Very low	32.7	Very low	115 Å²	115	132.4 Å²	132.4	70%	0.697	75%	0.751	S	S	*	*				78.1	100	106.7	166.6	0	0	0	0	119.9
923	S	33.5	Very low	32.7	Very low	87 Å²	87	129.5 Å²	129.5	61%	0.608	75%	0.749	S	S	*	*				83.3	151.3	122	-68.8	0	0	0	0	122.5
924	E	32.4	Very low	32.7	Very low	143 Å²	143	126.2 Å²	126.2	67%	0.668	75%	0.747	S	S	*	*			cis	-148.9	149.7	15.2	-144.5	114.6	-110.6	0	0	115.8
925	T	29.6	Very low	32.7	Very low	130 Å²	130	127 Å²	127	80%	0.798	75%	0.751	S	S	*	*			trans	54.6	100.2	154.6	48.3	0	0	0	0	122.2
926	T	25.3	Very low	32.9	Very low	140 Å²	140	127.8 Å²	127.8	86%	0.859	76%	0.756	S	S	*	*			trans	-144.5	159	134.8	48.5	0	0	0	0	109.5
927	A	28.6	Very low	32.8	Very low	89 Å²	89	129.1 Å²	129.1	74%	0.736	75%	0.754	S	S	*	*			trans	82.7	130.9	162.3	0	0	0	0	0	120.8
928	I	29.3	Very low	32.7	Very low	147 Å²	147	131 Å²	131	75%	0.754	76%	0.755	S	S	*	*			trans	9.6	140	131.9	-17.2	175.7	0	0	0	119.2
929	D	30.3	Very low	32.6	Very low	150 Å²	150	133 Å²	133	80%	0.802	75%	0.754	S	S	*	*				173	-165.2	113.1	-84.5	-36.8	0	0	0	112.5
930	V	31.9	Very low	32.5	Very low	122 Å²	122	136.8 Å²	136.8	74%	0.739	76%	0.755	S	S	*	*			trans	-127.7	175.7	-149.3	-155.3	0	0	0	0	113.5
931	D	33.6	Very low	32.7	Very low	151 Å²	151	138 Å²	138	81%	0.807	75%	0.754	S	S	*	*			trans	90.5	173.6	159.2	-63.5	-31.9	0	0	0	120.9
932	E	32.2	Very low	32.7	Very low	165 Å²	165	136 Å²	136	77%	0.771	74%	0.744	S	S	*	*			trans	-117.5	175.6	-146.4	-57.7	178.3	131.4	0	0	115.6
933	N	34.2	Very low	32.8	Very low	128 Å²	128	139.8 Å²	139.8	68%	0.684	75%	0.751	S	S	*	*			trans	96.5	109	154.7	-51.8	-61.5	0	0	0	121.2
934	D	35.1	Very low	32.7	Very low	137 Å²	137	140.4 Å²	140.4	73%	0.733	75%	0.751	S	S	*	*				57.5	113.3	121.1	-57	1.2	0	0	0	124.6
935	D	35	Very low	32.8	Very low	153 Å²	153	138.9 Å²	138.9	82%	0.818	76%	0.756	S	S	*	*				73.7	152	124.6	-71.2	-9.9	0	0	0	126.9
936	V	36.9	Very low	32.9	Very low	134 Å²	134	144.4 Å²	144.4	81%	0.812	76%	0.762	S	S	*	*			trans	93.5	128.1	159.4	-161.8	0	0	0	0	121.3
937	D	33.9	Very low	33	Very low	138 Å²	138	143 Å²	143	74%	0.738	76%	0.758	S	S	*	*			trans	-59.1	164.3	-178	-60.5	-74.3	0	0	0	119.1
938	N	34.9	Very low	33.1	Very low	152 Å²	152	144 Å²	144	81%	0.813	76%	0.76	S	S	*	*				-170.2	164.1	106.7	-105.5	-78.4	0	0	0	117.3
939	N	33.6	Very low	32.9	Very low	132 Å²	132	145.5 Å²	145.5	71%	0.706	76%	0.764	S	S	*	*			trans	-75.2	163.9	-171.1	-77.2	-68.8	0	0	0	116.7
940	Y	34.1	Very low	33	Very low	207 Å²	207	146.7 Å²	146.7	81%	0.812	77%	0.768	S	S	*	*				-178.4	122.9	108.5	-112.6	-95.1	0	0	0	116.6
941	D	36.1	Very low	32.7	Very low	127 Å²	127	146.1 Å²	146.1	68%	0.679	77%	0.769	S	S	*	*			trans	47.1	116.6	143	-64.2	7.1	0	0	0	127.8
942	D	33.5	Very low	32.6	Very low	110 Å²	110	144 Å²	144	59%	0.588	77%	0.767	S	S	*	*				53.2	132.2	116.8	-168	46.9	0	0	0	124.2	T944	D942-T944 PolarHBondContact OD1-N 3.17Å
943	K	34.5	Very low	32.4	Very low	194 Å²	194	143.7 Å²	143.7	84%	0.843	77%	0.77	S	S	*	*				-161.8	95.3	122.6	-106.4	150.2	-167.1	154.1	0	115.5
944	T	32.6	Very low	32.2	Very low	100 Å²	100	142.3 Å²	142.3	61%	0.613	77%	0.771	S	S	*	*			trans	11.1	137.8	139.4	50.9	0	0	0	0	120.9	D942	D942-T944 PolarHBondContact OD1-N 3.17Å
945	S	33	Very low	31.8	Very low	110 Å²	110	140.7 Å²	140.7	77%	0.769	77%	0.77	S	S	*	*				163.1	155.5	96.6	57	0	0	0	0	117.4
946	R	31.9	Very low	31.5	Very low	247 Å²	247	138.2 Å²	138.2	93%	0.932	77%	0.765	S	S	*	*			trans	83.4	124.9	157.7	-88.2	-178.6	164.2	133.5	0	122.3
947	S	27.3	Very low	31.1	Very low	111 Å²	111	142.1 Å²	142.1	78%	0.776	77%	0.765	S	S	*	*			trans	-117.8	160.7	-170.5	44.4	0	0	0	0	113.1
948	S	31.9	Very low	30.7	Very low	109 Å²	109	142.9 Å²	142.9	76%	0.762	77%	0.769	S	S	*	*			trans	177	107.7	147	55.1	0	0	0	0	108
949	E	25.5	Very low	30.2	Very low	179 Å²	179	137.8 Å²	137.8	84%	0.836	75%	0.748	S	S	*	*				58.7	117.5	77.1	-67.4	-166	170.6	0	0	115.6
950	I	30.9	Very low	29.7	Very low	174 Å²	174	137.4 Å²	137.4	89%	0.892	75%	0.745	S	S	*	*				177.7	154	117.9	-89.7	160.8	0	0	0	109.2
951	S	26	Very low	29.2	Very low	110 Å²	110	134.7 Å²	134.7	77%	0.769	74%	0.743	S	S	*	*			trans	-121.5	160	-168.2	58.5	0	0	0	0	113.9
952	S	30.8	Very low	28.7	Very low	107 Å²	107	132.4 Å²	132.4	75%	0.748	74%	0.737	S	S	*	*			trans	-167.6	119.9	150.5	57.7	0	0	0	0	113.3
953	N	28.2	Very low	28.2	Very low	158 Å²	158	132.7 Å²	132.7	85%	0.845	74%	0.743	S	S	*	*			trans	17.2	148.6	134.3	-52.1	-19.8	0	0	0	119.6
954	S	30.2	Very low	27.9	Very low	100 Å²	100	131.6 Å²	131.6	70%	0.699	74%	0.738	S	S	*	*			cis	-162.8	151.7	30.1	53.6	0	0	0	0	115.1
955	S	27.5	Very low	27.4	Very low	102 Å²	102	130.7 Å²	130.7	71%	0.713	73%	0.734	S	S	*	*			trans	44.9	123.4	144.1	65.2	0	0	0	0	120
956	S	28.7	Very low	27.2	Very low	101 Å²	101	132.7 Å²	132.7	71%	0.706	74%	0.735	S	S	*	*				-168.8	143.5	59.6	-70.6	0	0	0	0	115.8
957	R	28.2	Very low	26.8	Very low	217 Å²	217	126.1 Å²	126.1	82%	0.819	72%	0.718	S	S	*	*			trans	53.6	101.4	143.3	-65.8	177.5	173.9	150.1	-1.1	119.9	K238	K238-R957 PolarHBondContact NZ-O 3.32Å
958	N	24.8	Very low	26.7	Very low	153 Å²	153	126.4 Å²	126.4	82%	0.818	71%	0.71	S	S	*	*				23.7	131.7	123.9	-55.8	7.8	0	0	0	118.5	K238	K238-N958 PolarHBondContact NZ-O 3.32Å
959	A	25.2	Very low	26.4	Very low	46 Å²	46	124.8 Å²	124.8	38%	0.38	69%	0.693	S	S	.	*				170.6	127.3	114.3	0	0	0	0	0	111.5	K238	K238-A959 HydrophobicContact CD-CB 3.93Å; K238-A959 WeakPolarHBondContact CE-O 3.46Å; K238-A959 HydrophobicContact CG-CB 3.94Å
960	L	23.9	Very low	26.4	Very low	124 Å²	124	125.4 Å²	125.4	65%	0.649	69%	0.688	S	S	*	*			trans	37.9	128.7	146.4	-76.6	70	0	0	0	121.5	S237	S237-L960 WeakPolarHBondContact CB-O 3.41Å; S237-L960 PolarHBondContact OG-O 3.46Å
961	I	23.4	Very low	26.1	Very low	150 Å²	150	121.7 Å²	121.7	77%	0.769	67%	0.67	S	S	*	*				33	105	116.6	-46.3	166.3	0	0	0	116.7	S237	S237-I961 WeakPolarHBondContact CB-O 3.06Å
962	S	24.6	Very low	26.1	Very low	79 Å²	79	125 Å²	125	55%	0.552	67%	0.667	S	S	*	*			trans	-171.5	140.9	132.2	-170.5	0	0	0	0	113
963	T	24.4	Very low	25.8	Very low	115 Å²	115	125.4 Å²	125.4	71%	0.706	66%	0.66	S	S	*	*			trans	13.3	127.8	154.7	60.7	0	0	0	0	121.3
964	K	26.4	Very low	25.7	Very low	172 Å²	172	120.8 Å²	120.8	75%	0.748	64%	0.641	S	S	*	*				-178.7	115.8	114.7	-98.9	162.9	-175	175.3	0	111.6	L966	K964-L966 PolarHBondContact O-N 3.36Å
965	P	23.4	Very low	25.5	Very low	80 Å²	80	121.1 Å²	121.1	52%	0.519	64%	0.643	S	S	.	*			trans	-71.8	119.8	163.5	29.8	-30.9	0	0	0	108.8	L967	P965-L967 PolarHBondContact O-N 3.44Å; P965-L967 VanDerWaalsContact O-N 3.09Å
966	L	27.4	Very low	25.5	Very low	152 Å²	152	124 Å²	124	80%	0.796	65%	0.645	S	S	*	*			trans	-73.3	102.8	175.1	-78.1	170.8	0	0	0	109.7	N594 K964 L968	N594-L966 PolarHBondContact OD1-O 3.49Å; K964-L966 PolarHBondContact O-N 3.36Å; L966-L968 PolarHBondContact O-N 3.02Å
967	L	25.1	Very low	25.4	Very low	110 Å²	110	124 Å²	124	58%	0.576	65%	0.645	S	S	*	*			trans	-67	88.3	178.4	-70.3	169	0	0	0	111.2	P965 N969	P965-L967 PolarHBondContact O-N 3.44Å; P965-L967 VanDerWaalsContact O-N 3.09Å; L967-N969 PolarHBondContact O-N 2.8Å
968	L	24.8	Very low	25.2	Very low	117 Å²	117	119.4 Å²	119.4	61%	0.613	64%	0.644	S	S	*	*			trans	-77.4	67.8	173.4	-147.2	90.9	0	0	0	111.5	N594 L966 R970	N594-L968 WeakPolarHBondContact OD1-CB 3.37Å; L966-L968 PolarHBondContact O-N 3.02Å; L968-R970 PolarHBondContact O-N 2.99Å
969	N	25.9	Very low	25.2	Very low	75 Å²	75	119.2 Å²	119.2	40%	0.401	64%	0.643	S	S	.	*			trans	-64.3	95	172.3	-95.6	-32.8	0	0	0	110.4	N315 N595 L967 N971	N315-N969 WeakPolarHBondContact ND2-CB 3.29Å; N315-N969 VanDerWaalsContact ND2-CG 3.35Å; N315-N969 PolarHBondContact ND2-ND2 2.61Å; N595-N969 PolarHBondContact ND2-OD1 2.83Å; L967-N969 PolarHBondContact O-N 2.8Å; N969-N971 PolarHBondContact O-N 3.42Å
970	R	24.8	Very low	25.3	Very low	191 Å²	191	124.6 Å²	124.6	72%	0.721	67%	0.665	S	S	*	*			trans	-69.1	92.1	169.3	-84.5	-176.3	165	-174.6	-5.5	110.2	L968 Y972	L968-R970 PolarHBondContact O-N 2.99Å; R970-Y972 PolarHBondContact O-N 2.78Å; R970-Y972 VanDerWaalsContact O-N 3.09Å
971	N	25.4	Very low	25.5	Very low	96 Å²	96	124.1 Å²	124.1	51%	0.513	67%	0.668	S	S	.	*			trans	-63.6	100.9	148.6	-69.8	-56.1	0	0	0	107.5	P313 N969	P313-N971 VanDerWaalsContact CB-ND2 3.27Å; P313-N971 WeakPolarHBondContact CB-ND2 3.46Å; P313-N971 WeakPolarHBondContact CG-ND2 3.23Å; N969-N971 PolarHBondContact O-N 3.42Å
972	Y	26.2	Very low	25.8	Very low	181 Å²	181	124.1 Å²	124.1	71%	0.71	67%	0.669	S	S	*	*			trans	-135.1	96.7	170.2	-113	-94.4	0	0	0	110	R970	R970-Y972 PolarHBondContact O-N 2.78Å; R970-Y972 VanDerWaalsContact O-N 3.09Å
973	D	24	Very low	26	Very low	115 Å²	115	126 Å²	126	62%	0.615	67%	0.673	S	S	*	*			trans	-56.2	155	142.8	175.6	30.9	0	0	0	108.9
974	S	25	Very low	26.3	Very low	61 Å²	61	127.5 Å²	127.5	43%	0.427	68%	0.677	S	S	.	*			trans	65.7	110.4	-167.5	68.8	0	0	0	0	116.1
975	S	27.2	Very low	26.3	Very low	106 Å²	106	127 Å²	127	74%	0.741	68%	0.681	S	S	*	*			trans	-100	55.6	164.8	50.7	0	0	0	0	111.7
976	E	26.2	Very low	26.6	Very low	163 Å²	163	129.1 Å²	129.1	76%	0.762	69%	0.693	S	S	*	*			trans	-85.9	138.1	159.3	-73	-175.4	140.1	0	0	109.6
977	S	26.4	Very low	26.6	Very low	102 Å²	102	130.1 Å²	130.1	71%	0.713	69%	0.694	S	S	*	*			trans	53.1	96	166.8	61.4	0	0	0	0	118.3
978	C	24.5	Very low	26.7	Very low	119 Å²	119	133 Å²	133	80%	0.804	71%	0.708	S	S	*	*			trans	-147.5	31.9	153.8	-98.1	0	0	0	0	113.4
979	L	25.9	Very low	26.8	Very low	149 Å²	149	131.4 Å²	131.4	78%	0.78	71%	0.706	S	S	*	*			trans	-111.9	103	149.3	-75.1	177.6	0	0	0	106.4
980	N	26.8	Very low	26.8	Very low	159 Å²	159	134.6 Å²	134.6	85%	0.85	73%	0.729	S	S	*	*			trans	-162.5	73.2	166.5	-99.5	-2.9	0	0	0	105
981	T	27.3	Very low	27	Very low	115 Å²	115	135 Å²	135	71%	0.706	73%	0.73	S	S	*	*			trans	-80.2	151.7	153.4	56.8	0	0	0	0	107.8
982	D	29.8	Very low	27	Very low	149 Å²	149	136.2 Å²	136.2	80%	0.797	74%	0.735	S	S	*	*	S	Bend	trans	75.6	148.9	161.8	-43.6	-48.7	0	0	0	117.7
983	N	28.4	Very low	27.2	Very low	120 Å²	120	137.8 Å²	137.8	64%	0.642	75%	0.746	S	S	*	*			trans	-79.6	150.8	-175	-66.4	-61.7	0	0	0	110.6	E1149	N983-E1149 PolarHBondContact ND2-OE1 2.7Å
984	D	31.2	Very low	27.4	Very low	146 Å²	146	140.7 Å²	140.7	78%	0.781	75%	0.753	S	S	*	*			trans	-135.2	114.4	150.4	-141	-28.4	0	0	0	111.4
985	L	26.8	Very low	27.7	Very low	161 Å²	161	147 Å²	147	84%	0.843	77%	0.773	S	S	*	*			trans	-107.6	76.9	-179.2	-96.8	171.6	0	0	0	108.8
986	T	29.3	Very low	28	Very low	125 Å²	125	150.8 Å²	150.8	77%	0.767	78%	0.776	S	S	*	*			trans	-99.7	125.2	172.2	42.2	0	0	0	0	111.8
987	Q	28.3	Very low	28.4	Very low	173 Å²	173	150.8 Å²	150.8	81%	0.808	78%	0.776	S	S	*	*			trans	-92.6	138.5	-178.4	-54	175.3	33.4	0	0	110.1
988	I	27.7	Very low	28.7	Very low	169 Å²	169	153.5 Å²	153.5	87%	0.867	77%	0.774	S	S	*	*			trans	-127	127.1	151.5	-62.5	-176.4	0	0	0	107.8
989	S	25.6	Very low	29.1	Very low	84 Å²	84	156.7 Å²	156.7	59%	0.587	77%	0.77	S	S	*	*			trans	-121.1	127.3	-171	77	0	0	0	0	112.4
990	V	26.4	Very low	29.3	Very low	143 Å²	143	156 Å²	156	87%	0.867	76%	0.762	S	S	*	*			trans	-123.6	72.7	174	-169.5	0	0	0	0	111.4
991	R	28.8	Very low	29.5	Very low	199 Å²	199	155.3 Å²	155.3	75%	0.751	75%	0.754	S	S	*	*			trans	6	129.6	145.6	-80.3	174.9	174.1	169.2	0.5	120.1
992	I	25.2	Very low	29.8	Very low	122 Å²	122	156.9 Å²	156.9	63%	0.626	75%	0.751	S	S	*	*			trans	76.8	116.4	133.2	-58.5	164.2	0	0	0	119.4
993	K	29.9	Very low	30	Very low	213 Å²	213	157.3 Å²	157.3	93%	0.926	75%	0.746	S	S	*	*				-154.8	124.6	111.5	-106.4	161.6	-166.1	170.3	0	113.9
994	K	29.5	Very low	30.2	Very low	177 Å²	177	160.7 Å²	160.7	77%	0.77	75%	0.75	S	S	*	*			trans	-77.6	150.9	-170.6	-57.2	159.3	174.8	171.8	0	113.1
995	K	31.2	Very low	30.1	Very low	194 Å²	194	160.7 Å²	160.7	84%	0.843	75%	0.745	S	S	*	*				170	134.2	109.3	-94.1	168.1	178.9	174.4	0	117.4
996	K	33.7	Very low	30.5	Very low	184 Å²	184	162 Å²	162	80%	0.8	74%	0.744	S	S	*	*			trans	51.5	105.2	139.8	-72.9	-168.3	170.7	-174.3	0	123.5
997	H	34.4	Very low	30.6	Very low	164 Å²	164	165.8 Å²	165.8	76%	0.759	75%	0.75	S	S	*	*				65.4	129	102.1	-90.2	-55.9	0	0	0	125.6
998	K	32.1	Very low	30.7	Very low	159 Å²	159	160.6 Å²	160.6	69%	0.691	74%	0.742	S	S	*	*				85.1	139.4	128.8	-100.3	-176.9	173.7	178.4	0	122.7
999	R	31.9	Very low	30.9	Very low	186 Å²	186	160.7 Å²	160.7	70%	0.702	74%	0.743	S	S	*	*			trans	73.2	148.6	146	-72.7	-160.3	150.1	161.8	-11.7	120
1000	E	31.6	Very low	31.1	Very low	134 Å²	134	161.8 Å²	161.8	63%	0.626	75%	0.75	S	S	*	*			cis	-166.5	148.7	-30.7	-127.6	157.7	-133.7	0	0	109.1
1001	E	30.2	Very low	31.1	Very low	145 Å²	145	162.5 Å²	162.5	68%	0.678	75%	0.748	S	S	*	*			trans	46	123.5	143.4	-151.7	-158.9	-143.9	0	0	122.1
