A0A087X4H6_POEFO Loading...

Zinc finger and BTB domain containing 11

AlphaFold DB , UniProt , Accession A0A087X4H6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,142 aa.

						>A0A087X4H6_POEFO|A0A087X4H6
MSCEESYLAILRYLTDEREPYAPGTSGNTKRKIRKAAACYVVRNGTLFYQRRQKGQNDFTELEVVLQDCRRRELINQAHIIEGGEHLNQQLTWEIISQKYWWRGILKNVKDHIRECAQCQSKRSTDDGSGPRPFSRQGRRKFGPMEDEDDDEEEDGEDILFSTDLSSQRPKLAKGTAKHEVVYVNSKGEVNQFLPKHSQTMLDKLNQQRISNQFCDITLLIEGEEHRAHKAVLAACSEYFNELFYEKGAVTTHEAVVDLSGFAKASFLPLLDFAYTSVLTFNFCVMADIANLARHLLMTEVLQICESVHKQVEEQKLTVYQKGDVHTVVAGVLATDDSKVEPDAYMVTIDDDGSTVVTHGACIQQPVTVLTHAVAGDAVEAGQSETVALIAHGGEGEHGDTLTLISGCGEGLEGETMTVVTHSGQAGASESLAVVSACLAMEQPQVVEASAFVLDVDADKHAPSEEVVLESEAAAPTEAQKKETLPVPQKRKRGRPPKVKREAEVEGWIPPEEDPAEEEHADKQEATPDDLSGRRLRQRYMAEGGYARLHMGLEEEEEAKSVTPPPATPPKVGPRKRGRPPKRPVEPKFEGEPEAVVEESAMDSATVGELQPEEAAAKAVEPEAEAKQQDGAPQSAGSGEHTCSECGMSFQRRYSLIMHTLKHEKARAYKCSLCSKEFQYAASLQAHLARHKQQRSQRASSVPKALAELGPPERAENELDDKAAAAAYTRREFVCDICGKTLPKLYSLRIHMLTHTGVRPHTCKVCGKTFAHKHSLKMHRVLHDVTKQFQCEYCKKTFVSKRSMEEHTSLHTGESKYLCNTCGATFHRASALSKHLKKHQPKPEVRPFSCSHCEKSFYEAKDLQQHMNKHMGLKPFQCQVCGKCYSWKKDWYSHVKSHSVAEPFKCNVCGKEFFEKALFRRHVKKATHGKKGRVKQNLERECQQCGRKFTQLREYRRHINNHQGVKPFECLTCGVAWADARSLKRHVRTHTGERPYVCPMCQEAHIDARTLRKHMAKYHVDSLPGKIMLEKDTLQFHNQGTQVEHAVSILASDLPPELRSAHPAATEELETVLITEETVEAVEAVQAAQAANEGSVATLSDQGIMQVVNYVLAQQAMSGVKDEASEEIHTMEVEVAHVAEVE
					

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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	57.4	Low	67	Low	53 Å²	53	60.9 Å²	60.9	26%	0.261	34%	0.336	S	S	.	.				0	92.6	0	-50.2	-42.5	-98.1	0	0	109.8	Y7 I10 Y40 V64 W101	M1-Y7 HydrophobicContact CE-CD2 4.13Å; M1-I10 HydrophobicContact CE-CD1 4.07Å; M1-I10 HydrophobicContact SD-CD1 3.62Å; M1-Y40 WeakPolarHBondContact CG-OH 3.29Å; M1-V64 HydrophobicContact CE-CG1 4.43Å; M1-W101 HydrophobicContact CB-CH2 3.98Å; M1-W101 HydrophobicContact CB-CZ3 3.96Å; M1-W101 HydrophobicContact CG-CH2 3.75Å; M1-W101 HydrophobicContact CG-CZ3 3.76Å
2	S	46.5	Very low	67.6	Low	103 Å²	103	66 Å²	66	72%	0.72	35%	0.346	S	S	*	.			trans	-154.4	-2.9	176.4	53.7	0	0	0	0	114.5
3	C	64.1	Low	68	Low	49 Å²	49	66.7 Å²	66.7	33%	0.331	34%	0.342	S	S	.	.	S	Bend	trans	-141.6	158	165.4	57.7	0	0	0	0	108.5	E5 S6	C3-E5 PolarHBondContact O-N 3.39Å; C3-E5 PolarHBondContact SG-OE2 3.45Å; C3-S6 WeakPolarHBondContact O-CB 3.34Å; C3-S6 PolarHBondContact O-N 2.65Å; C3-S6 PolarHBondContact O-OG 2.64Å; C3-S6 PolarHBondContact SG-OG 2.95Å
4	E	68.8	Low	68.3	Low	123 Å²	123	66.4 Å²	66.4	58%	0.575	34%	0.341	S	S	*	.	H	α-helix	trans	-59.5	-35.6	176.8	-175.2	166.1	-150.7	0	0	112.2	S6 Y7 L8 L66	E4-S6 PolarHBondContact O-N 2.81Å; E4-S6 VanDerWaalsContact O-N 3.17Å; E4-Y7 WeakPolarHBondContact O-CB 3.38Å; E4-Y7 PolarHBondContact O-N 3.47Å; E4-L8 HydrophobicContact CG-CD1 4.22Å; E4-L8 HydrophobicContact CG-CG 4.47Å; E4-L8 PolarHBondContact O-N 3.47Å; E4-L66 HydrophobicContact CB-CD1 4.27Å; E4-L66 HydrophobicContact CG-CD1 4.07Å
5	E	68.1	Low	68.4	Low	148 Å²	148	66.3 Å²	66.3	69%	0.692	35%	0.345	S	S	*	.	H	α-helix	trans	-55.2	-32.9	171.9	-49.5	167.6	133.2	0	0	112.6	C3 Y7 A9	C3-E5 PolarHBondContact O-N 3.39Å; C3-E5 PolarHBondContact SG-OE2 3.45Å; E5-Y7 VanDerWaalsContact C-N 3.31Å; E5-Y7 PolarHBondContact O-N 3.15Å; E5-A9 WeakPolarHBondContact O-CB 3.41Å; E5-A9 PolarHBondContact O-N 2.75Å
6	S	68.9	Low	68.1	Low	33 Å²	33	70.9 Å²	70.9	23%	0.231	37%	0.37	C	S	.	.	H	α-helix	trans	-66.9	-34.4	176.4	-58	0	0	0	0	112.4	C3 E4 I10	C3-S6 WeakPolarHBondContact O-CB 3.34Å; C3-S6 PolarHBondContact O-N 2.65Å; C3-S6 PolarHBondContact O-OG 2.64Å; C3-S6 PolarHBondContact SG-OG 2.95Å; E4-S6 PolarHBondContact O-N 2.81Å; E4-S6 VanDerWaalsContact O-N 3.17Å; S6-I10 WeakPolarHBondContact O-CG1 3.42Å; S6-I10 PolarHBondContact O-N 3.43Å
7	Y	73.7	Confident	67.1	Low	32 Å²	32	73.5 Å²	73.5	13%	0.125	38%	0.38	C	S	.	.	