1002	K	34.4	Very low	31.2	Very low	148 Å²	148	158.7 Å²	158.7	64%	0.643	75%	0.749	S	S	*	*				168.2	131.8	112.6	-89.5	173.7	-175.3	71.8	0	116.8
1003	K	33.6	Very low	31.5	Very low	158 Å²	158	158.1 Å²	158.1	69%	0.687	75%	0.754	S	S	*	*			trans	69.7	110.1	134.3	-69	178.1	-178.2	179.1	0	122.5
1004	R	32	Very low	31.4	Very low	191 Å²	191	153.5 Å²	153.5	72%	0.721	74%	0.743	S	S	*	*				124.1	104.9	100	-90.6	-177.4	171.6	-175.8	-4.8	120.2
1005	Q	30.5	Very low	31.1	Very low	146 Å²	146	155.2 Å²	155.2	68%	0.682	75%	0.746	S	S	*	*				74.4	148.4	115.8	-75.1	178.1	-29.8	0	0	123.3
1006	K	33.2	Very low	30.8	Very low	188 Å²	188	150.6 Å²	150.6	82%	0.817	74%	0.738	S	S	*	*			trans	71.9	128.1	161.8	-72.6	173.5	-173.2	-177.5	0	115.8
1007	K	33.3	Very low	30.4	Very low	205 Å²	205	150 Å²	150	89%	0.891	74%	0.738	S	S	*	*			cis	-144.5	154.6	-8.4	-67.8	169.8	178.4	176.1	0	106.5
1008	G	30.5	Very low	30	Very low	63 Å²	63	149 Å²	149	65%	0.649	74%	0.738	S	S	*	*			cis	157.8	167.5	-5	0	0	0	0	0	111
1009	I	31.3	Very low	29.8	Very low	172 Å²	172	147 Å²	147	88%	0.882	74%	0.739	S	S	*	*			trans	71.9	138.6	168	-51.3	171.6	0	0	0	115.2
1010	S	29.3	Very low	29.5	Very low	106 Å²	106	146 Å²	146	74%	0.741	74%	0.742	S	S	*	*			cis	-161.1	172.5	-31.4	60.1	0	0	0	0	110.3
1011	L	25.4	Very low	29.3	Very low	158 Å²	158	145.5 Å²	145.5	83%	0.827	74%	0.744	S	S	*	*			trans	-105.6	-167.7	166.1	-39.4	90.1	0	0	0	109.4
1012	P	31.8	Very low	29.3	Very low	119 Å²	119	144.6 Å²	144.6	77%	0.773	75%	0.748	S	S	*	*			cis	-120.5	-102	-29.7	20.1	4.9	0	0	0	114.3
1013	P	31.6	Very low	29.1	Very low	110 Å²	110	143.3 Å²	143.3	71%	0.714	75%	0.753	S	S	*	*			trans	-127.7	-158.3	-141.2	38.4	-14.5	0	0	0	115
1014	V	27.2	Very low	29.1	Very low	116 Å²	116	140.8 Å²	140.8	70%	0.703	76%	0.756	S	S	*	*			trans	110.1	102.6	159.1	179.8	0	0	0	0	117.7
1015	Y	24.3	Very low	29.1	Very low	214 Å²	214	140.2 Å²	140.2	84%	0.839	76%	0.759	S	S	*	*			trans	65.3	155.1	141.6	-83.2	-111.4	0	0	0	124.3
1016	S	25.5	Very low	29.1	Very low	97 Å²	97	140.7 Å²	140.7	68%	0.678	76%	0.764	S	S	*	*			trans	68.9	121.4	152.5	45.1	0	0	0	0	121.7
1017	E	25.4	Very low	29.2	Very low	171 Å²	171	136.8 Å²	136.8	80%	0.799	76%	0.761	S	S	*	*			trans	78.3	133.9	134.1	-72.2	-179.9	-173	0	0	122.8
1018	L	26	Very low	29	Very low	144 Å²	144	134.2 Å²	134.2	75%	0.754	76%	0.756	S	S	*	*			trans	66.9	132.4	141.4	-65.5	166.9	0	0	0	122.3
1019	T	27.3	Very low	29	Very low	117 Å²	117	140.7 Å²	140.7	72%	0.718	77%	0.767	S	S	*	*			trans	60.7	110.7	143.3	53.9	0	0	0	0	121.9
1020	E	25.4	Very low	28.7	Very low	163 Å²	163	143.3 Å²	143.3	76%	0.762	77%	0.767	S	S	*	*				63.6	132.2	120.8	-67.1	-160.8	-170.2	0	0	124.3
1021	N	27.9	Very low	28.7	Very low	124 Å²	124	146.2 Å²	146.2	66%	0.663	77%	0.773	S	S	*	*			trans	54.7	114.1	132.8	-62.6	-37.4	0	0	0	121.5
1022	T	30.2	Very low	28.9	Very low	126 Å²	126	147.7 Å²	147.7	77%	0.773	78%	0.775	S	S	*	*				165.8	103.6	114.8	35.4	0	0	0	0	111.7
1023	T	29.4	Very low	29	Very low	121 Å²	121	149.2 Å²	149.2	74%	0.742	78%	0.777	S	S	*	*				86.5	147.8	83.2	59.2	0	0	0	0	117.7
1024	S	32.7	Very low	29	Very low	106 Å²	106	150.5 Å²	150.5	74%	0.741	78%	0.776	S	S	*	*			trans	96.6	139.7	155.7	92	0	0	0	0	117.3
1025	K	32.5	Very low	28.9	Very low	179 Å²	179	151 Å²	151	78%	0.778	79%	0.785	S	S	*	*			cis	-164.9	163.2	-4.7	-127.9	170.4	-167.2	173.1	0	112.9
1026	I	30.9	Very low	29.2	Very low	155 Å²	155	145.1 Å²	145.1	80%	0.795	78%	0.775	S	S	*	*			trans	74.8	135.5	161.6	-59	149.9	0	0	0	114.5
1027	S	34.9	Very low	29.4	Very low	107 Å²	107	149.2 Å²	149.2	75%	0.748	79%	0.786	S	S	*	*			cis	-130.3	152	6.1	52.7	0	0	0	0	113.9
1028	D	29.1	Very low	29.5	Very low	150 Å²	150	148.3 Å²	148.3	80%	0.802	79%	0.786	S	S	*	*			trans	-85.9	147.9	-170.4	-34.7	-92.6	0	0	0	115.1
1029	K	31.3	Very low	29.6	Very low	200 Å²	200	148.1 Å²	148.1	87%	0.87	79%	0.786	S	S	*	*				-174.4	160.3	110.6	-104.9	172.6	179	176.6	0	114.6
1030	Y	25.7	Very low	29.8	Very low	226 Å²	226	147.6 Å²	147.6	89%	0.886	78%	0.782	S	S	*	*	S	Bend	trans	84	28.5	158.2	-126.5	-89.8	0	0	0	122.1
1031	I	28.8	Very low	30.1	Very low	167 Å²	167	147.3 Å²	147.3	86%	0.856	78%	0.778	S	S	*	*			trans	-136.6	106.6	137.2	-59.1	-176.2	0	0	0	109.7
1032	Q	29.5	Very low	30.2	Very low	189 Å²	189	148.5 Å²	148.5	88%	0.883	78%	0.78	S	S	*	*			trans	-165.7	117.5	148.3	-117.4	-179.2	18.3	0	0	110.4
1033	N	32.8	Very low	30.1	Very low	151 Å²	151	150.1 Å²	150.1	81%	0.807	78%	0.782	S	S	*	*			trans	-152.6	101	150.6	-125.5	-11.4	0	0	0	110.5
1034	I	31.7	Very low	30.4	Very low	137 Å²	137	149 Å²	149	70%	0.703	78%	0.777	S	S	*	*			trans	58.2	107.2	152.6	-52.7	171.6	0	0	0	117.5	S1036	I1034-S1036 WeakPolarHBondContact CG2-OG 3.49Å
1035	S	26.8	Very low	30.2	Very low	127 Å²	127	150.5 Å²	150.5	89%	0.888	78%	0.777	S	S	*	*			trans	-111.8	120	145.9	-177.1	0	0	0	0	107.9
1036	S	29.5	Very low	30.1	Very low	91 Å²	91	148 Å²	148	64%	0.636	77%	0.772	S	S	*	*			trans	-163.5	83.5	176.6	62.3	0	0	0	0	113.5	I1034	I1034-S1036 WeakPolarHBondContact CG2-OG 3.49Å
1037	M	30.7	Very low	30	Very low	183 Å²	183	147.1 Å²	147.1	90%	0.901	77%	0.767	S	S	*	*			trans	-157.8	111	139.1	-82.7	-135.8	75.3	0	0	108.6
1038	L	27.6	Very low	29.7	Very low	152 Å²	152	149 Å²	149	80%	0.796	77%	0.766	S	S	*	*			trans	-98.3	170.4	168.6	-81.6	164.3	0	0	0	109.4
1039	N	28	Very low	29.8	Very low	140 Å²	140	149.2 Å²	149.2	75%	0.749	76%	0.762	S	S	*	*			trans	74.6	143.6	166.8	-58.6	-21.2	0	0	0	115.1
1040	T	30.7	Very low	29.9	Very low	106 Å²	106	145.8 Å²	145.8	65%	0.65	75%	0.753	S	S	*	*			cis	-167.5	149.2	0.4	12	0	0	0	0	110.7
1041	K	30.7	Very low	30.1	Very low	156 Å²	156	139.8 Å²	139.8	68%	0.678	74%	0.744	S	S	*	*			trans	62.1	172.6	147.6	-66.5	169.4	157.9	-78.4	0	116.6
1042	E	31.3	Very low	30.7	Very low	150 Å²	150	137.2 Å²	137.2	70%	0.701	74%	0.738	S	S	*	*			cis	-150	169.5	-33.9	-108	155.3	-178.8	0	0	109.6
1043	I	27.9	Very low	30.8	Very low	159 Å²	159	136.5 Å²	136.5	82%	0.815	74%	0.735	S	S	*	*			trans	-67.4	180	176.3	13.4	171.1	0	0	0	113.8
1044	P	35.3	Very low	30.6	Very low	98 Å²	98	139.2 Å²	139.2	64%	0.636	73%	0.734	S	S	*	*			cis	-138.6	-169.1	-14.9	36	-13.9	0	0	0	115.3
1045	N	28.5	Very low	30.7	Very low	138 Å²	138	137.2 Å²	137.2	74%	0.738	73%	0.73	S	S	*	*			trans	44.1	143.6	146.7	-63.3	8.6	0	0	0	121.9
1046	D	29.9	Very low	30.6	Very low	127 Å²	127	141 Å²	141	68%	0.679	73%	0.725	S	S	*	*				179.7	160.3	57.9	-114.4	-29.5	0	0	0	113
1047	I	28.5	Very low	30.6	Very low	135 Å²	135	142.2 Å²	142.2	69%	0.692	73%	0.729	S	S	*	*			trans	53.2	141.7	140.3	-62.8	166.3	0	0	0	121.5
1048	M	29.1	Very low	30.3	Very low	146 Å²	146	141.5 Å²	141.5	72%	0.719	72%	0.72	S	S	*	*			cis	-171.4	176.8	-19.5	-96	-164	-178.1	0	0	109.7
1049	H	32.2	Very low	30.3	Very low	156 Å²	156	140.7 Å²	140.7	72%	0.722	71%	0.712	S	S	*	*			trans	69.8	143.1	162.9	-69.5	-76.4	0	0	0	118
1050	D	32.9	Very low	30.2	Very low	128 Å²	128	140.6 Å²	140.6	68%	0.684	71%	0.712	S	S	*	*			cis	-135.8	154.4	-8.2	-93.6	-44.1	0	0	0	108.4
1051	S	30.5	Very low	30	Very low	99 Å²	99	141.2 Å²	141.2	69%	0.692	72%	0.721	S	S	*	*			cis	77.5	146.9	42.7	-140.4	0	0	0	0	114.1
1052	P	39.9	Very low	29.9	Very low	113 Å²	113	139.1 Å²	139.1	73%	0.734	72%	0.723	S	S	*	*			cis	-118.2	-148.8	-18.7	38.4	-18.3	0	0	0	109.4
1053	E	32.8	Very low	29.6	Very low	174 Å²	174	139.8 Å²	139.8	81%	0.813	73%	0.73	S	S	*	*			cis	-142.1	-108.1	-7.1	-170.5	148.2	-101.7	0	0	113.7
1054	R	29.2	Very low	29.8	Very low	208 Å²	208	137.5 Å²	137.5	79%	0.785	73%	0.726	S	S	*	*			trans	179.1	-165.9	-154.1	-112	173	180	-179	1.4	109.7
1055	P	32.6	Very low	29.2	Very low	95 Å²	95	142.4 Å²	142.4	62%	0.617	73%	0.733	S	S	*	*			cis	-134.8	172.7	4	27.8	-2.8	0	0	0	117.9
1056	R	25.5	Very low	29	Very low	207 Å²	207	141.8 Å²	141.8	78%	0.781	73%	0.728	S	S	*	*			trans	32.4	149.4	133.7	-52.2	165.6	177.4	157.6	-3.2	119.5
1057	T	28.9	Very low	28.8	Very low	117 Å²	117	140.6 Å²	140.6	72%	0.718	73%	0.73	S	S	*	*			cis	-171.6	135.6	44.7	-26.2	0	0	0	0	113.8
1058	K	24.6	Very low	28.8	Very low	167 Å²	167	138.2 Å²	138.2	73%	0.726	73%	0.726	S	S	*	*			trans	40.3	147.6	135.8	-65.8	175.6	140.4	-145.7	0	126.2
1059	H	27.9	Very low	29	Very low	136 Å²	136	137.8 Å²	137.8	63%	0.63	73%	0.726	S	S	*	*			trans	93	120.5	141.7	-75	-54.2	0	0	0	122.1
1060	N	25.6	Very low	28.8	Very low	137 Å²	137	136.9 Å²	136.9	73%	0.733	73%	0.726	S	S	*	*			trans	50.2	121.8	135.2	-50.7	9.8	0	0	0	121.7
1061	S	25.8	Very low	28.8	Very low	120 Å²	120	139.2 Å²	139.2	84%	0.839	73%	0.733	S	S	*	*				172.4	153.7	111.4	-72.2	0	0	0	0	112.6
1062	P	30	Very low	28.6	Very low	111 Å²	111	142.5 Å²	142.5	72%	0.721	74%	0.737	S	S	*	*			trans	-115.5	166	175.4	41.3	-32.3	0	0	0	114.8
1063	L	23.8	Very low	28.3	Very low	164 Å²	164	144 Å²	144	86%	0.859	75%	0.745	S	S	*	*			trans	67.5	169.6	172.9	-52.7	173.2	0	0	0	114.9
1064	P	31.5	Very low	28	Very low	112 Å²	112	140.4 Å²	140.4	73%	0.727	74%	0.738	S	S	*	*				-132.4	-168.6	-66	39.7	-24.3	0	0	0	113
1065	Y	23.9	Very low	28.1	Very low	201 Å²	201	137.2 Å²	137.2	79%	0.788	74%	0.737	S	S	*	*			trans	84.8	107.2	150.9	-143.7	-107.7	0	0	0	120.5
1066	I	24	Very low	27.7	Very low	124 Å²	124	139.1 Å²	139.1	64%	0.636	74%	0.741	S	S	*	*			trans	61.7	149.5	136.8	-77.3	-176.2	0	0	0	122.3
1067	S	26.4	Very low	27.8	Very low	103 Å²	103	137.4 Å²	137.4	72%	0.72	75%	0.746	S	S	*	*			trans	69.7	144.8	170.4	-90.2	0	0	0	0	117.3
1068	S	27.5	Very low	27.6	Very low	85 Å²	85	136.7 Å²	136.7	59%	0.594	74%	0.742	S	S	*	*			cis	167.2	-179.2	-27.6	50.3	0	0	0	0	104.8
1069	D	33.3	Very low	27.6	Very low	136 Å²	136	139.5 Å²	139.5	73%	0.727	75%	0.749	S	S	*	*			trans	95.4	134.7	166.6	-50.4	1.4	0	0	0	114
1070	L	28.2	Very low	27.6	Very low	138 Å²	138	137.7 Å²	137.7	72%	0.723	75%	0.749	S	S	*	*			cis	-175	-163.5	-29.2	-117.7	162	0	0	0	105.9
1071	E	32.2	Very low	27.5	Very low	177 Å²	177	139.4 Å²	139.4	83%	0.827	76%	0.758	S	S	*	*			trans	73.2	80.9	176.9	-58.6	-178	-165.6	0	0	113.5
1072	E	27.2	Very low	27.5	Very low	167 Å²	167	139.1 Å²	139.1	78%	0.78	75%	0.751	S	S	*	*				90.3	114.6	63.8	-74.8	-175.1	164.7	0	0	114.2
1073	T	33.7	Very low	27.3	Very low	146 Å²	146	142.9 Å²	142.9	90%	0.896	76%	0.759	S	S	*	*				-160.7	132.4	123	6.1	0	0	0	0	108.5
1074	S	25.9	Very low	27.4	Very low	97 Å²	97	140.6 Å²	140.6	68%	0.678	76%	0.756	S	S	*	*			trans	-78.9	173.8	174.1	52.7	0	0	0	0	110.1
1075	D	30.8	Very low	27.1	Very low	142 Å²	142	143.5 Å²	143.5	76%	0.759	76%	0.76	S	S	*	*				-155.5	168.2	68.4	-78.9	-31.3	0	0	0	114.6
1076	L	25.2	Very low	27.2	Very low	134 Å²	134	140.6 Å²	140.6	70%	0.702	76%	0.758	S	S	*	*			trans	-78.8	148.3	-179	-50.4	77.7	0	0	0	111.9
1077	I	27.5	Very low	27.3	Very low	172 Å²	172	139.4 Å²	139.4	88%	0.882	76%	0.757	S	S	*	*			trans	-132.4	113.6	132.4	-64.5	-171.9	0	0	0	108.8
1078	T	24.5	Very low	27.4	Very low	102 Å²	102	140.6 Å²	140.6	63%	0.626	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-77.8	161.4	172.6	-38.5	0	0	0	0	110.6	P1080	T1078-P1080 WeakPolarHBondContact O-CD 3.38Å
1079	Y	25.5	Very low	27.3	Very low	226 Å²	226	143.6 Å²	143.6	89%	0.886	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-53.6	129.3	159.1	-82.3	-100.4	0	0	0	110.6
1080	P	26.3	Very low	26.9	Very low	97 Å²	97	144.1 Å²	144.1	63%	0.63	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-92.9	120.4	159.9	33.5	-26.5	0	0	0	109.7	T1078 V1082	T1078-P1080 WeakPolarHBondContact O-CD 3.38Å; P1080-V1082 HydrophobicContact CB-CG2 4.04Å; P1080-V1082 HydrophobicContact CG-CG2 4.25Å; P1080-V1082 PolarHBondContact O-N 2.73Å
1081	D	24.1	Very low	26.7	Very low	173 Å²	173	143 Å²	143	93%	0.925	77%	0.771	S	S	*	*			trans	-65.8	97.8	158.5	-92.3	-47.8	0	0	0	108.3	Q1083	D1081-Q1083 PolarHBondContact O-N 2.86Å
1082	V	26.3	Very low	26.4	Very low	114 Å²	114	140.7 Å²	140.7	69%	0.691	77%	0.771	S	S	*	*			trans	-96.1	89	170.3	-176	0	0	0	0	108.4	P1080 C1084	P1080-V1082 HydrophobicContact CB-CG2 4.04Å; P1080-V1082 HydrophobicContact CG-CG2 4.25Å; P1080-V1082 PolarHBondContact O-N 2.73Å; V1082-C1084 HydrophobicContact CG1-CB 4.26Å; V1082-C1084 PolarHBondContact O-N 3.26Å
1083	Q	26.1	Very low	26.4	Very low	190 Å²	190	137 Å²	137	89%	0.888	76%	0.764	S	S	*	*			trans	-63.7	117.1	151.1	-73.1	-169.7	-31.5	0	0	108	D1081	D1081-Q1083 PolarHBondContact O-N 2.86Å
1084	C	25.2	Very low	26	Very low	117 Å²	117	135.1 Å²	135.1	79%	0.791	76%	0.756	S	S	*	*			trans	-136.3	131.4	157.4	-148.5	0	0	0	0	107.4	V1082	V1082-C1084 HydrophobicContact CG1-CB 4.26Å; V1082-C1084 PolarHBondContact O-N 3.26Å
1085	E	24.2	Very low	26	Very low	173 Å²	173	136.7 Å²	136.7	81%	0.808	76%	0.762	S	S	*	*			trans	-86	165.3	-164.1	-60.2	169.5	124.8	0	0	111.8
1086	D	27.9	Very low	25.8	Very low	139 Å²	139	137.2 Å²	137.2	74%	0.743	77%	0.765	S	S	*	*			trans	39.8	122.7	144.4	-71.7	0.7	0	0	0	119.4
1087	T	26	Very low	25.8	Very low	100 Å²	100	138.3 Å²	138.3	61%	0.613	77%	0.77	S	S	*	*			cis	-175.3	145.5	30.1	13.4	0	0	0	0	111.7