H	α-helix	trans	-80.3	-46.4	-177.5	175.5	-83.3	0	0	0	109.9	M1 E4 E5 A9 I10 L11 L47 V64 L66	M1-Y7 HydrophobicContact CE-CD2 4.13Å; E4-Y7 WeakPolarHBondContact O-CB 3.38Å; E4-Y7 PolarHBondContact O-N 3.47Å; E5-Y7 VanDerWaalsContact C-N 3.31Å; E5-Y7 PolarHBondContact O-N 3.15Å; Y7-A9 VanDerWaalsContact C-N 3.27Å; Y7-A9 PolarHBondContact O-N 2.96Å; Y7-I10 PolarHBondContact O-N 3.42Å; Y7-I10 VanDerWaalsContact O-N 3.11Å; Y7-L11 HydrophobicContact CD1-CD1 3.75Å; Y7-L11 HydrophobicContact CD1-CG 4.37Å; Y7-L11 HydrophobicContact CE1-CD1 3.36Å; Y7-L11 HydrophobicContact CE1-CG 4.14Å; Y7-L11 PolarHBondContact O-N 3.24Å; Y7-L47 HydrophobicContact CD1-CD1 4.34Å; Y7-L47 HydrophobicContact CD2-CB 4.35Å; Y7-L47 HydrophobicContact CD2-CD1 3.57Å; Y7-L47 HydrophobicContact CD2-CG 4.47Å; Y7-L47 HydrophobicContact CE1-CD1 4.47Å; Y7-L47 HydrophobicContact CE2-CB 3.73Å; Y7-L47 HydrophobicContact CE2-CD1 3.72Å; Y7-L47 HydrophobicContact CE2-CG 4.15Å; Y7-L47 HydrophobicContact CG-CD1 3.87Å; Y7-L47 PolarHBondContact OH-N 3.42Å; Y7-V64 HydrophobicContact CD2-CG1 3.99Å; Y7-V64 HydrophobicContact CE2-CB 4.18Å; Y7-V64 HydrophobicContact CE2-CG1 3.98Å; Y7-L66 HydrophobicContact CD1-CD1 3.72Å; Y7-L66 HydrophobicContact CD1-CG 4.49Å; Y7-L66 HydrophobicContact CD2-CD1 3.76Å; Y7-L66 HydrophobicContact CD2-CD2 4.25Å; Y7-L66 HydrophobicContact CD2-CG 3.69Å; Y7-L66 HydrophobicContact CE1-CD1 4.35Å; Y7-L66 HydrophobicContact CE2-CD1 4.37Å; Y7-L66 HydrophobicContact CE2-CG 4.14Å; Y7-L66 HydrophobicContact CG-CD1 3.42Å; Y7-L66 VanDerWaalsContact CG-CD1 3.42Å; Y7-L66 HydrophobicContact CG-CG 3.91Å
8	L	71.4	Confident	66	Low	71 Å²	71	83.2 Å²	83.2	37%	0.372	41%	0.411	S	S	.	.	H	α-helix	trans	-61.1	-35.1	172.7	-63.9	175.5	0	0	0	111.9	E4 L11 R12	E4-L8 HydrophobicContact CG-CD1 4.22Å; E4-L8 HydrophobicContact CG-CG 4.47Å; E4-L8 PolarHBondContact O-N 3.47Å; L8-L11 HydrophobicContact CD2-CD1 4.34Å; L8-R12 WeakPolarHBondContact O-CB 3.39Å; L8-R12 VanDerWaalsContact O-CG 3.25Å; L8-R12 WeakPolarHBondContact O-CG 3.4Å; L8-R12 PolarHBondContact O-N 3.33Å
9	A	70.1	Confident	65.1	Low	28 Å²	28	86.9 Å²	86.9	23%	0.231	43%	0.427	C	S	.	.	H	α-helix	trans	-73	-25.6	174.8	0	0	0	0	0	114.3	E5 Y7 Y13 I33	E5-A9 WeakPolarHBondContact O-CB 3.41Å; E5-A9 PolarHBondContact O-N 2.75Å; Y7-A9 VanDerWaalsContact C-N 3.27Å; Y7-A9 PolarHBondContact O-N 2.96Å; A9-Y13 VanDerWaalsContact O-CB 3.32Å; A9-Y13 WeakPolarHBondContact O-CB 3.48Å; A9-Y13 PolarHBondContact O-N 2.94Å; A9-I33 HydrophobicContact CB-CD1 4.09Å
10	I	74.4	Confident	64.6	Low	6 Å²	6	86.1 Å²	86.1	3%	0.031	43%	0.429	C	S	.	.	H	α-helix	trans	-83.4	-38.2	172.9	-71.8	171.2	0	0	0	110.6	M1 S6 Y7 Y13 L14 I33 A36 A37 Y40 L47	M1-I10 HydrophobicContact CE-CD1 4.07Å; M1-I10 HydrophobicContact SD-CD1 3.62Å; S6-I10 WeakPolarHBondContact O-CG1 3.42Å; S6-I10 PolarHBondContact O-N 3.43Å; Y7-I10 PolarHBondContact O-N 3.42Å; Y7-I10 VanDerWaalsContact O-N 3.11Å; I10-Y13 PolarHBondContact O-N 3.02Å; I10-L14 HydrophobicContact CG2-CD1 3.78Å; I10-L14 HydrophobicContact CG2-CG 4.47Å; I10-L14 WeakPolarHBondContact O-CB 3.47Å; I10-L14 WeakPolarHBondContact O-CG 3.29Å; I10-L14 PolarHBondContact O-N 3.08Å; I10-I33 HydrophobicContact CG1-CG2 4.22Å; I10-A36 HydrophobicContact CD1-CB 3.84Å; I10-A37 HydrophobicContact CG2-CB 4.29Å; I10-Y40 HydrophobicContact CD1-CD2 4.45Å; I10-Y40 HydrophobicContact CD1-CE2 4.31Å; I10-Y40 HydrophobicContact CG2-CD2 4.31Å; I10-L47 HydrophobicContact CB-CD1 4.24Å; I10-L47 HydrophobicContact CG2-CD1 3.98Å; I10-L47 HydrophobicContact CG2-CD2 3.91Å
11	L	73.9	Confident	64	Low	24 Å²	24	84.2 Å²	84.2	13%	0.126	42%	0.417	C	S	.	.	H	α-helix	trans	-54.5	-60	169.5	-86.8	174.8	0	0	0	110.6	Y7 L8 Y13 L14 T15 V42 L47	Y7-L11 HydrophobicContact CD1-CD1 3.75Å; Y7-L11 HydrophobicContact CD1-CG 4.37Å; Y7-L11 HydrophobicContact CE1-CD1 3.36Å; Y7-L11 HydrophobicContact CE1-CG 4.14Å; Y7-L11 PolarHBondContact O-N 3.24Å; L8-L11 HydrophobicContact CD2-CD1 4.34Å; L11-Y13 PolarHBondContact O-N 3.33Å; L11-Y13 VanDerWaalsContact O-N 3.1Å; L11-L14 CarbonylContact O-C 3.57Å; L11-L14 WeakPolarHBondContact O-CA 3.41Å; L11-L14 PolarHBondContact O-N 2.94Å; L11-T15 WeakPolarHBondContact O-CG2 3.35Å; L11-T15 PolarHBondContact O-N 3.01Å; L11-T15 PolarHBondContact O-OG1 3.18Å; L11-T15 VanDerWaalsContact O-OG1 3.11Å; L11-V42 HydrophobicContact CD2-CB 4.49Å; L11-V42 HydrophobicContact CD2-CG1 3.83Å; L11-V42 HydrophobicContact CD2-CG2 3.77Å; L11-L47 HydrophobicContact CD2-CD1 4.34Å; L11-L47 HydrophobicContact CD2-CD2 4.33Å; L11-L47 HydrophobicContact CD2-CG 3.83Å; L11-L47 HydrophobicContact CG-CD1 3.87Å; L11-L47 HydrophobicContact CG-CG 3.93Å
12	R	73.9	Confident	63.6	Low	122 Å²	122	84.4 Å²	84.4	46%	0.46	43%	0.427	S	S	.	.	H	α-helix	trans	-57.7	-29	-179.1	-71	173.9	-174.6	172.1	4.5	113.9	L8	L8-R12 WeakPolarHBondContact O-CB 3.39Å; L8-R12 VanDerWaalsContact O-CG 3.25Å; L8-R12 WeakPolarHBondContact O-CG 3.4Å; L8-R12 PolarHBondContact O-N 3.33Å