1088	S	28.5	Very low	25.8	Very low	127 Å²	127	136.6 Å²	136.6	89%	0.888	77%	0.772	S	S	*	*			trans	-161.5	92.5	145	-73.2	0	0	0	0	108.4
1089	Q	24.4	Very low	25.7	Very low	148 Å²	148	136.7 Å²	136.7	69%	0.692	78%	0.777	S	S	*	*			trans	-78.7	132.8	-178	-63.8	168.6	-5.2	0	0	110.8	I1091	Q1089-I1091 HydrophobicContact CB-CG1 4.1Å
1090	V	26	Very low	25.8	Very low	147 Å²	147	134.7 Å²	134.7	89%	0.891	78%	0.776	S	S	*	*			trans	-117.5	116.9	149.2	-179.3	0	0	0	0	106.2
1091	I	23.6	Very low	25.8	Very low	115 Å²	115	138.5 Å²	138.5	59%	0.59	79%	0.787	S	S	*	*			trans	-91.3	124.3	-161	-55.8	167.2	0	0	0	109.6	Q1089 S1093	Q1089-I1091 HydrophobicContact CB-CG1 4.1Å; I1091-S1093 VanDerWaalsContact C-N 3.33Å; I1091-S1093 PolarHBondContact O-N 2.95Å; I1091-S1093 VanDerWaalsContact O-N 3.09Å
1092	P	25.6	Very low	25.9	Very low	129 Å²	129	137.9 Å²	137.9	84%	0.838	78%	0.783	S	S	*	*			trans	-76.3	88.1	160	31.5	-30.5	0	0	0	108.3
1093	S	26.2	Very low	26	Very low	89 Å²	89	139.2 Å²	139.2	62%	0.622	79%	0.786	S	S	*	*			trans	-79.9	149.1	-178.8	54.3	0	0	0	0	112.2	I1091	I1091-S1093 VanDerWaalsContact C-N 3.33Å; I1091-S1093 PolarHBondContact O-N 2.95Å; I1091-S1093 VanDerWaalsContact O-N 3.09Å
1094	S	27.1	Very low	26	Very low	106 Å²	106	135.7 Å²	135.7	74%	0.741	78%	0.78	S	S	*	*			trans	51.8	81	174.4	52.9	0	0	0	0	115.2
1095	V	25.5	Very low	26.2	Very low	130 Å²	130	134.2 Å²	134.2	79%	0.788	77%	0.771	S	S	*	*			trans	-63.4	131.3	131.7	177	0	0	0	0	106.6
1096	D	26.3	Very low	26.6	Very low	154 Å²	154	133.9 Å²	133.9	82%	0.824	77%	0.774	S	S	*	*			trans	-124.5	144.9	161	-123.7	-36.5	0	0	0	109.4
1097	L	25.1	Very low	26.5	Very low	157 Å²	157	135.7 Å²	135.7	82%	0.822	78%	0.783	S	S	*	*			trans	-106.1	120.9	-170.4	-79	148.4	0	0	0	110.4
1098	C	26.5	Very low	26.7	Very low	136 Å²	136	135.6 Å²	135.6	92%	0.919	79%	0.786	S	S	*	*			trans	-141.4	144.3	155.9	-105.3	0	0	0	0	110.7
1099	S	24	Very low	26.8	Very low	103 Å²	103	137.6 Å²	137.6	72%	0.72	78%	0.782	S	S	*	*			trans	-102.3	162.3	-179.7	-55.6	0	0	0	0	111
1100	E	26.1	Very low	27	Very low	185 Å²	185	136.7 Å²	136.7	86%	0.864	79%	0.786	S	S	*	*			trans	69	153.2	161.8	-65.3	164.9	-156.3	0	0	115.1
1101	M	27.3	Very low	27.1	Very low	177 Å²	177	135.3 Å²	135.3	87%	0.872	78%	0.778	S	S	*	*			cis	-124.8	176.9	9.3	-76	-172	73.4	0	0	113.5
1102	L	26.4	Very low	27.2	Very low	160 Å²	160	140.7 Å²	140.7	84%	0.838	79%	0.792	S	S	*	*			trans	-79.7	150	173.2	-60.7	151	0	0	0	112.2
1103	D	27.7	Very low	27.4	Very low	141 Å²	141	139.8 Å²	139.8	75%	0.754	79%	0.789	S	S	*	*			trans	-130.2	113.8	149.4	-169.7	-14	0	0	0	110.3
1104	P	26.6	Very low	27.4	Very low	117 Å²	117	144.2 Å²	144.2	76%	0.76	80%	0.799	S	S	*	*			trans	-106.3	88.4	-177.8	37.6	-29.7	0	0	0	113
1105	S	28.8	Very low	27.7	Very low	85 Å²	85	145.3 Å²	145.3	59%	0.594	80%	0.804	S	S	*	*			trans	-147.6	105.4	169.6	56.8	0	0	0	0	115.3
1106	N	32.6	Very low	27.9	Very low	166 Å²	166	142.4 Å²	142.4	89%	0.888	80%	0.8	S	S	*	*				169.5	93.8	128.1	-92.8	-63.2	0	0	0	111.1
1107	L	25.4	Very low	27.9	Very low	178 Å²	178	144.6 Å²	144.6	93%	0.932	80%	0.802	S	S	*	*			trans	-135.4	113.6	169.8	-127.3	177.7	0	0	0	107.5
1108	S	31.8	Very low	28.2	Very low	97 Å²	97	145.1 Å²	145.1	68%	0.678	81%	0.806	S	S	*	*			trans	-151.7	125.5	171.1	87.7	0	0	0	0	113.9
1109	H	30.6	Very low	28.2	Very low	170 Å²	170	146.1 Å²	146.1	79%	0.787	80%	0.797	S	S	*	*			trans	80	118.3	151.3	-69.7	-63.3	0	0	0	123
1110	V	28	Very low	28.5	Very low	128 Å²	128	146.7 Å²	146.7	78%	0.776	79%	0.792	S	S	*	*				85.9	127.1	127.7	169.7	0	0	0	0	117.4
1111	V	28.2	Very low	28.6	Very low	119 Å²	119	144.3 Å²	144.3	72%	0.721	79%	0.786	S	S	*	*			cis	-155.8	157.7	-12.7	116.6	0	0	0	0	108.8
1112	Y	24.6	Very low	28.7	Very low	228 Å²	228	140.7 Å²	140.7	89%	0.894	78%	0.778	S	S	*	*			trans	-104.9	157.3	171.6	-95.1	-88.2	0	0	0	112.3
1113	S	29.9	Very low	28.8	Very low	110 Å²	110	137.6 Å²	137.6	77%	0.769	77%	0.77	S	S	*	*			trans	-147.2	133.9	165.3	-62.7	0	0	0	0	109.8
1114	E	26.7	Very low	29	Very low	181 Å²	181	137.6 Å²	137.6	85%	0.846	77%	0.769	S	S	*	*			trans	-85.1	178.9	179.9	-56.8	-173.9	148.6	0	0	111.7
1115	P	34.6	Very low	29.1	Very low	130 Å²	130	138.5 Å²	138.5	84%	0.844	77%	0.768	S	S	*	*				-145	139.5	100	36.4	-21.7	0	0	0	116.6
1116	G	29.9	Very low	29.2	Very low	68 Å²	68	140 Å²	140	70%	0.701	77%	0.773	S	S	*	*				66.4	110.3	107	0	0	0	0	0	119.6
1117	K	25	Very low	28.9	Very low	200 Å²	200	139.5 Å²	139.5	87%	0.87	77%	0.769	S	S	*	*			trans	-72	153.9	159.1	-59.8	174.4	179.6	177.6	0	111.2
1118	N	31.9	Very low	29.2	Very low	169 Å²	169	136 Å²	136	90%	0.904	76%	0.759	S	S	*	*			trans	-161	167.1	136.3	-106.1	-22.2	0	0	0	111.6
1119	E	26.3	Very low	29.2	Very low	156 Å²	156	135.9 Å²	135.9	73%	0.729	76%	0.759	S	S	*	*			trans	-116.8	-177.1	-157.9	-58.6	175.3	155.6	0	0	114.3
1120	N	30.8	Very low	29.1	Very low	115 Å²	115	134.7 Å²	134.7	62%	0.615	76%	0.757	S	S	*	*			trans	90.7	98.5	146.1	-65.5	-47.9	0	0	0	121.2
1121	N	27.9	Very low	29.1	Very low	136 Å²	136	136.6 Å²	136.6	73%	0.727	76%	0.757	S	S	*	*				91.6	152.9	112.8	-67	-22	0	0	0	124
1122	S	28.4	Very low	29	Very low	101 Å²	101	135.9 Å²	135.9	71%	0.706	76%	0.757	S	S	*	*			trans	68.7	101.9	154	45.2	0	0	0	0	120.2
1123	S	28.3	Very low	29.2	Very low	95 Å²	95	134.1 Å²	134.1	66%	0.664	76%	0.757	S	S	*	*				28.9	135.4	116.8	60.3	0	0	0	0	119.9
1124	D	32.3	Very low	29	Very low	140 Å²	140	133.9 Å²	133.9	75%	0.749	76%	0.756	S	S	*	*				-162.7	173.4	85.6	-124.7	-56.8	0	0	0	116.2
1125	N	30.2	Very low	29.2	Very low	137 Å²	137	134.4 Å²	134.4	73%	0.733	76%	0.755	S	S	*	*			trans	-80.8	172.7	-165.4	-70.2	-88.8	0	0	0	115.8
1126	T	29.7	Very low	28.7	Very low	115 Å²	115	136 Å²	136	71%	0.706	76%	0.757	S	S	*	*				130.5	95.3	125.7	-47.1	0	0	0	0	117
1127	I	27.6	Very low	28.8	Very low	156 Å²	156	138 Å²	138	80%	0.8	76%	0.758	S	S	*	*				39.2	123.5	127.9	-52.8	168.6	0	0	0	119.2
1128	S	31.1	Very low	28.8	Very low	104 Å²	104	137.6 Å²	137.6	73%	0.727	76%	0.756	S	S	*	*				179	159.3	109.1	58.7	0	0	0	0	116.6
1129	S	31.8	Very low	28.6	Very low	96 Å²	96	135.1 Å²	135.1	67%	0.671	75%	0.746	S	S	*	*			trans	82.3	84.2	146.9	-58.3	0	0	0	0	122.6
1130	I	28.4	Very low	28.5	Very low	144 Å²	144	134.2 Å²	134.2	74%	0.738	75%	0.746	S	S	*	*				77.2	115.2	106.3	-72.8	163.1	0	0	0	121
1131	Q	28.6	Very low	28.5	Very low	169 Å²	169	134.8 Å²	134.8	79%	0.79	75%	0.748	S	S	*	*			trans	66	99.3	140.5	-68.6	174.4	-1.9	0	0	122.5
1132	S	25.4	Very low	28.4	Very low	103 Å²	103	134.8 Å²	134.8	72%	0.72	75%	0.747	S	S	*	*				47.3	120.1	122.4	66.5	0	0	0	0	121.6
1133	Q	29	Very low	28.4	Very low	191 Å²	191	139 Å²	139	89%	0.893	75%	0.753	S	S	*	*				-156.8	151.4	118.2	-115.9	168.8	75.4	0	0	112.1
1134	S	25.5	Very low	28.5	Very low	106 Å²	106	141.9 Å²	141.9	74%	0.741	76%	0.761	S	S	*	*			trans	-91.9	140.3	-176	52.1	0	0	0	0	113
1135	K	30	Very low	28.3	Very low	192 Å²	192	138.1 Å²	138.1	84%	0.835	76%	0.755	S	S	*	*			trans	-171.8	121.5	153.1	-103.4	144.8	-171.9	170.7	0	111	P1137	K1135-P1137 WeakPolarHBondContact O-CD 3.08Å
1136	N	25.7	Very low	28.4	Very low	163 Å²	163	138.9 Å²	138.9	87%	0.872	76%	0.759	S	S	*	*			trans	-72.2	126.2	170.5	-65.7	-4.6	0	0	0	109.9
1137	P	30.6	Very low	28.6	Very low	111 Å²	111	138.4 Å²	138.4	72%	0.721	75%	0.752	S	S	*	*			trans	-77.9	119.9	167.4	30.7	-30.9	0	0	0	110	K1135 V1139	K1135-P1137 WeakPolarHBondContact O-CD 3.08Å; P1137-V1139 PolarHBondContact O-N 2.86Å
1138	K	25.9	Very low	29.1	Very low	190 Å²	190	137 Å²	137	83%	0.826	75%	0.746	S	S	*	*			trans	-73.5	107.2	163.7	-77.4	-173.9	175.1	-176.1	0	108.8	N1140	K1138-N1140 PolarHBondContact O-N 2.75Å
1139	V	27.8	Very low	29.4	Very low	117 Å²	117	138.3 Å²	138.3	71%	0.709	74%	0.741	S	S	*	*			trans	-80.1	85.6	175.1	179.4	0	0	0	0	109.7	P1137 I1141	P1137-V1139 PolarHBondContact O-N 2.86Å; V1139-I1141 HydrophobicContact CG1-CD1 4.12Å; V1139-I1141 HydrophobicContact CG1-CG1 3.9Å; V1139-I1141 PolarHBondContact O-N 2.99Å
1140	N	24.3	Very low	29.6	Very low	137 Å²	137	139.9 Å²	139.9	73%	0.733	74%	0.738	S	S	*	*			trans	-81.9	102.9	168.1	-80.1	-8.5	0	0	0	109.4	K1138	K1138-N1140 PolarHBondContact O-N 2.75Å
1141	I	29.3	Very low	29.9	Very low	127 Å²	127	136.6 Å²	136.6	65%	0.651	72%	0.721	S	S	*	*			trans	-89.2	113.8	170.4	-64.7	172.4	0	0	0	109	V1139 F1143	V1139-I1141 HydrophobicContact CG1-CD1 4.12Å; V1139-I1141 HydrophobicContact CG1-CG1 3.9Å; V1139-I1141 PolarHBondContact O-N 2.99Å; I1141-F1143 HydrophobicContact CG2-CE2 4.37Å
1142	I	27.7	Very low	30.3	Very low	136 Å²	136	131.3 Å²	131.3	70%	0.697	71%	0.706	S	S	*	*			trans	-95.8	114.3	179.3	-62.7	172.4	0	0	0	109	N1144	I1142-N1144 PolarHBondContact O-N 2.82Å; I1142-N1144 VanDerWaalsContact O-N 3.1Å
1143	F	26.8	Very low	30.8	Very low	190 Å²	190	129.4 Å²	129.4	83%	0.833	69%	0.693	S	S	*	*			trans	-77.6	90.1	176.5	-73	-86.2	0	0	0	112	I1141 G1145	I1141-F1143 HydrophobicContact CG2-CE2 4.37Å; F1143-G1145 PolarHBondContact O-N 2.85Å
1144	N	30.8	Very low	31	Very low	155 Å²	155	126 Å²	126	83%	0.829	68%	0.68	S	S	*	*			trans	-83.9	95.7	163.8	-83.8	-13.9	0	0	0	109.9	I1142	I1142-N1144 PolarHBondContact O-N 2.82Å; I1142-N1144 VanDerWaalsContact O-N 3.1Å
1145	G	28.2	Very low	31.7	Very low	61 Å²	61	130.5 Å²	130.5	63%	0.629	68%	0.68	S	S	*	*			trans	-78.8	141.5	178.4	0	0	0	0	0	113.7	F1143	F1143-G1145 PolarHBondContact O-N 2.85Å
1146	N	31.7	Very low	32.3	Very low	154 Å²	154	125.9 Å²	125.9	82%	0.824	67%	0.672	S	S	*	*			trans	-173.5	-20.5	147.2	-98	-27.8	0	0	0	114	N1148	N1146-N1148 PolarHBondContact O-N 3Å
1147	N	35.6	Very low	33.1	Very low	105 Å²	105	128.1 Å²	128.1	56%	0.561	67%	0.669	S	S	*	*			trans	-88.1	100.8	-178.3	-71.8	-2.8	0	0	0	112.6	E1149	N1147-E1149 VanDerWaalsContact C-N 3.27Å; N1147-E1149 PolarHBondContact O-N 3.17Å
1148	N	37.1	Very low	33.7	Very low	126 Å²	126	126.4 Å²	126.4	67%	0.674	66%	0.658	S	S	*	*	H	α-helix	trans	-65	-25.7	178.4	-76.5	-51.1	0	0	0	114.1	N1146 I1151 A1152	N1146-N1148 PolarHBondContact O-N 3Å; N1148-I1151 PolarHBondContact O-N 3.21Å; N1148-A1152 PolarHBondContact O-N 3.26Å
1149	E	37.2	Very low	34.6	Very low	132 Å²	132	121.1 Å²	121.1	62%	0.617	64%	0.642	S	S	*	*	H	α-helix	trans	-73	-39.5	-174.6	-67.3	166.4	145.8	0	0	112.5	N983 N1147 I1151 A1152 S1153	N983-E1149 PolarHBondContact ND2-OE1 2.7Å; N1147-E1149 VanDerWaalsContact C-N 3.27Å; N1147-E1149 PolarHBondContact O-N 3.17Å; E1149-I1151 VanDerWaalsContact C-N 3.28Å; E1149-I1151 PolarHBondContact O-N 3.21Å; E1149-A1152 WeakPolarHBondContact O-CB 3.47Å; E1149-A1152 PolarHBondContact O-N 2.93Å; E1149-A1152 VanDerWaalsContact O-N 3.11Å; E1149-S1153 PolarHBondContact O-N 2.91Å
1150	Q	35.4	Very low	35.4	Very low	129 Å²	129	119.3 Å²	119.3	60%	0.603	63%	0.631	S	S	*	*	H	α-helix	trans	-62.8	-37	171.6	-75.7	177.5	-38.2	0	0	111.5	A1152 S1153 I1154	Q1150-A1152 VanDerWaalsContact C-N 3.3Å; Q1150-A1152 PolarHBondContact O-N 2.9Å; Q1150-S1153 PolarHBondContact O-N 2.85Å; Q1150-I1154 WeakPolarHBondContact O-CG1 3.48Å; Q1150-I1154 PolarHBondContact O-N 2.86Å
1151	I	35.4	Very low	36.5	Very low	74 Å²	74	119.3 Å²	119.3	38%	0.379	63%	0.627	S	S	.	*	H	α-helix	trans	-66.9	-32.4	175.3	-57.8	174.3	0	0	0	110.9	N1148 E1149 R1155	N1148-I1151 PolarHBondContact O-N 3.21Å; E1149-I1151 VanDerWaalsContact C-N 3.28Å; E1149-I1151 PolarHBondContact O-N 3.21Å; I1151-R1155 VanDerWaalsContact CG2-CZ 3.48Å; I1151-R1155 WeakPolarHBondContact O-CB 3.34Å; I1151-R1155 WeakPolarHBondContact O-CD 3.39Å; I1151-R1155 WeakPolarHBondContact O-CG 3.33Å; I1151-R1155 PolarHBondContact O-N 2.98Å
1152	A	36.9	Very low	37.5	Very low	59 Å²	59	117.1 Å²	117.1	49%	0.488	62%	0.616	S	S	.	*	H	α-helix	trans	-70	-40.6	172.8	0	0	0	0	0	112.5	N1148 E1149 Q1150 R1155	N1148-A1152 PolarHBondContact O-N 3.26Å; E1149-A1152 WeakPolarHBondContact O-CB 3.47Å; E1149-A1152 PolarHBondContact O-N 2.93Å; E1149-A1152 VanDerWaalsContact O-N 3.11Å; Q1150-A1152 VanDerWaalsContact C-N 3.3Å; Q1150-A1152 PolarHBondContact O-N 2.9Å; A1152-R1155 PolarHBondContact O-N 3.47Å
1153	S	35.2	Very low	38.3	Very low	62 Å²	62	113.5 Å²	113.5	43%	0.434	60%	0.601	S	S	.	*	H	α-helix	trans	-65.4	-37.9	178.1	-170.1	0	0	0	0	113.1	E1149 Q1150 S1156	E1149-S1153 PolarHBondContact O-N 2.91Å; Q1150-S1153 PolarHBondContact O-N 2.85Å; S1153-S1156 PolarHBondContact O-OG 2.71Å
1154	I	34.4	Very low	39.6	Very low	121 Å²	121	108.8 Å²	108.8	62%	0.621	58%	0.583	S	S	*	*	H	α-helix	trans	-71.5	-35.5	176.4	-66	167.2	0	0	0	111.3	Q1150 S1156 R1157	Q1150-I1154 WeakPolarHBondContact O-CG1 3.48Å; Q1150-I1154 PolarHBondContact O-N 2.86Å; I1154-S1156 PolarHBondContact O-N 2.93Å; I1154-R1157 PolarHBondContact O-N 2.83Å