13	Y	72.6	Confident	63.3	Low	75 Å²	75	85.7 Å²	85.7	29%	0.294	43%	0.433	S	S	.	.	H	α-helix	trans	-77.4	-25.9	175.2	-179.4	-90.1	0	0	0	113.2	A9 I10 L11 I33 R34 A37	A9-Y13 VanDerWaalsContact O-CB 3.32Å; A9-Y13 WeakPolarHBondContact O-CB 3.48Å; A9-Y13 PolarHBondContact O-N 2.94Å; I10-Y13 PolarHBondContact O-N 3.02Å; L11-Y13 PolarHBondContact O-N 3.33Å; L11-Y13 VanDerWaalsContact O-N 3.1Å; Y13-I33 HydrophobicContact CG-CG2 4.13Å; Y13-R34 HydrophobicContact CD2-CG 4.38Å; Y13-R34 HydrophobicContact CE1-CG 4.32Å; Y13-R34 HydrophobicContact CE2-CG 3.58Å; Y13-R34 WeakPolarHBondContact OH-CD 3.5Å; Y13-A37 HydrophobicContact CD1-CB 3.43Å; Y13-A37 VanDerWaalsContact CD1-CB 3.43Å; Y13-A37 HydrophobicContact CE1-CB 3.73Å
14	L	72.3	Confident	62.7	Low	63 Å²	63	87.5 Å²	87.5	33%	0.33	46%	0.46	S	S	.	.	H	α-helix	trans	-98.4	-10.7	178.2	-70.2	172.5	0	0	0	113.5	I10 L11 A37 Y40 V42 L47	I10-L14 HydrophobicContact CG2-CD1 3.78Å; I10-L14 HydrophobicContact CG2-CG 4.47Å; I10-L14 WeakPolarHBondContact O-CB 3.47Å; I10-L14 WeakPolarHBondContact O-CG 3.29Å; I10-L14 PolarHBondContact O-N 3.08Å; L11-L14 CarbonylContact O-C 3.57Å; L11-L14 WeakPolarHBondContact O-CA 3.41Å; L11-L14 PolarHBondContact O-N 2.94Å; L14-A37 HydrophobicContact CD1-CB 4.37Å; L14-A37 HydrophobicContact CD2-CB 4.09Å; L14-A37 HydrophobicContact CG-CB 4.16Å; L14-Y40 WeakPolarHBondContact CD1-O 3.48Å; L14-V42 HydrophobicContact CB-CG2 3.63Å; L14-V42 HydrophobicContact CD1-CG2 3.98Å; L14-V42 HydrophobicContact CG-CG2 4.48Å; L14-L47 HydrophobicContact CD1-CD2 3.84Å
15	T	69.8	Low	62.3	Low	65 Å²	65	84 Å²	84	40%	0.399	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	10.7	176.9	64.3	0	0	0	0	113.6	L11 E17 V42	L11-T15 WeakPolarHBondContact O-CG2 3.35Å; L11-T15 PolarHBondContact O-N 3.01Å; L11-T15 PolarHBondContact O-OG1 3.18Å; L11-T15 VanDerWaalsContact O-OG1 3.11Å; T15-E17 PolarHBondContact O-N 3.41Å; T15-V42 HydrophobicContact CG2-CG1 4.2Å; T15-V42 HydrophobicContact CG2-CG2 4.33Å
16	D	63.9	Low	61.7	Low	139 Å²	139	79.8 Å²	79.8	74%	0.743	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.1	36.5	175.8	-82.9	-30.2	0	0	0	116.1	R18	D16-R18 PolarHBondContact O-N 3.34Å
17	E	51.3	Low	61.6	Low	115 Å²	115	81 Å²	81	54%	0.537	45%	0.451	S	S	.	.			trans	-66.8	126.6	170.7	-68.3	-168.8	148.7	0	0	109.7	T15 E19	T15-E17 PolarHBondContact O-N 3.41Å; E17-E19 CarbonylContact O-C 3.53Å; E17-E19 PolarHBondContact O-N 2.92Å
18	R	46.5	Very low	61.2	Low	248 Å²	248	84.3 Å²	84.3	94%	0.936	47%	0.471	S	S	*	.	S	Bend	trans	-63.9	7	-160.2	-74.6	-176.8	170.3	-175.5	-3.3	117.9	D16	D16-R18 PolarHBondContact O-N 3.34Å
19	E	49.8	Very low	61.1	Low	155 Å²	155	83.8 Å²	83.8	72%	0.724	47%	0.471	S	S	*	.			trans	-119.4	85.7	162.9	-69	-159.3	162.8	0	0	110.6	E17 Y21	E17-E19 CarbonylContact O-C 3.53Å; E17-E19 PolarHBondContact O-N 2.92Å; E19-Y21 PolarHBondContact O-N 3.3Å
20	P	53.8	Low	60.9	Low	70 Å²	70	85.7 Å²	85.7	46%	0.455	47%	0.474	S	S	.	.			trans	-62.2	-14.7	-167.5	-27.9	36.4	0	0	0	115.9
21	Y	53.2	Low	60.8	Low	46 Å²	46	95 Å²	95	18%	0.18	51%	0.509	C	S	.	.	S	Bend	trans	-154.2	140.8	175.2	-48.4	-91.3	0	0	0	112	E19 T25 K30 I33	E19-Y21 PolarHBondContact O-N 3.3Å; Y21-T25 WeakPolarHBondContact CB-OG1 3.44Å; Y21-K30 HydrophobicContact CD1-CB 4.44Å; Y21-K30 HydrophobicContact CD1-CD 4.07Å; Y21-K30 HydrophobicContact CD1-CG 3.68Å; Y21-K30 HydrophobicContact CD2-CD 3.59Å; Y21-K30 VanDerWaalsContact CD2-CE 3.48Å; Y21-K30 HydrophobicContact CD2-CG 4.14Å; Y21-K30 HydrophobicContact CE1-CB 3.84Å; Y21-K30 HydrophobicContact CE1-CD 4.13Å; Y21-K30 HydrophobicContact CE1-CG 3.58Å; Y21-K30 HydrophobicContact CE2-CB 4.43Å; Y21-K30 HydrophobicContact CE2-CD 3.69Å; Y21-K30 HydrophobicContact CE2-CG 4.08Å; Y21-K30 HydrophobicContact CG-CD 3.81Å; Y21-K30 VanDerWaalsContact CG-CE 3.42Å; Y21-K30 HydrophobicContact CG-CG 3.96Å; Y21-I33 HydrophobicContact CD1-CD1 4.1Å; Y21-I33 HydrophobicContact CE1-CB 4.39Å; Y21-I33 HydrophobicContact CE1-CD1 3.94Å; Y21-I33 HydrophobicContact CE1-CG2 4.33Å
22	A	48.3	Very low	60.9	Low	58 Å²	58	100.4 Å²	100.4	48%	0.479	53%	0.531	S	S	.	.			trans	-55.4	143.8	172.1	0	0	0	0	0	112.3	G24 T25	A22-G24 PolarHBondContact O-N 3.43Å; A22-T25 WeakPolarHBondContact O-CG2 3.23Å; A22-T25 PolarHBondContact O-N 3.18Å; A22-T25 PolarHBondContact O-OG1 3.44Å
23	P	40	Very low	60.8	Low	130 Å²	130	95.9 Å²	95.9	84%	0.844	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	128.1	178.2	-28.3	35.8	0	0	0	112.9
24	G	51.8	Low	60.9	Low	86 Å²	86	99.2 Å²	99.2	89%	0.887	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.3	-2.7	-179.7	0	0	0	0	0	116.1	A22 S26	A22-G24 PolarHBondContact O-N 3.43Å; G24-S26 PolarHBondContact O-N 3.13Å
25	T	60.7	Low	61.1	Low	49 Å²	49	104.6 Å²	104.6	30%	0.301	55%	0.549	S	S	.	.			trans	-65.2	125.8	175.8	42.8	0	0	0	0	113.4	Y21 A22 K30	Y21-T25 WeakPolarHBondContact CB-OG1 3.44Å; A22-T25 WeakPolarHBondContact O-CG2 3.23Å; A22-T25 PolarHBondContact O-N 3.18Å; A22-T25 PolarHBondContact O-OG1 3.44Å; T25-K30 WeakPolarHBondContact O-CE 3.15Å; T25-K30 WeakPolarHBondContact OG1-CE 3.38Å
26	S	56	Low	61.2	Low	60 Å²	60	103.1 Å²	103.1	42%	0.42	54%	0.543	S	S	.	.			trans	-68.1	149.3	-176.7	81.4	0	0	0	0	113.6	G24 N28 T29 K30	G24-S26 PolarHBondContact O-N 3.13Å; S26-N28 PolarHBondContact O-N 2.76Å; S26-T29 PolarHBondContact N-OG1 3.45Å; S26-T29 PolarHBondContact O-N 3.02Å; S26-T29 VanDerWaalsContact O-N 3.12Å; S26-T29 PolarHBondContact O-OG1 3.46Å; S26-T29 PolarHBondContact OG-N 3.36Å; S26-T29 PolarHBondContact OG-OG1 2.94Å; S26-K30 WeakPolarHBondContact O-CG 3.47Å; S26-K30 PolarHBondContact O-N 3.09Å
27	G	66.2	Low	61.6	Low	58 Å²	58	96.6 Å²	96.6	60%	0.598	51%	0.509	S	S	*	.	H	α-helix	trans	-58.7	-31.3	177.7	0	0	0	0	0	114.3	K30 R31	G27-K30 PolarHBondContact O-N 2.88Å; G27-R31 PolarHBondContact O-N 3.19Å
28	N	66.3	Low	62.6	Low	102 Å²	102	95.3 Å²	95.3	55%	0.545	52%	0.518	S	S	.	.	H	α-helix	trans	-68.6	-43.4	176.2	-167.6	-42.4	0	0	0	111.3	S26 K30 R31 K32	S26-N28 PolarHBondContact O-N 2.76Å; N28-K30 VanDerWaalsContact C-N 3.31Å; N28-K30 PolarHBondContact O-N 2.91Å; N28-R31 PolarHBondContact O-N 2.88Å; N28-K32 WeakPolarHBondContact O-CG 3.38Å; N28-K32 PolarHBondContact O-N 3.47Å; N28-K32 WeakPolarHBondContact OD1-CD 3.03Å; N28-K32 WeakPolarHBondContact OD1-CE 3.3Å
29	T	68	Low	63.9	Low	60 Å²	60	86.2 Å²	86.2	37%	0.368	49%	0.491	S	S	.	.	H	α-helix	trans	-63.1	-36.8	172.8	41.3	0	0	0	0	112	S26 K32 I33	S26-T29 PolarHBondContact N-OG1 3.45Å; S26-T29 PolarHBondContact O-N 3.02Å; S26-T29 VanDerWaalsContact O-N 3.12Å; S26-T29 PolarHBondContact O-OG1 3.46Å; S26-T29 PolarHBondContact OG-N 3.36Å; S26-T29 PolarHBondContact OG-OG1 2.94Å; T29-K32 PolarHBondContact O-N 2.92Å; T29-I33 WeakPolarHBondContact O-CG1 3.44Å; T29-I33 PolarHBondContact O-N 2.92Å
30	K	67.3	Low	65.2	Low	69 Å²	69	79.9 Å²	79.9	30%	0.3	46%	0.461	S	S	.	.	H	α-helix	trans	-61.9	-46.4	172.8	-58.5	-168.2	178.3	-163.1	0	112.2	Y21 T25 S26 G27 N28 K32 I33 R34	Y21-K30 HydrophobicContact CD1-CB 4.44Å; Y21-K30 HydrophobicContact CD1-CD 4.07Å; Y21-K30 HydrophobicContact CD1-CG 3.68Å; Y21-K30 HydrophobicContact CD2-CD 3.59Å; Y21-K30 VanDerWaalsContact CD2-CE 3.48Å; Y21-K30 HydrophobicContact CD2-CG 4.14Å; Y21-K30 HydrophobicContact CE1-CB 3.84Å; Y21-K30 HydrophobicContact CE1-CD 4.13Å; Y21-K30 HydrophobicContact CE1-CG 3.58Å; Y21-K30 HydrophobicContact CE2-CB 4.43Å; Y21-K30 HydrophobicContact CE2-CD 3.69Å; Y21-K30 HydrophobicContact CE2-CG 4.08Å; Y21-K30 HydrophobicContact CG-CD 3.81Å; Y21-K30 VanDerWaalsContact CG-CE 3.42Å; Y21-K30 HydrophobicContact CG-CG 3.96Å; T25-K30 WeakPolarHBondContact O-CE 3.15Å; T25-K30 WeakPolarHBondContact OG1-CE 3.38Å; S26-K30 WeakPolarHBondContact O-CG 3.47Å; S26-K30 PolarHBondContact O-N 3.09Å; G27-K30 PolarHBondContact O-N 2.88Å; N28-K30 VanDerWaalsContact C-N 3.31Å; N28-K30 PolarHBondContact O-N 2.91Å; K30-K32 VanDerWaalsContact C-N 3.29Å; K30-K32 PolarHBondContact O-N 3.47Å; K30-I33 PolarHBondContact O-N 2.9Å; K30-R34 WeakPolarHBondContact O-CG 3.39Å; K30-R34 PolarHBondContact O-N 3.44Å
31	R	71.2	Confident	66.4	Low	200 Å²	200	78.8 Å²	78.8	76%	0.755	45%	0.453	S	S	*	.	H	α-helix	trans	-61	-37	176	-159.5	179.9	-163.7	-169.4	6.2	112.2	G27 N28 K35	G27-R31 PolarHBondContact O-N 3.19Å; N28-R31 PolarHBondContact O-N 2.88Å; R31-K35 PolarHBondContact O-N 3.3Å
32	K	76	Confident	67.5	Low	139 Å²	139	78.4 Å²	78.4	60%	0.604	46%	0.455	S	S	*	.	H	α-helix	trans	-71.1	-39.1	176.8	-73.3	177.6	174.1	176.3	0	113.3	N28 T29 K30 A36	N28-K32 WeakPolarHBondContact O-CG 3.38Å; N28-K32 PolarHBondContact O-N 3.47Å; N28-K32 WeakPolarHBondContact OD1-CD 3.03Å; N28-K32 WeakPolarHBondContact OD1-CE 3.3Å; T29-K32 PolarHBondContact O-N 2.92Å; K30-K32 VanDerWaalsContact C-N 3.29Å; K30-K32 PolarHBondContact O-N 3.47Å; K32-A36 VanDerWaalsContact O-CB 3.24Å; K32-A36 WeakPolarHBondContact O-CB 3.18Å; K32-A36 PolarHBondContact O-N 3.42Å