1155	R	39.7	Very low	40.7	Very low	200 Å²	200	106.6 Å²	106.6	76%	0.755	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	-8.1	179	-83.1	171.3	177.4	155.1	2.3	115.5	I1151 A1152	I1151-R1155 VanDerWaalsContact CG2-CZ 3.48Å; I1151-R1155 WeakPolarHBondContact O-CB 3.34Å; I1151-R1155 WeakPolarHBondContact O-CD 3.39Å; I1151-R1155 WeakPolarHBondContact O-CG 3.33Å; I1151-R1155 PolarHBondContact O-N 2.98Å; A1152-R1155 PolarHBondContact O-N 3.47Å
1156	S	42.1	Very low	42	Very low	95 Å²	95	110 Å²	110	66%	0.664	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	-4.4	178.8	63.2	0	0	0	0	114.6	S1153 I1154	S1153-S1156 PolarHBondContact O-OG 2.71Å; I1154-S1156 PolarHBondContact O-N 2.93Å
1157	R	43.9	Very low	43	Very low	210 Å²	210	106.6 Å²	106.6	79%	0.792	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126	-5.6	-167.7	-76.1	-178.5	169.5	177.1	-5	116.7	I1154	I1154-R1157 PolarHBondContact O-N 2.83Å
1158	C	42.4	Very low	44.2	Very low	75 Å²	75	104 Å²	104	51%	0.507	54%	0.539	S	S	.	.			trans	-139.2	130.9	175.5	-174.4	0	0	0	0	110.4
1159	T	45.2	Very low	45.3	Very low	78 Å²	78	102.3 Å²	102.3	48%	0.479	53%	0.526	S	S	.	.			trans	-106.4	164.3	176.2	75.6	0	0	0	0	110.6	Q1161 D1162 V1163	T1159-Q1161 PolarHBondContact O-N 3.08Å; T1159-Q1161 WeakPolarHBondContact OG1-CB 3.39Å; T1159-Q1161 PolarHBondContact OG1-N 2.66Å; T1159-D1162 WeakPolarHBondContact CA-OD2 3.45Å; T1159-D1162 VanDerWaalsContact CB-OD2 3.27Å; T1159-D1162 WeakPolarHBondContact CB-OD2 3.24Å; T1159-D1162 PolarHBondContact N-OD2 3.38Å; T1159-D1162 PolarHBondContact O-N 2.99Å; T1159-D1162 VanDerWaalsContact OG1-CG 3.27Å; T1159-D1162 PolarHBondContact OG1-N 3.4Å; T1159-D1162 PolarHBondContact OG1-OD2 3.47Å; T1159-V1163 PolarHBondContact O-N 3.12Å
1160	V	43.7	Very low	46.3	Very low	80 Å²	80	99.6 Å²	99.6	49%	0.485	52%	0.519	S	S	.	.	H	α-helix	trans	-63.1	-27.4	173.6	-179.1	0	0	0	0	111.2	V1163 I1164	V1160-V1163 PolarHBondContact O-N 3.33Å; V1160-I1164 HydrophobicContact CG1-CD1 3.78Å; V1160-I1164 HydrophobicContact CG1-CG1 4.23Å; V1160-I1164 WeakPolarHBondContact O-CB 3.11Å; V1160-I1164 VanDerWaalsContact O-CG1 3.32Å; V1160-I1164 WeakPolarHBondContact O-CG1 3.41Å; V1160-I1164 PolarHBondContact O-N 3.04Å
1161	Q	47.5	Very low	47.1	Very low	136 Å²	136	97.4 Å²	97.4	64%	0.636	51%	0.51	S	S	*	.	H	α-helix	trans	-63.6	-43.1	176.2	-140.7	73.6	19.8	0	0	111.6	T1159 V1163 I1164 Q1165	T1159-Q1161 PolarHBondContact O-N 3.08Å; T1159-Q1161 WeakPolarHBondContact OG1-CB 3.39Å; T1159-Q1161 PolarHBondContact OG1-N 2.66Å; Q1161-V1163 VanDerWaalsContact C-N 3.34Å; Q1161-V1163 PolarHBondContact O-N 2.76Å; Q1161-I1164 PolarHBondContact O-N 2.9Å; Q1161-Q1165 WeakPolarHBondContact O-CB 3.32Å; Q1161-Q1165 PolarHBondContact O-N 2.99Å
1162	D	49.9	Very low	48	Very low	81 Å²	81	98.6 Å²	98.6	43%	0.433	52%	0.517	S	S	.	.	H	α-helix	trans	-64	-41	-179.2	-49.6	-58.6	0	0	0	110.9	T1159 Q1165 E1166	T1159-D1162 WeakPolarHBondContact CA-OD2 3.45Å; T1159-D1162 VanDerWaalsContact CB-OD2 3.27Å; T1159-D1162 WeakPolarHBondContact CB-OD2 3.24Å; T1159-D1162 PolarHBondContact N-OD2 3.38Å; T1159-D1162 PolarHBondContact O-N 2.99Å; T1159-D1162 VanDerWaalsContact OG1-CG 3.27Å; T1159-D1162 PolarHBondContact OG1-N 3.4Å; T1159-D1162 PolarHBondContact OG1-OD2 3.47Å; D1162-Q1165 PolarHBondContact O-N 2.98Å; D1162-E1166 WeakPolarHBondContact O-CB 3.48Å; D1162-E1166 PolarHBondContact O-N 3.23Å
1163	V	46.2	Very low	48.4	Very low	61 Å²	61	101.4 Å²	101.4	37%	0.37	52%	0.52	S	S	.	.	H	α-helix	trans	-70.1	-40.3	177	-178.6	0	0	0	0	111.9	T1159 V1160 Q1161 Q1165 I1167	T1159-V1163 PolarHBondContact O-N 3.12Å; V1160-V1163 PolarHBondContact O-N 3.33Å; Q1161-V1163 VanDerWaalsContact C-N 3.34Å; Q1161-V1163 PolarHBondContact O-N 2.76Å; V1163-Q1165 VanDerWaalsContact C-N 3.29Å; V1163-Q1165 PolarHBondContact O-N 2.77Å; V1163-I1167 HydrophobicContact CG1-CD1 3.95Å; V1163-I1167 WeakPolarHBondContact O-CB 3.11Å; V1163-I1167 VanDerWaalsContact O-CG1 3.27Å; V1163-I1167 WeakPolarHBondContact O-CG1 3.49Å; V1163-I1167 PolarHBondContact O-N 2.74Å
1164	I	54.1	Low	48.8	Very low	90 Å²	90	102.3 Å²	102.3	46%	0.462	52%	0.523	S	S	.	.	H	α-helix	trans	-64.1	-38.6	173.8	-72.7	173	0	0	0	110.3	V1160 Q1161 S1168	V1160-I1164 HydrophobicContact CG1-CD1 3.78Å; V1160-I1164 HydrophobicContact CG1-CG1 4.23Å; V1160-I1164 WeakPolarHBondContact O-CB 3.11Å; V1160-I1164 VanDerWaalsContact O-CG1 3.32Å; V1160-I1164 WeakPolarHBondContact O-CG1 3.41Å; V1160-I1164 PolarHBondContact O-N 3.04Å; Q1161-I1164 PolarHBondContact O-N 2.9Å; I1164-S1168 WeakPolarHBondContact O-CB 3.44Å; I1164-S1168 PolarHBondContact O-N 2.83Å; I1164-S1168 PolarHBondContact O-OG 2.86Å
1165	Q	53.8	Low	49.3	Very low	110 Å²	110	103.6 Å²	103.6	51%	0.514	52%	0.524	S	S	.	.	H	α-helix	trans	-68.6	-46.2	177.5	-177.5	160.9	-16.8	0	0	111.6	Q1161 D1162 V1163 I1167 S1168 E1169	Q1161-Q1165 WeakPolarHBondContact O-CB 3.32Å; Q1161-Q1165 PolarHBondContact O-N 2.99Å; D1162-Q1165 PolarHBondContact O-N 2.98Å; V1163-Q1165 VanDerWaalsContact C-N 3.29Å; V1163-Q1165 PolarHBondContact O-N 2.77Å; Q1165-I1167 VanDerWaalsContact C-N 3.33Å; Q1165-I1167 PolarHBondContact O-N 3.19Å; Q1165-S1168 PolarHBondContact O-N 3.47Å; Q1165-S1168 VanDerWaalsContact O-N 3.12Å; Q1165-E1169 HydrophobicContact CG-CG 4.21Å; Q1165-E1169 VanDerWaalsContact CG-OE1 3.23Å; Q1165-E1169 WeakPolarHBondContact CG-OE1 3.48Å; Q1165-E1169 PolarHBondContact NE2-OE1 3.36Å; Q1165-E1169 WeakPolarHBondContact O-CB 3.26Å; Q1165-E1169 WeakPolarHBondContact O-CG 3.12Å; Q1165-E1169 PolarHBondContact O-N 2.84Å
1166	E	54.8	Low	49.5	Very low	132 Å²	132	97.7 Å²	97.7	62%	0.617	51%	0.51	S	S	*	.	H	α-helix	trans	-57.9	-42.9	175	-174.1	179.2	-161	0	0	112.1	D1162 T1170	D1162-E1166 WeakPolarHBondContact O-CB 3.48Å; D1162-E1166 PolarHBondContact O-N 3.23Å; E1166-T1170 WeakPolarHBondContact O-CB 3.4Å; E1166-T1170 PolarHBondContact O-N 2.68Å; E1166-T1170 PolarHBondContact O-OG1 2.96Å
1167	I	53.8	Low	49.5	Very low	83 Å²	83	97.9 Å²	97.9	43%	0.426	51%	0.511	S	S	.	.	H	α-helix	trans	-66.3	-42.7	174.8	-69.1	169.3	0	0	0	111.1	V1163 Q1165 T1170 I1171	V1163-I1167 HydrophobicContact CG1-CD1 3.95Å; V1163-I1167 WeakPolarHBondContact O-CB 3.11Å; V1163-I1167 VanDerWaalsContact O-CG1 3.27Å; V1163-I1167 WeakPolarHBondContact O-CG1 3.49Å; V1163-I1167 PolarHBondContact O-N 2.74Å; Q1165-I1167 VanDerWaalsContact C-N 3.33Å; Q1165-I1167 PolarHBondContact O-N 3.19Å; I1167-T1170 WeakPolarHBondContact O-CB 3.34Å; I1167-T1170 PolarHBondContact O-N 3.25Å; I1167-I1171 HydrophobicContact CG2-CD1 3.79Å; I1167-I1171 HydrophobicContact CG2-CG1 4.49Å; I1167-I1171 VanDerWaalsContact O-CG1 3.32Å; I1167-I1171 WeakPolarHBondContact O-CG1 3.36Å; I1167-I1171 PolarHBondContact O-N 2.85Å
1168	S	59.3	Low	49.2	Very low	51 Å²	51	94.8 Å²	94.8	36%	0.357	51%	0.51	S	S	.	.	H	α-helix	trans	-66	-44.7	179.8	-61.7	0	0	0	0	111.7	I1164 Q1165 T1170 I1171 I1172	I1164-S1168 WeakPolarHBondContact O-CB 3.44Å; I1164-S1168 PolarHBondContact O-N 2.83Å; I1164-S1168 PolarHBondContact O-OG 2.86Å; Q1165-S1168 PolarHBondContact O-N 3.47Å; Q1165-S1168 VanDerWaalsContact O-N 3.12Å; S1168-T1170 VanDerWaalsContact C-N 3.32Å; S1168-T1170 PolarHBondContact O-N 3.09Å; S1168-I1171 PolarHBondContact O-N 3.46Å; S1168-I1172 WeakPolarHBondContact O-CB 3.26Å; S1168-I1172 WeakPolarHBondContact O-CD1 3.5Å; S1168-I1172 WeakPolarHBondContact O-CG1 3.49Å; S1168-I1172 PolarHBondContact O-N 2.9Å
1169	E	60.4	Low	48.7	Very low	90 Å²	90	99.9 Å²	99.9	42%	0.421	52%	0.523	S	S	.	.	H	α-helix	trans	-61.2	-40.9	173.6	-73	178.2	-167.2	0	0	110.9	Q1165 I1172 Q1173	Q1165-E1169 HydrophobicContact CG-CG 4.21Å; Q1165-E1169 VanDerWaalsContact CG-OE1 3.23Å; Q1165-E1169 WeakPolarHBondContact CG-OE1 3.48Å; Q1165-E1169 PolarHBondContact NE2-OE1 3.36Å; Q1165-E1169 WeakPolarHBondContact O-CB 3.26Å; Q1165-E1169 WeakPolarHBondContact O-CG 3.12Å; Q1165-E1169 PolarHBondContact O-N 2.84Å; E1169-I1172 PolarHBondContact O-N 3.36Å; E1169-Q1173 VanDerWaalsContact O-CB 3.28Å; E1169-Q1173 WeakPolarHBondContact O-CB 3.33Å; E1169-Q1173 WeakPolarHBondContact O-CG 3.24Å; E1169-Q1173 PolarHBondContact O-N 3.02Å
1170	T	57.7	Low	48	Very low	74 Å²	74	104.4 Å²	104.4	45%	0.454	54%	0.536	S	S	.	.	H	α-helix	trans	-62.6	-43	173.9	-58.4	0	0	0	0	112.2	E1166 I1167 S1168 T1174	E1166-T1170 WeakPolarHBondContact O-CB 3.4Å; E1166-T1170 PolarHBondContact O-N 2.68Å; E1166-T1170 PolarHBondContact O-OG1 2.96Å; I1167-T1170 WeakPolarHBondContact O-CB 3.34Å; I1167-T1170 PolarHBondContact O-N 3.25Å; S1168-T1170 VanDerWaalsContact C-N 3.32Å; S1168-T1170 PolarHBondContact O-N 3.09Å; T1170-T1174 WeakPolarHBondContact O-CB 3.41Å; T1170-T1174 PolarHBondContact O-N 2.93Å; T1170-T1174 PolarHBondContact O-OG1 3.35Å
1171	I	53.9	Low	47.3	Very low	83 Å²	83	105.9 Å²	105.9	43%	0.426	55%	0.547	S	S	.	.	H	α-helix	trans	-68.3	-39.1	177.5	-70.2	168.4	0	0	0	110.9	I1167 S1168 T1174 K1175	I1167-I1171 HydrophobicContact CG2-CD1 3.79Å; I1167-I1171 HydrophobicContact CG2-CG1 4.49Å; I1167-I1171 VanDerWaalsContact O-CG1 3.32Å; I1167-I1171 WeakPolarHBondContact O-CG1 3.36Å; I1167-I1171 PolarHBondContact O-N 2.85Å; S1168-I1171 PolarHBondContact O-N 3.46Å; I1171-T1174 PolarHBondContact O-N 3.1Å; I1171-K1175 HydrophobicContact CG2-CD 4.22Å; I1171-K1175 WeakPolarHBondContact O-CB 3.34Å; I1171-K1175 WeakPolarHBondContact O-CG 3.42Å; I1171-K1175 PolarHBondContact O-N 2.56Å
1172	I	52.4	Low	46.6	Very low	100 Å²	100	107.3 Å²	107.3	51%	0.513	55%	0.554	S	S	.	*	H	α-helix	trans	-67.3	-44.9	176.2	-70.8	164.7	0	0	0	110.5	S1168 E1169 T1174 K1175 T1176	S1168-I1172 WeakPolarHBondContact O-CB 3.26Å; S1168-I1172 WeakPolarHBondContact O-CD1 3.5Å; S1168-I1172 WeakPolarHBondContact O-CG1 3.49Å; S1168-I1172 PolarHBondContact O-N 2.9Å; E1169-I1172 PolarHBondContact O-N 3.36Å; I1172-T1174 VanDerWaalsContact C-N 3.28Å; I1172-T1174 PolarHBondContact O-N 3.39Å; I1172-K1175 PolarHBondContact O-N 3Å; I1172-T1176 HydrophobicContact CG2-CG2 4.37Å; I1172-T1176 WeakPolarHBondContact O-CB 3.35Å; I1172-T1176 WeakPolarHBondContact O-CG2 3.43Å; I1172-T1176 PolarHBondContact O-N 2.84Å; I1172-T1176 PolarHBondContact O-OG1 2.9Å
1173	Q	45.5	Very low	45.6	Very low	118 Å²	118	108.6 Å²	108.6	55%	0.551	57%	0.565	S	S	*	*	H	α-helix	trans	-59	-39	172.2	-75.4	176.4	22.4	0	0	111.5	E1169 T1176 S1177	E1169-Q1173 VanDerWaalsContact O-CB 3.28Å; E1169-Q1173 WeakPolarHBondContact O-CB 3.33Å; E1169-Q1173 WeakPolarHBondContact O-CG 3.24Å; E1169-Q1173 PolarHBondContact O-N 3.02Å; Q1173-T1176 WeakPolarHBondContact CA-OG1 3.2Å; Q1173-T1176 PolarHBondContact O-OG1 3.05Å; Q1173-S1177 WeakPolarHBondContact O-CB 3.39Å; Q1173-S1177 PolarHBondContact O-N 2.96Å; Q1173-S1177 PolarHBondContact O-OG 3.41Å
1174	T	44.2	Very low	44.9	Very low	81 Å²	81	112.7 Å²	112.7	50%	0.497	58%	0.583	S	S	.	*	H	α-helix	trans	-68.3	-44.9	176.5	-54.4	0	0	0	0	111.6	T1170 I1171 I1172 L1178	T1170-T1174 WeakPolarHBondContact O-CB 3.41Å; T1170-T1174 PolarHBondContact O-N 2.93Å; T1170-T1174 PolarHBondContact O-OG1 3.35Å; I1171-T1174 PolarHBondContact O-N 3.1Å; I1172-T1174 VanDerWaalsContact C-N 3.28Å; I1172-T1174 PolarHBondContact O-N 3.39Å; T1174-L1178 PolarHBondContact O-N 2.92Å
1175	K	45.1	Very low	43.7	Very low	147 Å²	147	116.5 Å²	116.5	64%	0.639	60%	0.599	S	S	*	*	H	α-helix	trans	-67.6	-33.3	177.3	-75.8	178.4	177.4	176.6	0	113.1	I1171 I1172	I1171-K1175 HydrophobicContact CG2-CD 4.22Å; I1171-K1175 WeakPolarHBondContact O-CB 3.34Å; I1171-K1175 WeakPolarHBondContact O-CG 3.42Å; I1171-K1175 PolarHBondContact O-N 2.56Å; I1172-K1175 PolarHBondContact O-N 3Å
1176	T	43.2	Very low	42.5	Very low	76 Å²	76	118.9 Å²	118.9	47%	0.466	62%	0.615	S	S	.	*	H	α-helix	trans	-81.8	-30.6	176.6	51	0	0	0	0	112.8	I1172 Q1173 L1178 K1179	I1172-T1176 HydrophobicContact CG2-CG2 4.37Å; I1172-T1176 WeakPolarHBondContact O-CB 3.35Å; I1172-T1176 WeakPolarHBondContact O-CG2 3.43Å; I1172-T1176 PolarHBondContact O-N 2.84Å; I1172-T1176 PolarHBondContact O-OG1 2.9Å; Q1173-T1176 WeakPolarHBondContact CA-OG1 3.2Å; Q1173-T1176 PolarHBondContact O-OG1 3.05Å; T1176-L1178 PolarHBondContact O-N 3.05Å; T1176-K1179 CarbonylContact O-C 3.56Å; T1176-K1179 VanDerWaalsContact O-C 3.29Å; T1176-K1179 PolarHBondContact O-N 3.02Å
1177	S	42.8	Very low	41.2	Very low	99 Å²	99	116.6 Å²	116.6	69%	0.692	61%	0.613	S	S	*	*	H	α-helix	trans	-65.1	-21.5	170.4	-61.8	0	0	0	0	112.8	Q1173	Q1173-S1177 WeakPolarHBondContact O-CB 3.39Å; Q1173-S1177 PolarHBondContact O-N 2.96Å; Q1173-S1177 PolarHBondContact O-OG 3.41Å
1178	L	36.9	Very low	40.1	Very low	146 Å²	146	119.1 Å²	119.1	76%	0.764	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	2.3	170.9	-70.9	166.7	0	0	0	113.8	T1174 T1176	T1174-L1178 PolarHBondContact O-N 2.92Å; T1176-L1178 PolarHBondContact O-N 3.05Å
1179	K	33.3	Very low	38.8	Very low	181 Å²	181	124.2 Å²	124.2	79%	0.787	65%	0.649	S	S	*	*	S	Bend	trans	-141.2	80.8	178.7	-74.7	-166.5	172.7	-170.3	0	112.3	T1176	T1176-K1179 CarbonylContact O-C 3.56Å; T1176-K1179 VanDerWaalsContact O-C 3.29Å; T1176-K1179 PolarHBondContact O-N 3.02Å