33	I	72.5	Confident	68.7	Low	27 Å²	27	82.3 Å²	82.3	14%	0.138	46%	0.457	C	S	.	.	H	α-helix	trans	-61.5	-47.5	173.4	-70.6	159.7	0	0	0	109.6	A9 I10 Y13 Y21 T29 K30 A36 A37	A9-I33 HydrophobicContact CB-CD1 4.09Å; I10-I33 HydrophobicContact CG1-CG2 4.22Å; Y13-I33 HydrophobicContact CG-CG2 4.13Å; Y21-I33 HydrophobicContact CD1-CD1 4.1Å; Y21-I33 HydrophobicContact CE1-CB 4.39Å; Y21-I33 HydrophobicContact CE1-CD1 3.94Å; Y21-I33 HydrophobicContact CE1-CG2 4.33Å; T29-I33 WeakPolarHBondContact O-CG1 3.44Å; T29-I33 PolarHBondContact O-N 2.92Å; K30-I33 PolarHBondContact O-N 2.9Å; I33-A36 PolarHBondContact O-N 3.28Å; I33-A37 WeakPolarHBondContact O-CB 3.41Å; I33-A37 PolarHBondContact O-N 3.33Å
34	R	74.3	Confident	69.7	Low	144 Å²	144	84.2 Å²	84.2	54%	0.543	46%	0.461	S	S	.	.	H	α-helix	trans	-60.1	-48.2	177.2	-65.1	-160	-74.9	174.2	-2.2	113.6	Y13 K30 A36 A37 A38	Y13-R34 HydrophobicContact CD2-CG 4.38Å; Y13-R34 HydrophobicContact CE1-CG 4.32Å; Y13-R34 HydrophobicContact CE2-CG 3.58Å; Y13-R34 WeakPolarHBondContact OH-CD 3.5Å; K30-R34 WeakPolarHBondContact O-CG 3.39Å; K30-R34 PolarHBondContact O-N 3.44Å; R34-A36 VanDerWaalsContact C-N 3.27Å; R34-A36 PolarHBondContact O-N 3.05Å; R34-A37 PolarHBondContact O-N 2.83Å; R34-A38 PolarHBondContact O-N 2.83Å
35	K	77.1	Confident	70.3	Confident	177 Å²	177	82.6 Å²	82.6	77%	0.77	44%	0.444	S	S	*	.	H	α-helix	trans	-67.2	-26.6	176.9	-172.3	168.9	-177.9	176.8	0	112.7	R31	R31-K35 PolarHBondContact O-N 3.3Å
36	A	71.2	Confident	70.7	Confident	33 Å²	33	82.5 Å²	82.5	27%	0.273	44%	0.443	S	S	.	.	H	α-helix	trans	-75.8	-45.6	173.6	0	0	0	0	0	112	I10 K32 I33 R34 A38 C39 Y40	I10-A36 HydrophobicContact CD1-CB 3.84Å; K32-A36 VanDerWaalsContact O-CB 3.24Å; K32-A36 WeakPolarHBondContact O-CB 3.18Å; K32-A36 PolarHBondContact O-N 3.42Å; I33-A36 PolarHBondContact O-N 3.28Å; R34-A36 VanDerWaalsContact C-N 3.27Å; R34-A36 PolarHBondContact O-N 3.05Å; A36-A38 PolarHBondContact O-N 3.13Å; A36-C39 PolarHBondContact O-N 2.91Å; A36-Y40 HydrophobicContact CB-CE2 4.4Å; A36-Y40 WeakPolarHBondContact O-CD2 3.34Å; A36-Y40 VanDerWaalsContact O-CE2 3.27Å; A36-Y40 WeakPolarHBondContact O-CE2 3.29Å
37	A	71.8	Confident	71.7	Confident	3 Å²	3	79.6 Å²	79.6	3%	0.025	42%	0.423	C	S	.	.	H	α-helix	trans	-58.4	-32	-177.3	0	0	0	0	0	113	I10 Y13 L14 I33 R34 C39 Y40	I10-A37 HydrophobicContact CG2-CB 4.29Å; Y13-A37 HydrophobicContact CD1-CB 3.43Å; Y13-A37 VanDerWaalsContact CD1-CB 3.43Å; Y13-A37 HydrophobicContact CE1-CB 3.73Å; L14-A37 HydrophobicContact CD1-CB 4.37Å; L14-A37 HydrophobicContact CD2-CB 4.09Å; L14-A37 HydrophobicContact CG-CB 4.16Å; I33-A37 WeakPolarHBondContact O-CB 3.41Å; I33-A37 PolarHBondContact O-N 3.33Å; R34-A37 PolarHBondContact O-N 2.83Å; A37-C39 PolarHBondContact O-N 3.27Å; A37-Y40 PolarHBondContact O-N 3.02Å
38	A	72.1	Confident	72.3	Confident	88 Å²	88	79 Å²	79	73%	0.727	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-4.4	172.5	0	0	0	0	0	115.3	R34 A36	R34-A38 PolarHBondContact O-N 2.83Å; A36-A38 PolarHBondContact O-N 3.13Å
39	C	74.3	Confident	72.9	Confident	56 Å²	56	77.2 Å²	77.2	38%	0.378	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.6	7.8	175.2	-50.9	0	0	0	0	113.7	A36 A37 Y49 Q50	A36-C39 PolarHBondContact O-N 2.91Å; A37-C39 PolarHBondContact O-N 3.27Å; C39-Y49 HydrophobicContact CB-CD2 4.3Å; C39-Y49 HydrophobicContact CB-CE2 3.88Å; C39-Y49 VanDerWaalsContact O-CD2 3.22Å; C39-Y49 WeakPolarHBondContact O-CD2 3.21Å; C39-Q50 PolarHBondContact O-N 3.02Å; C39-Q50 VanDerWaalsContact O-N 3.16Å
40	Y	78.1	Confident	73.2	Confident	22 Å²	22	77.1 Å²	77.1	9%	0.086	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	147.1	175.8	-52.8	-94.3	0	0	0	110.9	M1 I10 L14 A36 A37 F48 Y49 V64 W101	M1-Y40 WeakPolarHBondContact CG-OH 3.29Å; I10-Y40 HydrophobicContact CD1-CD2 4.45Å; I10-Y40 HydrophobicContact CD1-CE2 4.31Å; I10-Y40 HydrophobicContact CG2-CD2 4.31Å; L14-Y40 WeakPolarHBondContact CD1-O 3.48Å; A36-Y40 HydrophobicContact CB-CE2 4.4Å; A36-Y40 WeakPolarHBondContact O-CD2 3.34Å; A36-Y40 VanDerWaalsContact O-CE2 3.27Å; A36-Y40 WeakPolarHBondContact O-CE2 3.29Å; A37-Y40 PolarHBondContact O-N 3.02Å; Y40-F48 CarbonylContact C-O 3.46Å; Y40-F48 WeakPolarHBondContact CA-O 3.36Å; Y40-F48 WeakPolarHBondContact CB-O 3.14Å; Y40-Y49 HydrophobicContact CD1-CD2 4.01Å; Y40-Y49 HydrophobicContact CD1-CG 4.44Å; Y40-Y49 AromaticContact CE1-CD2 3.65Å; Y40-Y49 HydrophobicContact CE1-CD2 3.65Å; Y40-Y49 HydrophobicContact CE1-CG 4.15Å; Y40-Y49 AromaticContact CZ-CD2 3.95Å; Y40-V64 HydrophobicContact CD1-CG2 3.86Å; Y40-V64 HydrophobicContact CE1-CG2 3.94Å; Y40-W101 HydrophobicContact CE1-CE3 4.43Å; Y40-W101 HydrophobicContact CE1-CH2 4.34Å; Y40-W101 HydrophobicContact CE1-CZ3 4.07Å; Y40-W101 VanDerWaalsContact OH-CH2 3.23Å; Y40-W101 WeakPolarHBondContact OH-CH2 3.4Å