1180	K	29	Very low	37.2	Very low	173 Å²	173	124.2 Å²	124.2	75%	0.752	66%	0.659	S	S	*	*			trans	-137.2	149.4	164.6	-93.4	-170.4	177.3	-172.8	0	108
1181	P	29.8	Very low	35.7	Very low	111 Å²	111	127.6 Å²	127.6	72%	0.721	67%	0.674	S	S	*	*			cis	-115	152.8	48.3	9.5	12.9	0	0	0	116.7
1182	E	33.4	Very low	34.5	Very low	167 Å²	167	131.6 Å²	131.6	78%	0.78	69%	0.692	S	S	*	*			trans	44	142.4	131.1	-59.4	168.9	179.9	0	0	122.3
1183	T	28.7	Very low	33.2	Very low	108 Å²	108	133.9 Å²	133.9	66%	0.663	70%	0.704	S	S	*	*			cis	-179.2	176.7	-43.9	21.3	0	0	0	0	107.5
1184	I	30.4	Very low	32.4	Very low	146 Å²	146	132.2 Å²	132.2	75%	0.749	71%	0.705	S	S	*	*			trans	75.8	89.9	170.8	-47.6	174	0	0	0	112
1185	E	29.2	Very low	31.9	Very low	170 Å²	170	137.3 Å²	137.3	79%	0.794	72%	0.723	S	S	*	*				63.3	122.8	74.7	-63.2	-168	163.2	0	0	115
1186	L	29.6	Very low	31.5	Very low	160 Å²	160	135.5 Å²	135.5	84%	0.838	73%	0.726	S	S	*	*				-168.3	151.1	101.4	-98.9	167.8	0	0	0	112.3
1187	S	27	Very low	31	Very low	84 Å²	84	136.7 Å²	136.7	59%	0.587	74%	0.738	S	S	*	*			trans	-63.3	152.3	180	52.4	0	0	0	0	115.1
1188	N	30.3	Very low	30.5	Very low	137 Å²	137	139.4 Å²	139.4	73%	0.733	74%	0.744	S	S	*	*				168.9	161.4	114.4	-88.7	-44.3	0	0	0	113.9
1189	I	31.7	Very low	30.4	Very low	157 Å²	157	137.8 Å²	137.8	81%	0.805	74%	0.736	S	S	*	*			trans	64.3	105.3	161.6	-63.4	148.8	0	0	0	114.8
1190	S	28.2	Very low	30.6	Very low	90 Å²	90	136.3 Å²	136.3	63%	0.629	73%	0.731	S	S	*	*				87.4	109.5	61.6	173.6	0	0	0	0	115.2
1191	N	25.9	Very low	30.7	Very low	145 Å²	145	133.8 Å²	133.8	78%	0.775	73%	0.731	S	S	*	*			trans	62.7	150.4	143	-70.5	-55.2	0	0	0	122.8
1192	Q	27.2	Very low	31	Very low	168 Å²	168	133.6 Å²	133.6	79%	0.785	73%	0.729	S	S	*	*			trans	82.2	124.9	153.1	-79.5	-179	38.5	0	0	122
1193	L	27	Very low	31	Very low	147 Å²	147	130.3 Å²	130.3	77%	0.77	73%	0.725	S	S	*	*			trans	68.7	161.4	141.1	-59.8	168.8	0	0	0	119.9
1194	S	27.6	Very low	31.4	Very low	83 Å²	83	131.8 Å²	131.8	58%	0.58	73%	0.728	S	S	*	*			cis	-173.8	131.2	-47.3	55.6	0	0	0	0	112.8
1195	H	34.7	Very low	31.4	Very low	189 Å²	189	130.2 Å²	130.2	88%	0.875	73%	0.725	S	S	*	*			trans	60.5	-173.2	151.1	-82.3	-46.1	0	0	0	116.9
1196	P	35.9	Very low	31.6	Very low	109 Å²	109	129.3 Å²	129.3	71%	0.708	73%	0.726	S	S	*	*			cis	-144.4	-156.1	13.4	46.3	-24.9	0	0	0	118
1197	S	32.2	Very low	31.6	Very low	101 Å²	101	127.1 Å²	127.1	71%	0.706	72%	0.719	S	S	*	*			trans	76.3	142.3	160.8	40	0	0	0	0	119.6
1198	L	32.9	Very low	31.9	Very low	155 Å²	155	127.8 Å²	127.8	81%	0.812	72%	0.723	S	S	*	*			cis	-166.7	178.2	-4.2	-109.7	170.8	0	0	0	107.8
1199	N	34.4	Very low	32	Very low	113 Å²	113	130.3 Å²	130.3	60%	0.604	73%	0.728	S	S	*	*			cis	-159	173.5	4.5	-158.9	-2.7	0	0	0	111.9
1200	H	36.8	Very low	31.9	Very low	150 Å²	150	129.5 Å²	129.5	69%	0.694	73%	0.73	S	S	*	*			trans	68.7	178.5	157.9	-75.6	-48.6	0	0	0	121.6
1201	T	32.9	Very low	32	Very low	120 Å²	120	132.2 Å²	132.2	74%	0.736	73%	0.733	S	S	*	*				-157.4	-138	-112	40.3	0	0	0	0	114.7
1202	P	36.2	Very low	32.2	Very low	106 Å²	106	133.3 Å²	133.3	69%	0.688	73%	0.731	S	S	*	*				-139.2	173.7	-115.2	44.6	-25.2	0	0	0	121.1
1203	S	32.1	Very low	32.2	Very low	98 Å²	98	134 Å²	134	69%	0.685	73%	0.731	S	S	*	*			trans	82.2	153.2	145	79.1	0	0	0	0	120.8
1204	N	36.6	Very low	32.2	Very low	139 Å²	139	134.7 Å²	134.7	74%	0.743	73%	0.732	S	S	*	*			cis	-151.3	139.4	20.8	-88.3	-63.1	0	0	0	117
1205	V	32.1	Very low	32.2	Very low	113 Å²	113	139.6 Å²	139.6	69%	0.685	74%	0.743	S	S	*	*				42.3	134.7	123	-169	0	0	0	0	124.1
1206	L	32.6	Very low	31.8	Very low	152 Å²	152	137.6 Å²	137.6	80%	0.796	73%	0.732	S	S	*	*				166.2	92.6	107.8	-150.5	140.7	0	0	0	120.5
1207	V	30.4	Very low	31.3	Very low	114 Å²	114	141.2 Å²	141.2	69%	0.691	74%	0.737	S	S	*	*				39.8	133.8	126.1	-178.3	0	0	0	0	126.3
1208	S	32.7	Very low	31	Very low	98 Å²	98	141.6 Å²	141.6	69%	0.685	73%	0.727	S	S	*	*			trans	79.1	160.2	148.8	69.7	0	0	0	0	122.2
1209	K	31.7	Very low	30.8	Very low	190 Å²	190	141.7 Å²	141.7	83%	0.826	73%	0.725	S	S	*	*			cis	-166	158	-13.1	-103.8	162.2	-172.2	169.4	0	107.7
1210	T	30.8	Very low	30.3	Very low	139 Å²	139	140.4 Å²	140.4	85%	0.853	73%	0.726	S	S	*	*				162.9	173.4	93	-47.4	0	0	0	0	110.8
1211	Q	30.2	Very low	29.9	Very low	148 Å²	148	140.4 Å²	140.4	69%	0.692	72%	0.723	S	S	*	*			trans	-122.1	168.1	-170.8	-55.7	177.9	-26.2	0	0	116.8
1212	K	30.1	Very low	29.7	Very low	167 Å²	167	142 Å²	142	73%	0.726	72%	0.723	S	S	*	*			trans	97.5	139.5	133.5	-94	160.3	-177.8	151.7	0	123.6
1213	K	27.3	Very low	29.1	Very low	184 Å²	184	147.7 Å²	147.7	80%	0.8	73%	0.732	S	S	*	*			trans	78.6	154.7	154.1	-71.3	173.7	178	179.1	0	117.3
1214	M	26.9	Very low	28.8	Very low	160 Å²	160	151.7 Å²	151.7	79%	0.788	74%	0.737	S	S	*	*			cis	-154.2	147.7	11.9	-139.9	158.3	69.8	0	0	117.6
1215	K	27.2	Very low	28.3	Very low	186 Å²	186	151 Å²	151	81%	0.809	74%	0.74	S	S	*	*			trans	-0.7	153.3	156.9	-73	-176.8	170.2	-177.8	0	125.4
1216	K	25.5	Very low	28	Very low	148 Å²	148	154 Å²	154	64%	0.643	75%	0.748	S	S	*	*			trans	76.5	141.7	150.7	-82.1	-164.4	173.2	-142.7	0	117	E1218	K1216-E1218 WeakPolarHBondContact CE-OE2 3.08Å; K1216-E1218 IonicContact NZ-OE2 2.65Å; K1216-E1218 PolarHBondContact NZ-OE2 3.5Å
1217	F	26.1	Very low	27.9	Very low	185 Å²	185	156.3 Å²	156.3	81%	0.811	75%	0.752	S	S	*	*			cis	-137.6	-164.4	49.5	-125.2	-94.3	0	0	0	116.6
1218	E	25.9	Very low	27.7	Very low	108 Å²	108	155.6 Å²	155.6	51%	0.505	75%	0.75	S	S	.	*			trans	-129.7	151	-154.6	-69.9	161.9	86.8	0	0	115.6	K1216	K1216-E1218 WeakPolarHBondContact CE-OE2 3.08Å; K1216-E1218 IonicContact NZ-OE2 2.65Å; K1216-E1218 PolarHBondContact NZ-OE2 3.5Å
1219	M	27.8	Very low	27.3	Very low	157 Å²	157	160.1 Å²	160.1	77%	0.773	76%	0.757	S	S	*	*			trans	67.4	167.3	152	-68.2	168.7	83.4	0	0	116.9
1220	S	25.5	Very low	26.9	Very low	87 Å²	87	157.4 Å²	157.4	61%	0.608	76%	0.756	S	S	*	*			cis	-166.4	170.2	3.2	-119.8	0	0	0	0	108.2
1221	K	27.3	Very low	26.6	Very low	149 Å²	149	159.5 Å²	159.5	65%	0.648	76%	0.756	S	S	*	*			cis	-171.5	153.2	-4.8	-127.6	168.3	-172.9	175.5	0	110.7
1222	H	28	Very low	26.3	Very low	155 Å²	155	157.3 Å²	157.3	72%	0.718	75%	0.753	S	S	*	*			trans	68.4	157.5	160	-56.6	-39	0	0	0	117
1223	Y	24.7	Very low	26.1	Very low	224 Å²	224	156.8 Å²	156.8	88%	0.878	76%	0.758	S	S	*	*			cis	-136.5	-176.4	34.9	-132	-97.5	0	0	0	116.2
1224	K	25.6	Very low	26	Very low	183 Å²	183	155 Å²	155	80%	0.796	76%	0.757	S	S	*	*			trans	-96.4	157.5	-165.4	-74	179.7	174.9	178.9	0	116
1225	P	26.3	Very low	26	Very low	124 Å²	124	156.5 Å²	156.5	81%	0.805	76%	0.761	S	S	*	*			trans	-88.9	170.2	176.3	37.5	-37.7	0	0	0	114.4
1226	M	24.7	Very low	25.9	Very low	176 Å²	176	152.3 Å²	152.3	87%	0.867	75%	0.753	S	S	*	*			trans	-125.8	129.1	168.5	-70.7	-175.3	70.3	0	0	112.8
1227	K	30.6	Very low	25.8	Very low	201 Å²	201	151.4 Å²	151.4	87%	0.874	76%	0.76	S	S	*	*			trans	-109.2	155	145.8	-71.6	-173.9	175	-174.8	0	107
1228	P	27.1	Very low	25.7	Very low	99 Å²	99	147.7 Å²	147.7	64%	0.643	75%	0.752	S	S	*	*				-152.3	158.1	110.4	37	-20.3	0	0	0	116.7
1229	K	23.8	Very low	25.7	Very low	192 Å²	192	149.4 Å²	149.4	84%	0.835	76%	0.76	S	S	*	*			trans	54.7	114.6	142	-64.7	169.5	-175.2	-178.8	0	118.6
1230	V	23.8	Very low	25.6	Very low	134 Å²	134	149.2 Å²	149.2	81%	0.812	76%	0.755	S	S	*	*				70.3	116.9	69.7	172.7	0	0	0	0	113.3
1231	Q	24.2	Very low	25.6	Very low	183 Å²	183	151.8 Å²	151.8	86%	0.855	76%	0.757	S	S	*	*			trans	-143.9	134.9	137.9	-162	164	7.4	0	0	109.6
1232	V	23.7	Very low	25.8	Very low	101 Å²	101	151.9 Å²	151.9	61%	0.612	77%	0.765	S	S	*	*			trans	-107.3	139.8	178.2	172.5	0	0	0	0	107.9	L1234	V1232-L1234 HydrophobicContact CG1-CD1 4.2Å; V1232-L1234 HydrophobicContact CG1-CG 4.02Å
1233	N	26.3	Very low	25.7	Very low	157 Å²	157	149.1 Å²	149.1	84%	0.84	76%	0.759	S	S	*	*			trans	-123.5	89.4	163.9	-90.1	-10.2	0	0	0	109.4
1234	L	24.7	Very low	25.9	Very low	147 Å²	147	143.7 Å²	143.7	77%	0.77	75%	0.753	S	S	*	*			trans	-78.9	132	155.4	-74.9	156.3	0	0	0	107.4	V1232	V1232-L1234 HydrophobicContact CG1-CD1 4.2Å; V1232-L1234 HydrophobicContact CG1-CG 4.02Å
1235	H	26.6	Very low	25.9	Very low	191 Å²	191	141.4 Å²	141.4	88%	0.884	76%	0.755	S	S	*	*			trans	-155.5	152.5	147.3	-105	-79.9	0	0	0	109.6
1236	P	25.9	Very low	26.3	Very low	98 Å²	98	140.5 Å²	140.5	64%	0.636	75%	0.749	S	S	*	*			trans	-135.6	175	-144.8	41.4	-23.9	0	0	0	115.4
1237	V	23.6	Very low	26.6	Very low	129 Å²	129	140.7 Å²	140.7	78%	0.782	75%	0.748	S	S	*	*			trans	59.9	170.5	141.5	172.1	0	0	0	0	118.1
1238	V	24.2	Very low	26.3	Very low	107 Å²	107	139.6 Å²	139.6	65%	0.648	74%	0.743	S	S	*	*			trans	81.5	93.8	176.9	-162.2	0	0	0	0	115.4
1239	E	24.6	Very low	26.2	Very low	143 Å²	143	143.3 Å²	143.3	67%	0.668	75%	0.751	S	S	*	*				33.5	141	114.7	-43.5	161.5	-157.8	0	0	118.1
1240	K	25.9	Very low	26.4	Very low	153 Å²	153	138.7 Å²	138.7	67%	0.665	74%	0.744	S	S	*	*			cis	-154.6	147.3	46.4	-85.3	-171.6	177	-166.8	0	115.6
1241	E	26.5	Very low	26.7	Very low	141 Å²	141	140.9 Å²	140.9	66%	0.659	75%	0.747	S	S	*	*				15.5	118.8	122.5	-49.2	169.4	115.9	0	0	117.6	T1243	E1241-T1243 HydrophobicContact CB-CG2 4.23Å
1242	D	30.2	Very low	26.7	Very low	151 Å²	151	141 Å²	141	81%	0.807	75%	0.745	S	S	*	*				-153.2	102.8	111.7	-101.9	-30.1	0	0	0	107.9
1243	T	26.8	Very low	26.8	Very low	98 Å²	98	142 Å²	142	60%	0.601	75%	0.747	S	S	*	*				76.7	151.1	72.4	76.6	0	0	0	0	114.9	E1241	E1241-T1243 HydrophobicContact CB-CG2 4.23Å
1244	S	29.6	Very low	27	Very low	109 Å²	109	144.6 Å²	144.6	76%	0.762	75%	0.751	S	S	*	*			trans	76.3	135.9	177.2	77.6	0	0	0	0	118.1
1245	T	25.7	Very low	27.2	Very low	135 Å²	135	144.2 Å²	144.2	83%	0.828	75%	0.748	S	S	*	*			cis	-179	168.1	-37.6	19.8	0	0	0	0	105.9
1246	P	34.6	Very low	27.2	Very low	105 Å²	105	139.7 Å²	139.7	68%	0.682	74%	0.738	S	S	*	*			trans	-112.9	177.4	-156.5	42.5	-36.6	0	0	0	115.3
1247	H	31	Very low	27.3	Very low	181 Å²	181	143.6 Å²	143.6	84%	0.838	75%	0.745	S	S	*	*			trans	-164.7	129.1	147.9	-103.8	-78.8	0	0	0	106.4
1248	F	23.7	Very low	27.7	Very low	178 Å²	178	148.6 Å²	148.6	78%	0.781	75%	0.751	S	S	*	*			cis	65.9	98.3	27.8	-115.5	-78.2	0	0	0	115.3
1249	H	25.7	Very low	27.8	Very low	176 Å²	176	147.9 Å²	147.9	82%	0.815	75%	0.751	S	S	*	*			trans	65.3	120.5	155.1	-134.4	76.9	0	0	0	119.2
1250	S	26.7	Very low	28.1	Very low	96 Å²	96	147.1 Å²	147.1	67%	0.671	75%	0.752	S	S	*	*				155.6	113.9	125.1	-170.7	0	0	0	0	112.7
1251	M	29.7	Very low	28.2	Very low	179 Å²	179	146 Å²	146	88%	0.882	75%	0.748	S	S	*	*				174.5	118.7	105.8	-89.8	-156.5	176.6	0	0	111.7
1252	F	25.2	Very low	28.3	Very low	187 Å²	187	145 Å²	145	82%	0.82	75%	0.752	S	S	*	*			trans	-73.2	162.7	165.8	-114.2	-100.4	0	0	0	111.4
1253	N	25.9	Very low	28.1	Very low	120 Å²	120	145.1 Å²	145.1	64%	0.642	75%	0.745	S	S	*	*			trans	61.4	109.6	156.3	-67.4	-35.6	0	0	0	119.9
1254	K	31.1	Very low	28.3	Very low	212 Å²	212	147.1 Å²	147.1	92%	0.922	75%	0.752	S	S	*	*			trans	-149.6	65.6	136.2	-117.2	161.6	-169.5	170.3	0	115
1255	I	28.2	Very low	28.3	Very low	140 Å²	140	150.3 Å²	150.3	72%	0.718	75%	0.752	S	S	*	*				42.1	99.9	123.2	-58.6	178.5	0	0	0	117
1256	S	25.7	Very low	28.4	Very low	95 Å²	95	150.3 Å²	150.3	66%	0.664	75%	0.747	S	S	*	*				75.7	151.3	122.9	-148.7	0	0	0	0	121.9
1257	K	29	Very low	28.2	Very low	180 Å²	180	153.6 Å²	153.6	78%	0.783	75%	0.75	S	S	*	*			trans	60.1	108.6	163.3	-67.3	156.7	-173.9	177	0	117.4
1258	Y	31.2	Very low	28.1	Very low	235 Å²	235	149.6 Å²	149.6	92%	0.922	74%	0.743	S	S	*	*				-147.2	135.1	96.7	-103.3	-74.2	0	0	0	111.2
1259	S	27	Very low	28.6	Very low	92 Å²	92	150.2 Å²	150.2	64%	0.643	75%	0.745	S	S	*	*			trans	-110.9	139.3	170.6	173.3	0	0	0	0	108.5
1260	N	31.2	Very low	28.7	Very low	127 Å²	127	151.5 Å²	151.5	68%	0.679	75%	0.748	S	S	*	*				-179.9	140.3	121.8	-97.1	-57	0	0	0	113.4
1261	Q	27.3	Very low	28.9	Very low	128 Å²	128	152.5 Å²	152.5	60%	0.598	76%	0.756	S	S	*	*			trans	19	132.1	134.5	-53.2	-179.5	74.4	0	0	118
1262	V	29.6	Very low	28.8	Very low	121 Å²	121	155.1 Å²	155.1	73%	0.733	76%	0.756	S	S	*	*				-157.8	123.6	75.7	149.4	0	0	0	0	108.2
1263	K	25.9	Very low	29	Very low	154 Å²	154	150.8 Å²	150.8	67%	0.67	75%	0.748	S	S	*	*				63.1	150	73.9	-81.5	176.4	178.8	158.9	0	114.7
1264	L	29.8	Very low	29.2	Very low	140 Å²	140	154.1 Å²	154.1	73%	0.733	76%	0.757	S	S	*	*			trans	78.5	141.3	174.1	-44.7	175.5	0	0	0	116.2
1265	K	31.2	Very low	29.2	Very low	175 Å²	175	149.3 Å²	149.3	76%	0.761	75%	0.75	S	S	*	*			cis	-163.8	131.7	-27.2	-121.6	175.5	-163.3	164.7	0	110.3
1266	N	27.6	Very low	29.4	Very low	135 Å²	135	147.3 Å²	147.3	72%	0.722	75%	0.748	S	S	*	*			trans	45.5	125.6	130.7	-94.7	-24.1	0	0	0	123.4
1267	K	30	Very low	29.6	Very low	174 Å²	174	147.5 Å²	147.5	76%	0.757	75%	0.75	S	S	*	*				112.4	116.6	125.7	-77.7	167.4	178.1	-176.8	0	120.6
1268	S	29.2	Very low	29.8	Very low	98 Å²	98	144.5 Å²	144.5	69%	0.685	75%	0.747	S	S	*	*				53.2	145.9	127.4	78.7	0	0	0	0	120.6
1269	K	32.9	Very low	29.7	Very low	191 Å²	191	140.7 Å²	140.7	83%	0.83	74%	0.742	S	S	*	*			cis	-150	154.8	29	-64.6	168.2	-172	167.7	0	107.6
1270	K	28.8	Very low	29.9	Very low	202 Å²	202	141.3 Å²	141.3	88%	0.878	75%	0.747	S	S	*	*			cis	90.3	68.4	35.1	-160.2	-167.4	-176.6	-179.9	0	116.4
1271	S	29.9	Very low	30	Very low	118 Å²	118	140.3 Å²	140.3	83%	0.825	75%	0.75	S	S	*	*			trans	178.7	124.1	153.8	47.5	0	0	0	0	110
1272	R	28.6	Very low	30	Very low	234 Å²	234	140.1 Å²	140.1	88%	0.883	76%	0.758	S	S	*	*			cis	106.4	119.5	9.5	-157.5	-158.3	-170.9	-179.2	4.1	115
1273	S	29.3	Very low	30.1	Very low	95 Å²	95	142 Å²	142	66%	0.664	76%	0.764	S	S	*	*			trans	68.3	148.4	153.4	45.5	0	0	0	0	119.6
1274	K	30.9	Very low	30.4	Very low	191 Å²	191	142.6 Å²	142.6	83%	0.83	77%	0.769	S	S	*	*			cis	-174.4	172	-5.7	-114.1	-177.1	171.4	-165.7	0	110.3
1275	S	30.3	Very low	30.4	Very low	110 Å²	110	144.3 Å²	144.3	77%	0.769	78%	0.778	S	S	*	*			trans	67.2	148.8	148.4	39.9	0	0	0	0	119.8
1276	S	31.6	Very low	30.6	Very low	98 Å²	98	146.5 Å²	146.5	69%	0.685	78%	0.783	S	S	*	*			cis	-169.8	172.9	-9	47	0	0	0	0	111.6
1277	S	31.5	Very low	31	Very low	100 Å²	100	145.2 Å²	145.2	70%	0.699	78%	0.776	S	S	*	*			trans	66.7	142.4	155.6	37.6	0	0	0	0	117.9
1278	T	31.2	Very low	31.1	Very low	117 Å²	117	147.5 Å²	147.5	72%	0.718	78%	0.78	S	S	*	*			cis	-161.5	156.9	-3.4	8.6	0	0	0	0	111.1
1279	N	29.8	Very low	31.6	Very low	154 Å²	154	151.7 Å²	151.7	82%	0.824	79%	0.786	S	S	*	*			trans	45.9	110.2	151.3	-56.3	1.8	0	0	0	121.3
1280	S	31.7	Very low	31.8	Very low	106 Å²	106	145.2 Å²	145.2	74%	0.741	76%	0.764	S	S	*	*				-170	167.6	120.2	67.4	0	0	0	0	112.6
1281	S	32.9	Very low	32	Very low	105 Å²	105	142.3 Å²	142.3	73%	0.734	75%	0.754	S	S	*	*			trans	61.2	137.2	149.7	50	0	0	0	0	121.8
1282	T	27.9	Very low	32.2	Very low	125 Å²	125	145.6 Å²	145.6	77%	0.767	75%	0.75	S	S	*	*	S	Bend	trans	-49.9	166.9	163.2	41.6	0	0	0	0	114.9
1283	N	32	Very low	32.6	Very low	161 Å²	161	141.7 Å²	141.7	86%	0.861	74%	0.739	S	S	*	*			trans	79.4	58.2	175.3	-62.6	-17	0	0	0	118.5
1284	E	32.3	Very low	32.9	Very low	166 Å²	166	144.2 Å²	144.2	78%	0.776	74%	0.738	S	S	*	*			trans	-143.9	39	164	-141.2	179.2	-144.5	0	0	117.6
1285	L	29.5	Very low	33.1	Very low	176 Å²	176	140.4 Å²	140.4	92%	0.921	73%	0.725	S	S	*	*	S	Bend	trans	-94.7	-4.8	168.2	-134.7	97.2	0	0	0	114.6
1286	Y	34.2	Very low	33.2	Very low	220 Å²	220	145.1 Å²	145.1	86%	0.863	73%	0.727	S	S	*	*	S	Bend	trans	-89.4	-18.9	-174.6	-127.1	-105.2	0	0	0	114.1
1287	N	36.2	Very low	33.4	Very low	109 Å²	109	144.1 Å²	144.1	58%	0.583	72%	0.719	S	S	*	*	S	Bend	trans	-100.1	4.8	-165.7	-94.6	-30	0	0	0	116.9	S1290	N1287-S1290 PolarHBondContact O-OG 3.17Å; N1287-S1290 VanDerWaalsContact O-OG 3.05Å
1288	R	33.5	Very low	33.5	Very low	221 Å²	221	146.2 Å²	146.2	83%	0.834	72%	0.723	S	S	*	*	S	Bend	trans	-96.4	-9	173.6	-79.6	-171.8	175.2	177.8	2	115.6	S1290	R1288-S1290 VanDerWaalsContact C-N 3.33Å
1289	K	37.8	Very low	33.7	Very low	186 Å²	186	149.2 Å²	149.2	81%	0.809	72%	0.721	S	S	*	*	H	α-helix	trans	-79.2	-12.5	172.8	-75.2	-175	175	-179.9	0	113.5
1290	S	37.9	Very low	34	Very low	55 Å²	55	144.3 Å²	144.3	39%	0.385	70%	0.702	S	S	.	*	H	α-helix	trans	-83.6	-40.7	-175.2	52.6	0	0	0	0	114.1	N1287 R1288 K1293 K1294	N1287-S1290 PolarHBondContact O-OG 3.17Å; N1287-S1290 VanDerWaalsContact O-OG 3.05Å; R1288-S1290 VanDerWaalsContact C-N 3.33Å; S1290-K1293 WeakPolarHBondContact O-CB 3.36Å; S1290-K1293 PolarHBondContact O-N 2.67Å; S1290-K1294 PolarHBondContact O-N 3.48Å
1291	E	34.2	Very low	34.3	Very low	142 Å²	142	143 Å²	143	66%	0.664	70%	0.698	S	S	*	*	H	α-helix	trans	-68.3	-42.7	178.7	-71.1	-163.6	120.4	0	0	112.8	K1293 K1294 I1295	E1291-K1293 PolarHBondContact O-N 2.94Å; E1291-K1294 PolarHBondContact O-N 3.1Å; E1291-K1294 VanDerWaalsContact O-N 3.14Å; E1291-I1295 WeakPolarHBondContact O-CG1 3.4Å; E1291-I1295 PolarHBondContact O-N 3.48Å
1292	Y	33.8	Very low	34.5	Very low	187 Å²	187	142.4 Å²	142.4	73%	0.733	69%	0.693	S	S	*	*	H	α-helix	trans	-58.9	-36.1	172.4	-94	-91	0	0	0	111.9	I1295 W1296	Y1292-I1295 PolarHBondContact O-N 3.49Å; Y1292-W1296 PolarHBondContact O-N 2.92Å
1293	K	36.9	Very low	34.8	Very low	152 Å²	152	139.8 Å²	139.8	66%	0.661	67%	0.674	S	S	*	*	H	α-helix	trans	-64.8	-43.7	175.3	-146	171.9	-172.1	-179.8	0	111.7	S1290 E1291 I1295 W1296 S1297	S1290-K1293 WeakPolarHBondContact O-CB 3.36Å; S1290-K1293 PolarHBondContact O-N 2.67Å; E1291-K1293 PolarHBondContact O-N 2.94Å; K1293-I1295 PolarHBondContact O-N 3.22Å; K1293-W1296 PolarHBondContact O-N 3.18Å; K1293-S1297 PolarHBondContact O-N 3.32Å; K1293-S1297 PolarHBondContact O-OG 3.01Å
1294	K	35	Very low	34.9	Very low	148 Å²	148	135.9 Å²	135.9	64%	0.643	66%	0.658	S	S	*	*	H	α-helix	trans	-64.4	-34.2	175.3	-80.1	-174.1	172.5	179.3	0	113.5	S1290 E1291	S1290-K1294 PolarHBondContact O-N 3.48Å; E1291-K1294 PolarHBondContact O-N 3.1Å; E1291-K1294 VanDerWaalsContact O-N 3.14Å
1295	I	34.5	Very low	34.9	Very low	110 Å²	110	138 Å²	138	56%	0.564	66%	0.659	S	S	*	*	H	α-helix	trans	-72.8	-32.1	175.8	-66.5	170.7	0	0	0	111.6	E1291 Y1292 K1293	E1291-I1295 WeakPolarHBondContact O-CG1 3.4Å; E1291-I1295 PolarHBondContact O-N 3.48Å; Y1292-I1295 PolarHBondContact O-N 3.49Å; K1293-I1295 PolarHBondContact O-N 3.22Å
1296	W	32.1	Very low	35.1	Very low	210 Å²	210	133.3 Å²	133.3	80%	0.795	64%	0.64	S	S	*	*	H	α-helix	trans	-77.2	-43.8	176.7	-109.1	36.2	0	0	0	113.9	Y1292 K1293 N1298 R1299 A1300	Y1292-W1296 PolarHBondContact O-N 2.92Å; K1293-W1296 PolarHBondContact O-N 3.18Å; W1296-N1298 PolarHBondContact O-N 2.84Å; W1296-R1299 PolarHBondContact O-N 3.37Å; W1296-A1300 PolarHBondContact O-N 3.33Å; W1296-A1300 VanDerWaalsContact O-N 3.12Å
1297	S	36.4	Very low	35.2	Very low	76 Å²	76	128.8 Å²	128.8	53%	0.531	63%	0.626	S	S	.	*	H	α-helix	trans	-55.5	-38.5	-178.1	-67.8	0	0	0	0	113.1	K1293 R1299 A1300	K1293-S1297 PolarHBondContact O-N 3.32Å; K1293-S1297 PolarHBondContact O-OG 3.01Å; S1297-R1299 VanDerWaalsContact C-N 3.3Å; S1297-R1299 PolarHBondContact O-N 3.1Å; S1297-A1300 PolarHBondContact O-N 3.24Å
1298	N	34.7	Very low	35.3	Very low	144 Å²	144	130.1 Å²	130.1	77%	0.77	62%	0.622	S	S	*	*	H	α-helix	trans	-78.8	-6.5	179.4	-71.7	-6.3	0	0	0	114.4	W1296	W1296-N1298 PolarHBondContact O-N 2.84Å
1299	R	35.2	Very low	35.6	Very low	180 Å²	180	125 Å²	125	68%	0.679	61%	0.611	S	S	*	*	H	α-helix	trans	-101.3	-21.3	170.9	-92.9	179.8	163.6	171.8	-6.3	113.7	W1296 S1297 A1301 S1302	W1296-R1299 PolarHBondContact O-N 3.37Å; S1297-R1299 VanDerWaalsContact C-N 3.3Å; S1297-R1299 PolarHBondContact O-N 3.1Å; R1299-A1301 PolarHBondContact O-N 2.68Å; R1299-S1302 PolarHBondContact O-N 3.14Å; R1299-S1302 PolarHBondContact O-OG 3.46Å
1300	A	36.3	Very low	35.5	Very low	52 Å²	52	120.7 Å²	120.7	43%	0.43	60%	0.596	S	S	.	*	H	α-helix	trans	-58.7	-33.9	177.7	0	0	0	0	0	113	W1296 S1297 S1302 L1303	W1296-A1300 PolarHBondContact O-N 3.33Å; W1296-A1300 VanDerWaalsContact O-N 3.12Å; S1297-A1300 PolarHBondContact O-N 3.24Å; A1300-S1302 PolarHBondContact O-N 3.24Å; A1300-L1303 PolarHBondContact O-N 2.91Å
1301	A	36.4	Very low	35.4	Very low	79 Å²	79	124.3 Å²	124.3	65%	0.653	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	-27.5	175.6	0	0	0	0	0	113.7	R1299 R1308	R1299-A1301 PolarHBondContact O-N 2.68Å; A1301-R1308 PolarHBondContact O-NH2 2.94Å
1302	S	36.9	Very low	35.5	Very low	91 Å²	91	121.8 Å²	121.8	64%	0.636	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	1.4	179.3	49.3	0	0	0	0	115	R1299 A1300	R1299-S1302 PolarHBondContact O-N 3.14Å; R1299-S1302 PolarHBondContact O-OG 3.46Å; A1300-S1302 PolarHBondContact O-N 3.24Å
1303	L	35.4	Very low	35.6	Very low	70 Å²	70	114.9 Å²	114.9	37%	0.366	58%	0.579	S	S	.	*			trans	-75.9	140.8	-178.7	-72	174.4	0	0	0	112.8	A1300 F1307 R1308	A1300-L1303 PolarHBondContact O-N 2.91Å; L1303-F1307 HydrophobicContact CB-CB 4.04Å; L1303-F1307 HydrophobicContact CD1-CB 4.28Å; L1303-F1307 HydrophobicContact CD1-CD1 4.21Å; L1303-F1307 HydrophobicContact CD1-CG 4.46Å; L1303-F1307 HydrophobicContact CD2-CG 4.5Å; L1303-R1308 PolarHBondContact O-NE 2.8Å; L1303-R1308 PolarHBondContact O-NH2 3.4Å
1304	P	34.1	Very low	35.5	Very low	79 Å²	79	115 Å²	115	51%	0.513	58%	0.58	S	S	.	*			trans	-56.4	163.9	174.1	-27.2	35.8	0	0	0	114.9	S1306 F1307 R1308	P1304-S1306 VanDerWaalsContact C-N 3.3Å; P1304-S1306 PolarHBondContact O-N 2.93Å; P1304-F1307 PolarHBondContact O-N 3.41Å; P1304-F1307 VanDerWaalsContact O-N 3.16Å; P1304-R1308 PolarHBondContact O-N 3.45Å
1305	R	32.6	Very low	35.4	Very low	211 Å²	211	113 Å²	113	80%	0.796	57%	0.573	S	S	*	*	H	α-helix	trans	-58.2	-37.4	-175.9	-170.6	172	178.3	162.6	-3.2	113.2	R1308 L1309	R1305-R1308 PolarHBondContact O-N 3.44Å; R1305-L1309 PolarHBondContact O-N 2.89Å; R1305-L1309 VanDerWaalsContact O-N 3.1Å
1306	S	33.7	Very low	35.4	Very low	77 Å²	77	112.7 Å²	112.7	54%	0.538	57%	0.572	S	S	.	*	H	α-helix	trans	-58.6	-46.3	175.1	47	0	0	0	0	112.9	P1304 R1308 L1309 L1310	P1304-S1306 VanDerWaalsContact C-N 3.3Å; P1304-S1306 PolarHBondContact O-N 2.93Å; S1306-R1308 VanDerWaalsContact C-N 3.26Å; S1306-R1308 PolarHBondContact O-N 2.81Å; S1306-L1309 WeakPolarHBondContact O-CB 3.03Å; S1306-L1309 PolarHBondContact O-N 3.45Å; S1306-L1309 VanDerWaalsContact O-N 3.15Å; S1306-L1310 PolarHBondContact O-N 2.73Å
1307	F	36.9	Very low	35.5	Very low	126 Å²	126	108 Å²	108	55%	0.553	56%	0.561	S	S	*	*	H	α-helix	trans	-66.6	-25.6	178.3	-107.6	-89.1	0	0	0	113.7	L1303 P1304 H1311	L1303-F1307 HydrophobicContact CB-CB 4.04Å; L1303-F1307 HydrophobicContact CD1-CB 4.28Å; L1303-F1307 HydrophobicContact CD1-CD1 4.21Å; L1303-F1307 HydrophobicContact CD1-CG 4.46Å; L1303-F1307 HydrophobicContact CD2-CG 4.5Å; P1304-F1307 PolarHBondContact O-N 3.41Å; P1304-F1307 VanDerWaalsContact O-N 3.16Å; F1307-H1311 PolarHBondContact O-N 2.9Å
1308	R	37.5	Very low	35.3	Very low	137 Å²	137	113.7 Å²	113.7	52%	0.517	57%	0.572	S	S	.	*	H	α-helix	trans	-76.4	-36.1	173	-59.4	-176.1	-168.1	-171.1	-0.6	111.9	A1301 L1303 P1304 R1305 S1306 H1311 N1312	A1301-R1308 PolarHBondContact O-NH2 2.94Å; L1303-R1308 PolarHBondContact O-NE 2.8Å; L1303-R1308 PolarHBondContact O-NH2 3.4Å; P1304-R1308 PolarHBondContact O-N 3.45Å; R1305-R1308 PolarHBondContact O-N 3.44Å; S1306-R1308 VanDerWaalsContact C-N 3.26Å; S1306-R1308 PolarHBondContact O-N 2.81Å; R1308-H1311 PolarHBondContact O-N 3.28Å; R1308-N1312 PolarHBondContact O-N 3.12Å; R1308-N1312 VanDerWaalsContact O-N 3.12Å
1309	L	39.1	Very low	35.2	Very low	112 Å²	112	113.6 Å²	113.6	59%	0.586	57%	0.566	S	S	*	*	H	α-helix	trans	-61.6	-43.6	172.1	-72.4	163.8	0	0	0	110.9	R1305 S1306 H1311 N1312 A1313	R1305-L1309 PolarHBondContact O-N 2.89Å; R1305-L1309 VanDerWaalsContact O-N 3.1Å; S1306-L1309 WeakPolarHBondContact O-CB 3.03Å; S1306-L1309 PolarHBondContact O-N 3.45Å; S1306-L1309 VanDerWaalsContact O-N 3.15Å; L1309-H1311 VanDerWaalsContact C-N 3.32Å; L1309-H1311 PolarHBondContact O-N 2.87Å; L1309-N1312 PolarHBondContact O-N 3.28Å; L1309-A1313 WeakPolarHBondContact O-CB 3.46Å; L1309-A1313 PolarHBondContact O-N 3.21Å
1310	L	36.8	Very low	34.9	Very low	97 Å²	97	107.6 Å²	107.6	51%	0.508	55%	0.552	S	S	.	*	H	α-helix	trans	-62.6	-35.3	178.1	-139.1	86.1	0	0	0	113.5	S1306 K1314	S1306-L1310 PolarHBondContact O-N 2.73Å; L1310-K1314 PolarHBondContact O-N 3.15Å
1311	H	34.8	Very low	34.5	Very low	131 Å²	131	111.1 Å²	111.1	61%	0.606	56%	0.564	S	S	*	*	H	α-helix	trans	-68.3	-42.1	174.3	-173	-67.5	0	0	0	111.7	F1307 R1308 L1309 K1314 Q1315	F1307-H1311 PolarHBondContact O-N 2.9Å; R1308-H1311 PolarHBondContact O-N 3.28Å; L1309-H1311 VanDerWaalsContact C-N 3.32Å; L1309-H1311 PolarHBondContact O-N 2.87Å; H1311-K1314 PolarHBondContact O-N 3.33Å; H1311-Q1315 PolarHBondContact O-N 2.69Å
1312	N	36	Very low	34.2	Very low	89 Å²	89	115.8 Å²	115.8	48%	0.476	57%	0.569	S	S	.	*	H	α-helix	trans	-67.8	-37.1	176	-71.8	6.7	0	0	0	111.5	R1308 L1309 K1314 Q1315 L1316	R1308-N1312 PolarHBondContact O-N 3.12Å; R1308-N1312 VanDerWaalsContact O-N 3.12Å; L1309-N1312 PolarHBondContact O-N 3.28Å; N1312-K1314 PolarHBondContact O-N 3.35Å; N1312-Q1315 WeakPolarHBondContact O-CB 3.37Å; N1312-Q1315 PolarHBondContact O-N 2.71Å; N1312-L1316 WeakPolarHBondContact O-CG 3.13Å; N1312-L1316 PolarHBondContact O-N 3.17Å