41	V	78.4	Confident	73.2	Confident	47 Å²	47	80 Å²	80	29%	0.285	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	144.5	173.6	171.9	0	0	0	0	108.9	R43 F48 Q50	V41-R43 HydrophobicContact CG1-CG 4.29Å; V41-F48 PolarHBondContact N-O 3.31Å; V41-F48 PolarHBondContact O-N 3.02Å; V41-Q50 HydrophobicContact CG2-CG 4.28Å
42	V	76.6	Confident	72.8	Confident	38 Å²	38	78 Å²	78	23%	0.23	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	121.7	174.7	-173.8	0	0	0	0	108.7	L11 L14 T15 T46 L47	L11-V42 HydrophobicContact CD2-CB 4.49Å; L11-V42 HydrophobicContact CD2-CG1 3.83Å; L11-V42 HydrophobicContact CD2-CG2 3.77Å; L14-V42 HydrophobicContact CB-CG2 3.63Å; L14-V42 HydrophobicContact CD1-CG2 3.98Å; L14-V42 HydrophobicContact CG-CG2 4.48Å; T15-V42 HydrophobicContact CG2-CG1 4.2Å; T15-V42 HydrophobicContact CG2-CG2 4.33Å; V42-T46 WeakPolarHBondContact CA-O 3.44Å; V42-L47 HydrophobicContact CG2-CD2 3.68Å; V42-L47 HydrophobicContact CG2-CG 4.47Å
43	R	72.4	Confident	71.7	Confident	140 Å²	140	76 Å²	76	53%	0.528	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	128.3	167.7	-71.3	177.4	170.8	-174.7	-6.6	107.9	V41 G45 T46 F48 E61	V41-R43 HydrophobicContact CG1-CG 4.29Å; R43-G45 VanDerWaalsContact C-N 3.27Å; R43-G45 PolarHBondContact O-N 2.85Å; R43-T46 PolarHBondContact N-O 3.41Å; R43-T46 PolarHBondContact O-N 2.85Å; R43-F48 HydrophobicContact CB-CD2 3.97Å; R43-F48 HydrophobicContact CB-CE2 3.8Å; R43-E61 WeakPolarHBondContact CD-OE2 3.34Å; R43-E61 IonicContact CZ-OE1 2.8Å; R43-E61 IonicContact CZ-OE2 2.73Å; R43-E61 VanDerWaalsContact CZ-OE2 3.22Å; R43-E61 IonicContact NE-OE1 2.7Å; R43-E61 IonicContact NE-OE2 3.67Å; R43-E61 PolarHBondContact NE-OE2 2.9Å; R43-E61 VanDerWaalsContact NH1-CD 3.28Å; R43-E61 IonicContact NH1-OE1 2.98Å; R43-E61 PolarHBondContact NH1-OE1 3.37Å; R43-E61 IonicContact NH1-OE2 3.9Å; R43-E61 PolarHBondContact NH1-OE2 3.49Å; R43-E61 IonicContact NH2-OE1 2.6Å
44	N	60.7	Low	70.1	Confident	171 Å²	171	83 Å²	83	91%	0.914	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	44.2	-179.4	-56.4	-14.4	0	0	0	113.8	T46	N44-T46 PolarHBondContact O-N 3.07Å
45	G	64.7	Low	68.8	Low	51 Å²	51	80.1 Å²	80.1	53%	0.526	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	0.4	-179.4	0	0	0	0	0	116	R43	R43-G45 VanDerWaalsContact C-N 3.27Å; R43-G45 PolarHBondContact O-N 2.85Å
46	T	70.4	Confident	67.4	Low	47 Å²	47	77 Å²	77	29%	0.288	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	138.5	179.5	-56.8	0	0	0	0	110	V42 R43 N44 F48 E63	V42-T46 WeakPolarHBondContact CA-O 3.44Å; R43-T46 PolarHBondContact N-O 3.41Å; R43-T46 PolarHBondContact O-N 2.85Å; N44-T46 PolarHBondContact O-N 3.07Å; T46-F48 HydrophobicContact CG2-CE2 4.06Å; T46-F48 HydrophobicContact CG2-CZ 4.28Å; T46-F48 WeakPolarHBondContact O-CD2 3.5Å; T46-E63 HydrophobicContact CG2-CG 4Å
47	L	76.8	Confident	66.3	Low	0 Å²	0	81.4 Å²	81.4	0%	0	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	130.3	173.7	-79.7	167.1	0	0	0	110.7	Y7 I10 L11 L14 V42 V64	Y7-L47 HydrophobicContact CD1-CD1 4.34Å; Y7-L47 HydrophobicContact CD2-CB 4.35Å; Y7-L47 HydrophobicContact CD2-CD1 3.57Å; Y7-L47 HydrophobicContact CD2-CG 4.47Å; Y7-L47 HydrophobicContact CE1-CD1 4.47Å; Y7-L47 HydrophobicContact CE2-CB 3.73Å; Y7-L47 HydrophobicContact CE2-CD1 3.72Å; Y7-L47 HydrophobicContact CE2-CG 4.15Å; Y7-L47 HydrophobicContact CG-CD1 3.87Å; Y7-L47 PolarHBondContact OH-N 3.42Å; I10-L47 HydrophobicContact CB-CD1 4.24Å; I10-L47 HydrophobicContact CG2-CD1 3.98Å; I10-L47 HydrophobicContact CG2-CD2 3.91Å; L11-L47 HydrophobicContact CD2-CD1 4.34Å; L11-L47 HydrophobicContact CD2-CD2 4.33Å; L11-L47 HydrophobicContact CD2-CG 3.83Å; L11-L47 HydrophobicContact CG-CD1 3.87Å; L11-L47 HydrophobicContact CG-CG 3.93Å; L14-L47 HydrophobicContact CD1-CD2 3.84Å; V42-L47 HydrophobicContact CG2-CD2 3.68Å; V42-L47 HydrophobicContact CG2-CG 4.47Å; L47-V64 HydrophobicContact CB-CB 4.18Å; L47-V64 HydrophobicContact CB-CG2 4.26Å; L47-V64 VanDerWaalsContact O-CB 3.27Å; L47-V64 WeakPolarHBondContact O-CB 3.43Å; L47-V64 WeakPolarHBondContact O-CG2 3.43Å; L47-V64 PolarHBondContact O-N 3.04Å