1313	A	36.5	Very low	33.7	Very low	41 Å²	41	115.4 Å²	115.4	34%	0.339	57%	0.567	S	S	.	*	H	α-helix	trans	-58.7	-43.9	174.8	0	0	0	0	0	111.8	L1309 Q1315 L1316 L1317	L1309-A1313 WeakPolarHBondContact O-CB 3.46Å; L1309-A1313 PolarHBondContact O-N 3.21Å; A1313-Q1315 PolarHBondContact O-N 2.88Å; A1313-L1316 PolarHBondContact O-N 2.94Å; A1313-L1317 VanDerWaalsContact O-CB 3.29Å; A1313-L1317 WeakPolarHBondContact O-CB 3.23Å; A1313-L1317 WeakPolarHBondContact O-CD1 3.38Å; A1313-L1317 WeakPolarHBondContact O-CG 3.47Å; A1313-L1317 PolarHBondContact O-N 3.15Å
1314	K	35.8	Very low	33.4	Very low	154 Å²	154	122.5 Å²	122.5	67%	0.67	59%	0.589	S	S	*	*	H	α-helix	trans	-65.9	-13.9	174.2	-78.7	-162.4	172	-167.6	0	115	L1310 H1311 N1312	L1310-K1314 PolarHBondContact O-N 3.15Å; H1311-K1314 PolarHBondContact O-N 3.33Å; N1312-K1314 PolarHBondContact O-N 3.35Å
1315	Q	32.4	Very low	33.1	Very low	106 Å²	106	123.4 Å²	123.4	50%	0.495	59%	0.588	S	S	.	*	H	α-helix	trans	-93.7	-44.1	173.7	-166	164.9	-18.7	0	0	110.9	H1311 N1312 A1313 L1317 R1318	H1311-Q1315 PolarHBondContact O-N 2.69Å; N1312-Q1315 WeakPolarHBondContact O-CB 3.37Å; N1312-Q1315 PolarHBondContact O-N 2.71Å; A1313-Q1315 PolarHBondContact O-N 2.88Å; Q1315-L1317 VanDerWaalsContact C-N 3.29Å; Q1315-L1317 PolarHBondContact O-N 2.74Å; Q1315-R1318 PolarHBondContact O-N 3Å
1316	L	33.8	Very low	32.9	Very low	105 Å²	105	115.1 Å²	115.1	55%	0.55	56%	0.562	S	S	.	*	H	α-helix	trans	-60.6	-35.2	172.9	-69.3	166.7	0	0	0	112.6	N1312 A1313 R1318 E1319 S1320	N1312-L1316 WeakPolarHBondContact O-CG 3.13Å; N1312-L1316 PolarHBondContact O-N 3.17Å; A1313-L1316 PolarHBondContact O-N 2.94Å; L1316-R1318 PolarHBondContact O-N 2.94Å; L1316-E1319 CarbonylContact O-C 3.59Å; L1316-E1319 WeakPolarHBondContact O-CA 3.44Å; L1316-E1319 PolarHBondContact O-N 3.09Å; L1316-S1320 WeakPolarHBondContact O-CB 3.44Å; L1316-S1320 PolarHBondContact O-N 3.15Å; L1316-S1320 PolarHBondContact O-OG 3.39Å
1317	L	34.4	Very low	32.7	Very low	110 Å²	110	114.4 Å²	114.4	58%	0.576	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	1.3	173.6	-75.8	167.1	0	0	0	114.7	A1313 Q1315	A1313-L1317 VanDerWaalsContact O-CB 3.29Å; A1313-L1317 WeakPolarHBondContact O-CB 3.23Å; A1313-L1317 WeakPolarHBondContact O-CD1 3.38Å; A1313-L1317 WeakPolarHBondContact O-CG 3.47Å; A1313-L1317 PolarHBondContact O-N 3.15Å; Q1315-L1317 VanDerWaalsContact C-N 3.29Å; Q1315-L1317 PolarHBondContact O-N 2.74Å
1318	R	32.9	Very low	32.2	Very low	197 Å²	197	111.8 Å²	111.8	74%	0.743	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	-5.8	165.8	-68.8	-173.1	171.1	-131.6	-4.1	113.5	Q1315 L1316	Q1315-R1318 PolarHBondContact O-N 3Å; L1316-R1318 PolarHBondContact O-N 2.94Å
1319	E	32.3	Very low	31.8	Very low	141 Å²	141	111.4 Å²	111.4	66%	0.659	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.2	2	-167.9	-64.1	174	-177.2	0	0	112.4	L1316	L1316-E1319 CarbonylContact O-C 3.59Å; L1316-E1319 WeakPolarHBondContact O-CA 3.44Å; L1316-E1319 PolarHBondContact O-N 3.09Å
1320	S	28.1	Very low	31.2	Very low	55 Å²	55	111.5 Å²	111.5	39%	0.385	55%	0.547	S	S	.	.	S	Bend	trans	-107.9	137.1	-175.6	59.6	0	0	0	0	113.9	L1316 F1322	L1316-S1320 WeakPolarHBondContact O-CB 3.44Å; L1316-S1320 PolarHBondContact O-N 3.15Å; L1316-S1320 PolarHBondContact O-OG 3.39Å; S1320-F1322 PolarHBondContact O-N 3.06Å
1321	D	27.6	Very low	30.7	Very low	126 Å²	126	109.2 Å²	109.2	67%	0.674	54%	0.539	S	S	*	.			trans	-55	130.9	170.6	-98.5	-48.1	0	0	0	111.6	S1323	D1321-S1323 PolarHBondContact O-N 3.37Å
1322	F	30.3	Very low	30.3	Very low	176 Å²	176	104.4 Å²	104.4	77%	0.772	52%	0.519	S	S	*	.	S	Bend	trans	-80.3	30.8	-177.9	-73	-82.9	0	0	0	113.7	S1320	S1320-F1322 PolarHBondContact O-N 3.06Å
1323	S	27	Very low	29.8	Very low	83 Å²	83	106.5 Å²	106.5	58%	0.58	53%	0.53	S	S	*	.			trans	-90	3.5	-171.1	54.9	0	0	0	0	115.4	D1321	D1321-S1323 PolarHBondContact O-N 3.37Å
1324	R	28.7	Very low	29.5	Very low	219 Å²	219	109.2 Å²	109.2	83%	0.826	54%	0.536	S	S	*	.			trans	-129.6	88.2	-171.6	-65	-176.3	174.6	-153.5	-5.5	112.9
1325	I	28.4	Very low	29.1	Very low	99 Å²	99	107.9 Å²	107.9	51%	0.508	54%	0.536	S	S	.	.			trans	-141.7	114.1	162.8	-55.9	178.3	0	0	0	109	F747	F747-I1325 HydrophobicContact CD2-CD1 3.92Å; F747-I1325 HydrophobicContact CE2-CD1 3.9Å; F747-I1325 HydrophobicContact CE2-CG1 4.34Å; F747-I1325 HydrophobicContact CE2-CG2 4.21Å
1326	P	28.5	Very low	28.8	Very low	36 Å²	36	109.9 Å²	109.9	23%	0.234	55%	0.55	C	S	.	.			trans	-74.9	136.4	170.6	31.8	-34.7	0	0	0	110.7	E829 L830	E829-P1326 WeakPolarHBondContact O-CG 3.39Å; L830-P1326 HydrophobicContact CD2-CB 3.59Å
1327	V	28.1	Very low	28.6	Very low	63 Å²	63	111.6 Å²	111.6	38%	0.382	56%	0.558	S	S	.	*			trans	-106.8	98.6	167.3	179.1	0	0	0	0	107.7	R684 V770	R684-V1327 PolarHBondContact NE-O 3.34Å; R684-V1327 PolarHBondContact NH1-O 2.84Å; R684-V1327 PolarHBondContact NH2-O 2.76Å; V770-V1327 HydrophobicContact CG1-CG1 4.49Å
1328	V	27.7	Very low	28.2	Very low	71 Å²	71	115.8 Å²	115.8	43%	0.43	57%	0.571	S	S	.	*			trans	-74.3	131.3	175.2	-178	0	0	0	0	109.2	L830 L1330	L830-V1328 HydrophobicContact CB-CG2 4.24Å; V1328-L1330 HydrophobicContact CG1-CG 4.48Å
1329	R	29	Very low	27.9	Very low	129 Å²	129	114.1 Å²	114.1	49%	0.487	57%	0.572	S	S	.	*			trans	-100.7	112.2	173.7	-122.6	-170.6	-176	-175.1	1.9	109
1330	L	26	Very low	27.7	Very low	113 Å²	113	115.7 Å²	115.7	59%	0.592	58%	0.58	S	S	*	*			trans	-103.6	70.7	163.2	-68.7	175.5	0	0	0	108.9	L699 V1328	L699-L1330 WeakPolarHBondContact CD2-O 3.44Å; V1328-L1330 HydrophobicContact CG1-CG 4.48Å
1331	C	26.3	Very low	27.6	Very low	49 Å²	49	120.2 Å²	120.2	33%	0.331	60%	0.599	S	S	.	*	S	Bend	trans	-151.4	142.8	172.2	-85.5	0	0	0	0	109.3
1332	P	27.2	Very low	27.8	Very low	30 Å²	30	122.2 Å²	122.2	20%	0.195	60%	0.604	C	S	.	*			trans	-62.4	168.4	175.6	-23.7	35.1	0	0	0	114.6	L699 E1334	L699-P1332 HydrophobicContact CD1-CG 4.18Å; P1332-E1334 PolarHBondContact O-N 2.84Å
1333	L	24.2	Very low	27.6	Very low	133 Å²	133	121 Å²	121	70%	0.696	61%	0.606	S	S	*	*			trans	-81.3	97.6	166.5	-76.9	154.2	0	0	0	109.1
1334	E	30.1	Very low	27.7	Very low	99 Å²	99	124.2 Å²	124.2	46%	0.463	62%	0.615	S	S	.	*			trans	-124.7	90.5	167.6	-73.7	174.8	168.8	0	0	107.5	S757 P1332 D1336	S757-E1334 WeakPolarHBondContact CB-OE2 3.42Å; S757-E1334 PolarHBondContact OG-OE2 2.82Å; P1332-E1334 PolarHBondContact O-N 2.84Å; E1334-D1336 VanDerWaalsContact C-N 3.26Å; E1334-D1336 PolarHBondContact O-N 3.42Å
1335	N	27.7	Very low	27.7	Very low	126 Å²	126	119.8 Å²	119.8	67%	0.674	60%	0.604	S	S	*	*			trans	-98.3	43	177.4	-121.8	36.2	0	0	0	109.6	I1337	N1335-I1337 PolarHBondContact O-N 3.36Å
1336	D	27.2	Very low	27.6	Very low	147 Å²	147	124.3 Å²	124.3	79%	0.786	63%	0.625	S	S	*	*			trans	-75	58.8	-175.9	-76.5	23.5	0	0	0	111.8	E1334 K1338	E1334-D1336 VanDerWaalsContact C-N 3.26Å; E1334-D1336 PolarHBondContact O-N 3.42Å; D1336-K1338 PolarHBondContact O-N 3.14Å
1337	I	28.3	Very low	27.6	Very low	141 Å²	141	129.1 Å²	129.1	72%	0.723	64%	0.642	S	S	*	*			trans	-67.2	121	141.8	-61.8	177.7	0	0	0	104.9	N1335 Q1339	N1335-I1337 PolarHBondContact O-N 3.36Å; I1337-Q1339 PolarHBondContact O-N 2.75Å
1338	K	26.4	Very low	27.8	Very low	198 Å²	198	133.1 Å²	133.1	86%	0.861	66%	0.662	S	S	*	*			trans	-65.3	90.2	166.8	-67.9	-175.3	176.9	-173	0	108.7	D1336	D1336-K1338 PolarHBondContact O-N 3.14Å
1339	Q	26.3	Very low	27.8	Very low	163 Å²	163	137 Å²	137	76%	0.762	69%	0.685	S	S	*	*			trans	-70.9	125.8	150.2	-73.5	-174.6	-115.8	0	0	106.5	I1337 D1341	I1337-Q1339 PolarHBondContact O-N 2.75Å; Q1339-D1341 PolarHBondContact O-N 2.8Å
1340	E	28.6	Very low	27.8	Very low	174 Å²	174	137.3 Å²	137.3	81%	0.813	70%	0.695	S	S	*	*			trans	-77.2	115	166.3	-68.1	175.7	143.7	0	0	106.5	H1342	E1340-H1342 VanDerWaalsContact C-N 3.35Å; E1340-H1342 PolarHBondContact O-N 3.3Å
1341	D	26.5	Very low	28.1	Very low	149 Å²	149	140 Å²	140	80%	0.797	71%	0.706	S	S	*	*			trans	-68	90.4	-179	-74.8	-45	0	0	0	110.3	Q1339 D1343	Q1339-D1341 PolarHBondContact O-N 2.8Å; D1341-D1343 PolarHBondContact O-N 2.75Å
1342	H	30.4	Very low	28.2	Very low	169 Å²	169	144.2 Å²	144.2	78%	0.782	73%	0.726	S	S	*	*			trans	-88.6	88.9	163.2	-95	-57.5	0	0	0	110.2	E1340 I1344	E1340-H1342 VanDerWaalsContact C-N 3.35Å; E1340-H1342 PolarHBondContact O-N 3.3Å; H1342-I1344 PolarHBondContact O-N 2.92Å; H1342-I1344 VanDerWaalsContact O-N 3.16Å
1343	D	27.6	Very low	28.6	Very low	149 Å²	149	147.1 Å²	147.1	80%	0.797	75%	0.747	S	S	*	*			trans	-51.4	115.2	164.2	-83.6	-47.3	0	0	0	110.6	D1341	D1341-D1343 PolarHBondContact O-N 2.75Å
1344	I	28.3	Very low	29	Very low	151 Å²	151	147.8 Å²	147.8	77%	0.774	75%	0.751	S	S	*	*			trans	-119.8	90.5	161.4	-59.8	-175.6	0	0	0	107.9	H1342 M1346	H1342-I1344 PolarHBondContact O-N 2.92Å; H1342-I1344 VanDerWaalsContact O-N 3.16Å; I1344-M1346 PolarHBondContact O-N 2.95Å
1345	E	27.9	Very low	29.2	Very low	126 Å²	126	150.4 Å²	150.4	59%	0.589	77%	0.768	S	S	*	*			trans	-61.4	119.3	168	-62.3	-156.7	111.5	0	0	110	K1347	E1345-K1347 HydrophobicContact CB-CB 4.37Å; E1345-K1347 HydrophobicContact CB-CD 4.47Å; E1345-K1347 HydrophobicContact CB-CG 4.22Å; E1345-K1347 PolarHBondContact O-N 3.04Å; E1345-K1347 WeakPolarHBondContact OE1-CE 3.5Å; E1345-K1347 IonicContact OE1-NZ 3.71Å; E1345-K1347 PolarHBondContact OE1-NZ 2.62Å; E1345-K1347 WeakPolarHBondContact OE2-CD 3.33Å; E1345-K1347 WeakPolarHBondContact OE2-CE 3.4Å; E1345-K1347 IonicContact OE2-NZ 3.87Å; E1345-K1347 PolarHBondContact OE2-NZ 2.98Å
1346	M	26.3	Very low	29.4	Very low	194 Å²	194	147.4 Å²	147.4	96%	0.956	76%	0.761	S	S	*	*			trans	-71.1	78.6	159.7	-77	-163.6	177.8	0	0	109.8	I1344	I1344-M1346 PolarHBondContact O-N 2.95Å
1347	K	29.9	Very low	29.5	Very low	137 Å²	137	149.7 Å²	149.7	60%	0.596	76%	0.764	S	S	*	*			trans	-121.4	93	172.7	-79.7	-173.2	-169.4	152.9	0	112.5	E1345	E1345-K1347 HydrophobicContact CB-CB 4.37Å; E1345-K1347 HydrophobicContact CB-CD 4.47Å; E1345-K1347 HydrophobicContact CB-CG 4.22Å; E1345-K1347 PolarHBondContact O-N 3.04Å; E1345-K1347 WeakPolarHBondContact OE1-CE 3.5Å; E1345-K1347 IonicContact OE1-NZ 3.71Å; E1345-K1347 PolarHBondContact OE1-NZ 2.62Å; E1345-K1347 WeakPolarHBondContact OE2-CD 3.33Å; E1345-K1347 WeakPolarHBondContact OE2-CE 3.4Å; E1345-K1347 IonicContact OE2-NZ 3.87Å; E1345-K1347 PolarHBondContact OE2-NZ 2.98Å
1348	N	30.9	Very low	29.6	Very low	148 Å²	148	148 Å²	148	79%	0.791	76%	0.764	S	S	*	*			trans	41.1	101.7	137.1	-58.2	-18.6	0	0	0	118.3
1349	V	29.5	Very low	29.7	Very low	151 Å²	151	143.2 Å²	143.2	92%	0.915	76%	0.756	S	S	*	*			trans	-69.6	132.6	146.9	176	0	0	0	0	108.7
1350	I	28.9	Very low	29.8	Very low	136 Å²	136	142.1 Å²	142.1	70%	0.697	76%	0.756	S	S	*	*			trans	-71.5	135	-174.5	-63.6	153.2	0	0	0	111.4
1351	M	31.2	Very low	29.8	Very low	170 Å²	170	140.3 Å²	140.3	84%	0.837	75%	0.752	S	S	*	*				-160.6	141.3	128.8	-80.3	-127.8	87.8	0	0	110.9
1352	N	29.7	Very low	29.9	Very low	137 Å²	137	140.8 Å²	140.8	73%	0.733	75%	0.754	S	S	*	*			trans	-55.4	162.2	-176.5	-38.6	-28.7	0	0	0	113.1
1353	S	33.6	Very low	29.8	Very low	91 Å²	91	138.5 Å²	138.5	64%	0.636	76%	0.757	S	S	*	*			cis	-161.8	157.8	24.3	51.7	0	0	0	0	112.8
1354	D	34.1	Very low	30.1	Very low	147 Å²	147	140.7 Å²	140.7	79%	0.786	76%	0.759	S	S	*	*			trans	29.3	138.9	133.5	-35.2	-30.6	0	0	0	120
1355	D	34.3	Very low	30.1	Very low	154 Å²	154	139.4 Å²	139.4	82%	0.824	76%	0.761	S	S	*	*			cis	-160.3	164	10.9	-149.6	-12.8	0	0	0	114.5
1356	A	31.4	Very low	30.2	Very low	64 Å²	64	140.6 Å²	140.6	53%	0.529	76%	0.764	S	S	.	*			trans	36.6	111.7	148.7	0	0	0	0	0	124.2
1357	K	30.3	Very low	30.4	Very low	194 Å²	194	141.5 Å²	141.5	84%	0.843	76%	0.763	S	S	*	*				79.8	125	120.1	-67.7	173.7	-176.7	167.4	0	122.9
1358	S	28.5	Very low	30.3	Very low	105 Å²	105	141.6 Å²	141.6	73%	0.734	77%	0.766	S	S	*	*				104.9	121.5	122.6	66.7	0	0	0	0	122
1359	S	28.5	Very low	30.5	Very low	99 Å²	99	144.3 Å²	144.3	69%	0.692	77%	0.771	S	S	*	*			trans	71.1	131.2	139	54.8	0	0	0	0	122.5
1360	N	28.6	Very low	30.6	Very low	139 Å²	139	142.9 Å²	142.9	74%	0.743	77%	0.765	S	S	*	*			trans	91.6	136.4	145.2	-72.2	24	0	0	0	122
1361	D	29.1	Very low	30.6	Very low	137 Å²	137	142.6 Å²	142.6	73%	0.733	77%	0.769	S	S	*	*			trans	66.1	130	146.7	-52.5	-22.5	0	0	0	123.1
1362	D	28.9	Very low	30.6	Very low	158 Å²	158	142.1 Å²	142.1	85%	0.845	77%	0.765	S	S	*	*			trans	24.3	114.1	148.3	-73.2	-22.3	0	0	0	120.3
1363	S	28.4	Very low	30.7	Very low	121 Å²	121	142.4 Å²	142.4	85%	0.846	77%	0.771	S	S	*	*				-172.6	150.5	117.2	37.3	0	0	0	0	115
1364	K	33.1	Very low	30.5	Very low	195 Å²	195	146 Å²	146	85%	0.848	78%	0.776	S	S	*	*			trans	-77.4	152.8	165.5	-99.9	178.6	174.4	171.6	0	111.5
1365	P	30	Very low	30.5	Very low	125 Å²	125	148 Å²	148	81%	0.812	78%	0.78	S	S	*	*			trans	-116.9	161.4	135	3.7	16.9	0	0	0	113.1
1366	K	28.4	Very low	30.3	Very low	151 Å²	151	147.5 Å²	147.5	66%	0.657	78%	0.777	S	S	*	*			trans	-100.3	165.3	164.4	-74.2	174.1	145.2	-164.9	0	109.5	E1368	K1366-E1368 IonicContact NZ-OE1 2.62Å; K1366-E1368 PolarHBondContact NZ-OE1 2.65Å
1367	F	31.2	Very low	30.2	Very low	212 Å²	212	150.3 Å²	150.3	93%	0.93	79%	0.788	S	S	*	*			trans	-131.7	155.2	141.3	-111.9	-92.3	0	0	0	110.1
1368	E	27.4	Very low	30.3	Very low	140 Å²	140	150.5 Å²	150.5	65%	0.654	79%	0.789	S	S	*	*			trans	-135.3	151.4	-172.6	-69.7	178.9	141.9	0	0	111.5	K1366	K1366-E1368 IonicContact NZ-OE1 2.62Å; K1366-E1368 PolarHBondContact NZ-OE1 2.65Å
1369	F	34.9	Very low	30.3	Very low	204 Å²	204	152.7 Å²	152.7	90%	0.895	79%	0.792	S	S	*	*			trans	-86.8	153.8	172.7	-77.3	-96.6	0	0	0	112.2
1370	P	31.4	Very low	30.5	Very low	121 Å²	121	157.5 Å²	157.5	79%	0.786	80%	0.804	S	S	*	*			trans	-110	171.1	159.8	35.9	-25.1	0	0	0	113.5
1371	V	29.5	Very low	30.6	Very low	131 Å²	131	159 Å²	159	79%	0.794	81%	0.806	S	S	*	*			trans	-134.9	166.6	-163.6	170.6	0	0	0	0	112.6
1372	E	30.8	Very low	30.6	Very low	160 Å²	160	157 Å²	157	75%	0.748	80%	0.802	S	S	*	*			trans	-30	156.9	177.9	-55.9	179.4	120.8	0	0	120.4
1373	V	31.7	Very low	30.6	Very low	143 Å²	143	155.5 Å²	155.5	87%	0.867	79%	0.794	S	S	*	*			trans	-141	150.4	150	-176.9	0	0	0	0	109.6
1374	K	30.6	Very low	30.7	Very low	167 Å²	167	155 Å²	155	73%	0.726	79%	0.79	S	S	*	*			trans	-127.3	155.8	171.1	-62.4	176.4	179.1	176.5	0	110.1
1375	E	33.1	Very low	30.6	Very low	189 Å²	189	149.9 Å²	149.9	88%	0.883	78%	0.779	S	S	*	*			trans	-173.4	112.5	138.8	-109	169.4	-160.4	0	0	114.8
1376	D	30	Very low	30.6	Very low	142 Å²	142	149.7 Å²	149.7	76%	0.759	78%	0.776	S	S	*	*			trans	35.7	118.7	135	-65.2	10.3	0	0	0	126.4
1377	V	30.9	Very low	30.7	Very low	124 Å²	124	148.8 Å²	148.8	75%	0.752	78%	0.778	S	S	*	*				65.5	116	121.3	-173.9	0	0	0	0	121.4
1378	K	31.6	Very low	30.5	Very low	198 Å²	198	144.8 Å²	144.8	86%	0.861	77%	0.771	S	S	*	*				-172.3	146.6	115	-102.5	178.1	-171.8	-179.9	0	113.9
1379	N	29	Very low	30.6	Very low	150 Å²	150	141.9 Å²	141.9	80%	0.802	78%	0.779	S	S	*	*			trans	-90.7	155.8	170.6	-66.7	4.8	0	0	0	111.3
1380	E	32.1	Very low	30.3	Very low	201 Å²	201	139.6 Å²	139.6	94%	0.939	78%	0.776	S	S	*	*				-157.5	176.5	123.2	-114.2	162.3	-154.1	0	0	110.1
1381	Q	31.3	Very low	30.2	Very low	170 Å²	170	138.3 Å²	138.3	79%	0.794	77%	0.77	S	S	*	*			trans	-134.8	-179.7	-147.8	-165.8	171.5	-32.5	0	0	112.8
1382	C	28.3	Very low	30.2	Very low	95 Å²	95	140.9 Å²	140.9	64%	0.642	77%	0.77	S	S	*	*			trans	80	145.7	165.5	-58.8	0	0	0	0	116.9
1383	D	29.6	Very low	30.2	Very low	127 Å²	127	141.1 Å²	141.1	68%	0.679	77%	0.769	S	S	*	*			cis	-166	155.5	-15.7	-106.3	-25.5	0	0	0	111.6
1384	S	30.4	Very low	30.2	Very low	109 Å²	109	139.6 Å²	139.6	76%	0.762	76%	0.756	S	S	*	*			trans	64.2	155.2	147.9	76.5	0	0	0	0	119.6
1385	S	31.1	Very low	30.3	Very low	89 Å²	89	137.9 Å²	137.9	62%	0.622	75%	0.754	S	S	*	*			cis	-173.9	147	-23.1	48.5	0	0	0	0	110.5
1386	T	30	Very low	30.4	Very low	121 Å²	121	135.3 Å²	135.3	74%	0.742	75%	0.746	S	S	*	*			trans	64.7	156.3	148.3	60.6	0	0	0	0	118.9
1387	N	29.3	Very low	30.5	Very low	131 Å²	131	134.1 Å²	134.1	70%	0.701	74%	0.739	S	S	*	*			cis	-154.1	161.3	-1.2	-129.4	-10.8	0	0	0	113.2
1388	T	28.3	Very low	30.6	Very low	129 Å²	129	135.4 Å²	135.4	79%	0.791	74%	0.74	S	S	*	*			trans	42.5	139.4	149.2	57.2	0	0	0	0	122.5
1389	G	29.1	Very low	30.7	Very low	79 Å²	79	134.3 Å²	134.3	81%	0.814	74%	0.736	S	S	*	*			trans	161.4	97	154.3	0	0	0	0	0	117.3
1390	D	28.7	Very low	31.1	Very low	156 Å²	156	133.5 Å²	133.5	83%	0.834	74%	0.736	S	S	*	*			trans	-48.2	131.2	-178.3	-80.8	-73.7	0	0	0	120.7
1391	S	28.1	Very low	31.2	Very low	93 Å²	93	127.1 Å²	127.1	65%	0.65	72%	0.724	S	S	*	*				81	127.4	123.9	83	0	0	0	0	124
1392	K	30.9	Very low	31.3	Very low	185 Å²	185	124.8 Å²	124.8	80%	0.804	72%	0.721	S	S	*	*			trans	66.2	132.1	130.3	-77.9	176.2	180	168.5	0	123.1
1393	K	31	Very low	31.5	Very low	165 Å²	165	127.1 Å²	127.1	72%	0.717	73%	0.727	S	S	*	*			trans	75.9	149.4	146	-70.2	178.2	151.8	-76.8	0	117.3
1394	D	29.9	Very low	31.5	Very low	111 Å²	111	128 Å²	128	59%	0.594	73%	0.727	S	S	*	*			cis	-153.2	-174.9	-4.8	-114.8	-18.1	0	0	0	112.1
1395	L	34.6	Very low	31.5	Very low	132 Å²	132	128.4 Å²	128.4	69%	0.691	72%	0.72	S	S	*	*			trans	-42.7	168	177.6	-63.4	70.2	0	0	0	115.9
1396	N	33.9	Very low	31.5	Very low	134 Å²	134	130.9 Å²	130.9	72%	0.717	73%	0.727	S	S	*	*				174.3	-178.9	69.8	-126.5	-41.3	0	0	0	109.3
1397	I	32.6	Very low	31.3	Very low	118 Å²	118	130 Å²	130	61%	0.605	73%	0.726	S	S	*	*			cis	-159.1	-179.5	14.9	-150.1	162.4	0	0	0	111.8
1398	L	33.3	Very low	31.3	Very low	150 Å²	150	132.1 Å²	132.1	79%	0.785	73%	0.732	S	S	*	*			trans	108.2	101.9	170	-63.6	174.8	0	0	0	113.2
1399	K	34.2	Very low	31.2	Very low	176 Å²	176	130.8 Å²	130.8	77%	0.765	73%	0.727	S	S	*	*				69.2	139.3	53.7	-60.6	-169.8	170	-174	0	112.9
1400	V	35.5	Very low	31.1	Very low	133 Å²	133	135.3 Å²	135.3	81%	0.806	73%	0.727	S	S	*	*			cis	-137.8	143.6	25.8	174.6	0	0	0	0	108.3
1401	G	34.8	Very low	31	Very low	67 Å²	67	133.7 Å²	133.7	69%	0.691	72%	0.723	S	S	*	*				95.3	154.2	64.7	0	0	0	0	0	111.1
1402	T	33.7	Very low	31	Very low	120 Å²	120	137.2 Å²	137.2	74%	0.736	73%	0.733	S	S	*	*			cis	-176.3	146.8	-0.9	5.7	0	0	0	0	110.6
1403	L	32.1	Very low	30.8	Very low	144 Å²	144	131.5 Å²	131.5	75%	0.754	73%	0.727	S	S	*	*			trans	65.8	157.4	150.1	-59.3	169.7	0	0	0	118.9
1404	E	30.2	Very low	30.9	Very low	145 Å²	145	131.6 Å²	131.6	68%	0.678	74%	0.735	S	S	*	*			cis	-164.7	165.4	-29.3	-124.1	-180	-148.6	0	0	111.6
1405	N	31.1	Very low	30.8	Very low	118 Å²	118	131.6 Å²	131.6	63%	0.631	74%	0.739	S	S	*	*			trans	59.6	124.9	151.3	-52	-21.9	0	0	0	125
1406	D	29.3	Very low	30.7	Very low	141 Å²	141	133.5 Å²	133.5	75%	0.754	75%	0.749	S	S	*	*				64.2	119.8	124.7	-63.4	-16.7	0	0	0	126.1
1407	S	27.3	Very low	30.4	Very low	104 Å²	104	135.1 Å²	135.1	73%	0.727	75%	0.75	S	S	*	*				96.5	135	122	74.6	0	0	0	0	123.2
1408	Q	28.3	Very low	30.3	Very low	175 Å²	175	136.7 Å²	136.7	82%	0.818	77%	0.765	S	S	*	*			trans	67	111.4	141.8	-73.5	-178.1	11.1	0	0	123.1
1409	S	26.1	Very low	30.1	Very low	100 Å²	100	134.5 Å²	134.5	70%	0.699	76%	0.758	S	S	*	*				73.5	138.3	121.3	70.3	0	0	0	0	123.4
1410	E	27.4	Very low	29.8	Very low	175 Å²	175	131.2 Å²	131.2	82%	0.818	76%	0.757	S	S	*	*			trans	65.7	115.1	153.8	-66	179.2	-175.4	0	0	118.9
1411	T	26.6	Very low	29.6	Very low	121 Å²	121	132.3 Å²	132.3	74%	0.742	76%	0.756	S	S	*	*				80.3	142.5	77.1	-39.9	0	0	0	0	112.9
1412	I	28.5	Very low	29.3	Very low	167 Å²	167	134 Å²	134	86%	0.856	76%	0.758	S	S	*	*			trans	71.4	118.9	-174.3	-44.5	165.5	0	0	0	111.1
1413	G	27.2	Very low	29.3	Very low	66 Å²	66	132.1 Å²	132.1	68%	0.68	76%	0.755	S	S	*	*			cis	114.5	117.5	-0.3	0	0	0	0	0	111.5
1414	D	33.2	Very low	29.3	Very low	167 Å²	167	131.9 Å²	131.9	89%	0.893	75%	0.754	S	S	*	*			trans	-149.1	151.6	159.4	-138.3	-22.5	0	0	0	113.6
1415	T	27.9	Very low	29.3	Very low	110 Å²	110	130 Å²	130	68%	0.675	76%	0.757	S	S	*	*			trans	-100.7	142.1	-173.3	-51.8	0	0	0	0	109.7
1416	L	31.9	Very low	29.5	Very low	172 Å²	172	130.1 Å²	130.1	90%	0.901	76%	0.764	S	S	*	*			trans	-150.7	112.7	147.5	-113.8	171	0	0	0	113.8
1417	K	27	Very low	29.6	Very low	168 Å²	168	127.8 Å²	127.8	73%	0.73	76%	0.759	S	S	*	*			trans	-71.1	143.8	171.7	-60.7	161.5	175.4	169.6	0	110.7
1418	V	31.6	Very low	30	Very low	151 Å²	151	129.1 Å²	129.1	92%	0.915	77%	0.765	S	S	*	*			trans	-133.3	152.7	140.8	-175.8	0	0	0	0	107.9
1419	T	28.5	Very low	30.1	Very low	105 Å²	105	128.7 Å²	128.7	64%	0.644	76%	0.76	S	S	*	*			trans	-126.9	150.9	-157.4	48.9	0	0	0	0	114.6
1420	S	27.3	Very low	30.4	Very low	107 Å²	107	132.1 Å²	132.1	75%	0.748	77%	0.765	S	S	*	*			trans	67.3	162.7	155.4	67	0	0	0	0	115.8
1421	I	31.5	Very low	30.4	Very low	155 Å²	155	132 Å²	132	80%	0.795	77%	0.765	S	S	*	*			cis	-138.3	166.2	31.4	-69.4	174.5	0	0	0	112.3
1422	S	28.8	Very low	30.6	Very low	103 Å²	103	130.3 Å²	130.3	72%	0.72	77%	0.771	S	S	*	*			trans	-55.6	169.6	177.1	68.7	0	0	0	0	115
1423	A	33.1	Very low	30.5	Very low	81 Å²	81	128 Å²	128	67%	0.669	77%	0.77	S	S	*	*				-166.3	143.3	58.4	0	0	0	0	0	118.9
1424	N	33.3	Very low	30.6	Very low	139 Å²	139	132.8 Å²	132.8	74%	0.743	78%	0.779	S	S	*	*			trans	65.6	96.9	131.6	-62.2	-2.1	0	0	0	123.9
1425	S	30.1	Very low	30.2	Very low	105 Å²	105	133.7 Å²	133.7	73%	0.734	78%	0.775	S	S	*	*				72.2	163.9	111.6	78.3	0	0	0	0	121.7
1426	P	33.7	Very low	30.2	Very low	121 Å²	121	135.4 Å²	135.4	79%	0.786	78%	0.779	S	S	*	*			cis	-132.6	164.6	-25.8	27.7	-7.2	0	0	0	115.4
1427	S	32.8	Very low	29.9	Very low	91 Å²	91	137.9 Å²	137.9	64%	0.636	78%	0.776	S	S	*	*			trans	-80.5	174.9	164.5	62.6	0	0	0	0	113.3
1428	P	35.2	Very low	29.8	Very low	133 Å²	133	138.1 Å²	138.1	86%	0.864	79%	0.785	S	S	*	*				-138	170.3	105.5	37.5	-26.1	0	0	0	116.2
1429	K	29.8	Very low	29.6	Very low	165 Å²	165	142.3 Å²	142.3	72%	0.717	78%	0.784	S	S	*	*			trans	-109.6	164.4	-167.6	-53.7	159.4	-179.5	172.8	0	111.9
1430	H	32.1	Very low	29.4	Very low	173 Å²	173	149.5 Å²	149.5	80%	0.801	80%	0.8	S	S	*	*				-178.4	114.9	125.8	-92.5	-66.8	0	0	0	107.7
1431	Q	28.9	Very low	29.5	Very low	173 Å²	173	151.1 Å²	151.1	81%	0.808	81%	0.805	S	S	*	*				62.2	118.6	67.6	-78.6	-168.9	-34.3	0	0	115.6
1432	G	30	Very low	29.3	Very low	85 Å²	85	148.4 Å²	148.4	88%	0.876	80%	0.799	S	S	*	*			trans	163.7	99.6	169.1	0	0	0	0	0	112.3
1433	S	26.9	Very low	29.3	Very low	118 Å²	118	148 Å²	148	83%	0.825	80%	0.796	S	S	*	*			trans	-110.3	148.6	176.6	73.4	0	0	0	0	111.1
1434	L	28.3	Very low	29	Very low	167 Å²	167	150.3 Å²	150.3	87%	0.874	80%	0.802	S	S	*	*			trans	-164.6	145.3	147.2	-112.5	164.6	0	0	0	113.3
1435	K	26.2	Very low	28.8	Very low	185 Å²	185	148.6 Å²	148.6	80%	0.804	80%	0.801	S	S	*	*			trans	-69.2	153.1	166.9	-57.7	161.9	178.2	172.2	0	109.4
1436	L	26.3	Very low	28.7	Very low	146 Å²	146	148.2 Å²	148.2	76%	0.764	80%	0.798	S	S	*	*				-177.8	131.7	124.6	-100.6	160.8	0	0	0	115.7
1437	R	27	Very low	28.5	Very low	224 Å²	224	150.5 Å²	150.5	85%	0.845	80%	0.797	S	S	*	*			trans	30	119.8	145.6	-81.7	-179.4	163	106.3	-0.6	121
1438	L	23.7	Very low	28.4	Very low	174 Å²	174	154.4 Å²	154.4	91%	0.911	80%	0.802	S	S	*	*			trans	-37.3	133.1	142.7	-73.2	156.3	0	0	0	113.8
1439	R	27.4	Very low	28.1	Very low	238 Å²	238	152.9 Å²	152.9	90%	0.898	80%	0.8	S	S	*	*			trans	-141.6	128.6	147.5	-91.5	-171	169.6	170.1	-2.7	109.7
1440	R	25.1	Very low	28.2	Very low	257 Å²	257	151.5 Å²	151.5	97%	0.97	81%	0.805	S	S	*	*			trans	-67.3	135.5	164.5	-69.1	175.8	175	154.4	-3.5	109
1441	V	29.3	Very low	27.9	Very low	141 Å²	141	153.5 Å²	153.5	86%	0.855	81%	0.806	S	S	*	*			trans	-136.6	134.6	155.7	-176.4	0	0	0	0	106.8
1442	S	26.6	Very low	28.2	Very low	98 Å²	98	150.3 Å²	150.3	69%	0.685	80%	0.8	S	S	*	*			trans	-101.8	169.2	-178.6	56.4	0	0	0	0	112.1
1443	S	28.8	Very low	28.2	Very low	94 Å²	94	150.5 Å²	150.5	66%	0.657	78%	0.784	S	S	*	*			trans	65.2	124	150.2	48.9	0	0	0	0	119.9
1444	T	27.4	Very low	28.3	Very low	129 Å²	129	153.8 Å²	153.8	79%	0.791	78%	0.784	S	S	*	*			trans	59	123.8	141.6	61.2	0	0	0	0	118.9
1445	S	28.9	Very low	28.3	Very low	103 Å²	103	153.6 Å²	153.6	72%	0.72	78%	0.778	S	S	*	*				176.5	148.3	56.6	41.6	0	0	0	0	112.7
1446	S	27.5	Very low	28.3	Very low	97 Å²	97	156.9 Å²	156.9	68%	0.678	80%	0.797	S	S	*	*			trans	51	135.9	149.6	63.7	0	0	0	0	122.9
1447	F	30.5	Very low	28.4	Very low	170 Å²	170	157.4 Å²	157.4	75%	0.746	80%	0.798	S	S	*	*				165.4	100.7	122.9	-105.5	-110.7	0	0	0	109.4
1448	K	31.3	Very low	28.5	Very low	173 Å²	173	153.9 Å²	153.9	75%	0.752	80%	0.796	S	S	*	*				86.7	112.3	94.9	-81.8	-166	-173	172.3	0	117.2
1449	A	28.3	Very low	28.8	Very low	100 Å²	100	152.8 Å²	152.8	83%	0.826	79%	0.789	S	S	*	*			trans	64	142.6	155.3	0	0	0	0	0	117.2
1450	V	31.9	Very low	28.9	Very low	136 Å²	136	147.8 Å²	147.8	82%	0.824	78%	0.783	S	S	*	*				-142.6	154.4	50.9	166.3	0	0	0	0	113
1451	R	25.6	Very low	29.1	Very low	216 Å²	216	140.9 Å²	140.9	82%	0.815	77%	0.771	S	S	*	*			trans	-111.7	144.8	165	-101	-174.8	176.3	-173.3	-0.4	109.1
1452	P	34.6	Very low	29.1	Very low	106 Å²	106	140.9 Å²	140.9	69%	0.688	77%	0.766	S	S	*	*				-142	137.7	90.5	34.2	-17.1	0	0	0	113.3
1453	T	30.7	Very low	29.3	Very low	88 Å²	88	144 Å²	144	54%	0.54	77%	0.771	S	S	.	*				46.5	111.3	76.9	65.7	0	0	0	0	113.5
1454	F	28.3	Very low	29.3	Very low	187 Å²	187	147.8 Å²	147.8	82%	0.82	78%	0.78	S	S	*	*				-167.9	143.2	81.3	-113.4	-95.8	0	0	0	113.2
1455	H	28.3	Very low	29.5	Very low	163 Å²	163	149.4 Å²	149.4	76%	0.755	78%	0.779	S	S	*	*			trans	5.5	130.8	153.9	-76.9	-76.9	0	0	0	120.7
1456	Q	27.7	Very low	29.5	Very low	254 Å²	254	153.6 Å²	153.6	100%	1.187	79%	0.785	S	S	*	*				-120.2	0	85	-169.9	157.8	-7.8	0	0	109.8

Retrieved 1,456 of 1,456 residues in 375.5 ms (Link to these results)

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