48	F	77.9	Confident	65.3	Low	46 Å²	46	86.7 Å²	86.7	20%	0.202	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	136.9	168.9	-66.5	-93.7	0	0	0	109	Y40 V41 R43 T46 E61 L62 E63	Y40-F48 CarbonylContact C-O 3.46Å; Y40-F48 WeakPolarHBondContact CA-O 3.36Å; Y40-F48 WeakPolarHBondContact CB-O 3.14Å; V41-F48 PolarHBondContact N-O 3.31Å; V41-F48 PolarHBondContact O-N 3.02Å; R43-F48 HydrophobicContact CB-CD2 3.97Å; R43-F48 HydrophobicContact CB-CE2 3.8Å; T46-F48 HydrophobicContact CG2-CE2 4.06Å; T46-F48 HydrophobicContact CG2-CZ 4.28Å; T46-F48 WeakPolarHBondContact O-CD2 3.5Å; F48-E61 HydrophobicContact CB-CB 4.07Å; F48-E61 HydrophobicContact CB-CG 4.33Å; F48-E61 HydrophobicContact CD1-CB 4.12Å; F48-E61 HydrophobicContact CG-CB 4.38Å; F48-L62 CarbonylContact C-O 3.56Å; F48-L62 WeakPolarHBondContact CA-O 3.2Å; F48-E63 HydrophobicContact CD1-CB 4.32Å; F48-E63 HydrophobicContact CE1-CB 3.98Å; F48-E63 HydrophobicContact CE1-CG 4.39Å
49	Y	78.6	Confident	64.6	Low	64 Å²	64	88 Å²	88	25%	0.251	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	124.2	171.1	175	-110.7	0	0	0	108.8	C39 Y40 R51 L62 W101	C39-Y49 HydrophobicContact CB-CD2 4.3Å; C39-Y49 HydrophobicContact CB-CE2 3.88Å; C39-Y49 VanDerWaalsContact O-CD2 3.22Å; C39-Y49 WeakPolarHBondContact O-CD2 3.21Å; Y40-Y49 HydrophobicContact CD1-CD2 4.01Å; Y40-Y49 HydrophobicContact CD1-CG 4.44Å; Y40-Y49 AromaticContact CE1-CD2 3.65Å; Y40-Y49 HydrophobicContact CE1-CD2 3.65Å; Y40-Y49 HydrophobicContact CE1-CG 4.15Å; Y40-Y49 AromaticContact CZ-CD2 3.95Å; Y49-R51 HydrophobicContact CE1-CB 4.25Å; Y49-L62 HydrophobicContact CD1-CD1 4.3Å; Y49-L62 PolarHBondContact N-O 3.33Å; Y49-L62 PolarHBondContact O-N 3.06Å; Y49-W101 AromaticContact CD1-CD1 3.5Å; Y49-W101 VanDerWaalsContact CD1-CD1 3.5Å; Y49-W101 HydrophobicContact CD1-CD2 4.36Å; Y49-W101 AromaticContact CD1-CG 3.96Å; Y49-W101 HydrophobicContact CD1-CG 3.96Å; Y49-W101 AromaticContact CD1-NE1 3.62Å; Y49-W101 AromaticContact CE1-CD1 3.98Å; Y49-W101 AromaticContact CE1-NE1 3.76Å; Y49-W101 HydrophobicContact CG-CD2 4.28Å; Y49-W101 HydrophobicContact CG-CG 4.22Å
50	Q	74.2	Confident	64.3	Low	57 Å²	57	87.7 Å²	87.7	27%	0.266	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	116.6	179.3	-79.1	-175.1	-21.3	0	0	110.7	C39 V41 F59 E61	C39-Q50 PolarHBondContact O-N 3.02Å; C39-Q50 VanDerWaalsContact O-N 3.16Å; V41-Q50 HydrophobicContact CG2-CG 4.28Å; Q50-F59 HydrophobicContact CB-CB 4.48Å; Q50-F59 HydrophobicContact CB-CD1 4.27Å; Q50-F59 HydrophobicContact CG-CB 4.41Å; Q50-E61 HydrophobicContact CG-CG 3.84Å; Q50-E61 PolarHBondContact NE2-OE1 3.4Å; Q50-E61 VanDerWaalsContact NE2-OE1 3.1Å
51	R	68.7	Low	64.1	Low	131 Å²	131	89 Å²	89	49%	0.494	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	113.2	174.9	-176.7	-179.8	-179	-172.5	-2.3	109.1	Y49 T60 L62	Y49-R51 HydrophobicContact CE1-CB 4.25Å; R51-T60 PolarHBondContact N-O 2.71Å; R51-T60 PolarHBondContact O-N 3.43Å; R51-T60 PolarHBondContact O-OG1 3.26Å; R51-T60 VanDerWaalsContact O-OG1 3.11Å; R51-L62 HydrophobicContact CB-CD1 4.29Å
52	R	61.8	Low	63.8	Low	157 Å²	157	87.1 Å²	87.1	59%	0.592	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.9	134.2	168.3	-165.7	178.4	-174.5	-176.8	4.7	109.1	N57 F59	R52-N57 PolarHBondContact NH2-OD1 3.19Å; R52-F59 HydrophobicContact CB-CD1 4.26Å; R52-F59 HydrophobicContact CB-CE1 4.26Å; R52-F59 HydrophobicContact CG-CE1 4.49Å
53	Q	54	Low	63.7	Low	96 Å²	96	87.1 Å²	87.1	45%	0.449	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-85.2	154.8	172.9	-59.6	-147.8	45.4	0	0	111.1	G55 T60	Q53-G55 PolarHBondContact O-N 3.24Å; Q53-T60 HydrophobicContact CG-CG2 4.42Å; Q53-T60 VanDerWaalsContact NE2-CG2 3.29Å
54	K	37.8	Very low	63.8	Low	176 Å²	176	80.8 Å²	80.8	77%	0.765	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	119.6	175.3	-165.6	-165.2	179	-159.1	0	108.1	E246	K54-E246 IonicContact NZ-OE1 3.55Å; K54-E246 PolarHBondContact NZ-OE1 2.98Å; K54-E246 IonicContact NZ-OE2 3.61Å
55	G	46.8	Very low	64.2	Low	83 Å²	83	72.8 Å²	72.8	86%	0.856	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.7	1.5	175.3	0	0	0	0	0	116.5	Q53	Q53-G55 PolarHBondContact O-N 3.24Å
56	Q	48.8	Very low	64.1	Low	111 Å²	111	72.3 Å²	72.3	52%	0.519	36%	0.357	S	S	.	.			trans	-131	152.4	173.4	-72.3	178	-21.7	0	0	110.7	D58	Q56-D58 VanDerWaalsContact C-N 3.33Å
57	N	48.3	Very low	64.1	Low	125 Å²	125	76.1 Å²	76.1	67%	0.668	37%	0.371	S	S	*	.	S	Bend	trans	-85.9	-6.4	176.2	-77.5	-31.5	0	0	0	113.3	R52	R52-N57 PolarHBondContact NH2-OD1 3.19Å
58	D	49.4	Very low	63.5	Low	115 Å²	115	80.6 Å²	80.6	62%	0.615	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-78.5	142.5	178.5	-58	-53.1	0	0	0	112.7	Q56	Q56-D58 VanDerWaalsContact C-N 3.33Å
59	F	58.3	Low	63.1	Low	115 Å²	115	81.5 Å²	81.5	50%	0.504	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	121.3	177	-62.9	-92.8	0	0	0	109.8	Q50 R52 E61	Q50-F59 HydrophobicContact CB-CB 4.48Å; Q50-F59 HydrophobicContact CB-CD1 4.27Å; Q50-F59 HydrophobicContact CG-CB 4.41Å; R52-F59 HydrophobicContact CB-CD1 4.26Å; R52-F59 HydrophobicContact CB-CE1 4.26Å; R52-F59 HydrophobicContact CG-CE1 4.49Å; F59-E61 PolarHBondContact O-N 3.44Å
60	T	67.6	Low	62.9	Low	49 Å²	49	84 Å²	84	30%	0.301	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	119.6	166.5	40.5	0	0	0	0	110.1	R51 Q53	R51-T60 PolarHBondContact N-O 2.71Å; R51-T60 PolarHBondContact O-N 3.43Å; R51-T60 PolarHBondContact O-OG1 3.26Å; R51-T60 VanDerWaalsContact O-OG1 3.11Å; Q53-T60 HydrophobicContact CG-CG2 4.42Å; Q53-T60 VanDerWaalsContact NE2-CG2 3.29Å
61	E	73.6	Confident	63.1	Low	51 Å²	51	83 Å²	83	24%	0.238	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	119	175.6	-76.2	-177.7	176.3	0	0	110.4	R43 F48 Q50 F59	R43-E61 WeakPolarHBondContact CD-OE2 3.34Å; R43-E61 IonicContact CZ-OE1 2.8Å; R43-E61 IonicContact CZ-OE2 2.73Å; R43-E61 VanDerWaalsContact CZ-OE2 3.22Å; R43-E61 IonicContact NE-OE1 2.7Å; R43-E61 IonicContact NE-OE2 3.67Å; R43-E61 PolarHBondContact NE-OE2 2.9Å; R43-E61 VanDerWaalsContact NH1-CD 3.28Å; R43-E61 IonicContact NH1-OE1 2.98Å; R43-E61 PolarHBondContact NH1-OE1 3.37Å; R43-E61 IonicContact NH1-OE2 3.9Å; R43-E61 PolarHBondContact NH1-OE2 3.49Å; R43-E61 IonicContact NH2-OE1 2.6Å; F48-E61 HydrophobicContact CB-CB 4.07Å; F48-E61 HydrophobicContact CB-CG 4.33Å; F48-E61 HydrophobicContact CD1-CB 4.12Å; F48-E61 HydrophobicContact CG-CB 4.38Å; Q50-E61 HydrophobicContact CG-CG 3.84Å; Q50-E61 PolarHBondContact NE2-OE1 3.4Å; Q50-E61 VanDerWaalsContact NE2-OE1 3.1Å; F59-E61 PolarHBondContact O-N 3.44Å
62	L	73.2	Confident	63.4	Low	7 Å²	7	82.6 Å²	82.6	4%	0.037	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	125.5	-179.9	-64	167.6	0	0	0	110.3	F48 Y49 R51 V64 S97 Q98 W101	F48-L62 CarbonylContact C-O 3.56Å; F48-L62 WeakPolarHBondContact CA-O 3.2Å; Y49-L62 HydrophobicContact CD1-CD1 4.3Å; Y49-L62 PolarHBondContact N-O 3.33Å; Y49-L62 PolarHBondContact O-N 3.06Å; R51-L62 HydrophobicContact CB-CD1 4.29Å; L62-V64 PolarHBondContact O-N 2.95Å; L62-S97 WeakPolarHBondContact CD2-O 3.49Å; L62-Q98 VanDerWaalsContact CD2-O 3.27Å; L62-Q98 WeakPolarHBondContact CD2-O 3.22Å; L62-W101 HydrophobicContact CB-CB 3.79Å; L62-W101 HydrophobicContact CD1-CB 4.42Å
63	E	74.3	Confident	64.1	Low	38 Å²	38	79.8 Å²	79.8	18%	0.178	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	127.1	-178.7	-174.6	-163	133.9	0	0	110.9	T46 F48 V65 R70 K99 Y100 W101	T46-E63 HydrophobicContact CG2-CG 4Å; F48-E63 HydrophobicContact CD1-CB 4.32Å; F48-E63 HydrophobicContact CE1-CB 3.98Å; F48-E63 HydrophobicContact CE1-CG 4.39Å; E63-V65 HydrophobicContact CG-CG2 4.4Å; E63-V65 PolarHBondContact O-N 3.16Å; E63-V65 VanDerWaalsContact O-N 3.15Å; E63-R70 IonicContact OE1-CZ 3.49Å; E63-R70 IonicContact OE1-NE 3.54Å; E63-R70 IonicContact OE1-NH2 2.71Å; E63-R70 PolarHBondContact OE1-NH2 3.35Å; E63-R70 IonicContact OE2-NH2 3.43Å; E63-R70 PolarHBondContact OE2-NH2 2.82Å; E63-K99 PolarHBondContact N-O 3.31Å; E63-K99 VanDerWaalsContact N-O 3.17Å; E63-Y100 HydrophobicContact CB-CD1 4Å; E63-Y100 HydrophobicContact CB-CE1 4.42Å; E63-W101 PolarHBondContact O-N 3.14Å
64	V	73.7	Confident	65.3	Low	6 Å²	6	76 Å²	76	4%	0.036	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	87.9	-177.1	-179.7	0	0	0	0	111.3	M1 Y7 Y40 L47 L62 L66 W101	M1-V64 HydrophobicContact CE-CG1 4.43Å; Y7-V64 HydrophobicContact CD2-CG1 3.99Å; Y7-V64 HydrophobicContact CE2-CB 4.18Å; Y7-V64 HydrophobicContact CE2-CG1 3.98Å; Y40-V64 HydrophobicContact CD1-CG2 3.86Å; Y40-V64 HydrophobicContact CE1-CG2 3.94Å; L47-V64 HydrophobicContact CB-CB 4.18Å; L47-V64 HydrophobicContact CB-CG2 4.26Å; L47-V64 VanDerWaalsContact O-CB 3.27Å; L47-V64 WeakPolarHBondContact O-CB 3.43Å; L47-V64 WeakPolarHBondContact O-CG2 3.43Å; L47-V64 PolarHBondContact O-N 3.04Å; L62-V64 PolarHBondContact O-N 2.95Å; V64-L66 PolarHBondContact O-N 3.08Å; V64-W101 WeakPolarHBondContact CA-O 3.36Å; V64-W101 HydrophobicContact CG1-CE3 3.99Å; V64-W101 HydrophobicContact CG1-CZ3 4.17Å; V64-W101 HydrophobicContact CG2-CE3 4.04Å
65	V	69.4	Low	67.3	Low	3 Å²	3	67.7 Å²	67.7	2%	0.018	35%	0.348	C	S	.	.			trans	-79.3	113.8	-176.2	-170.9	0	0	0	0	111.7	E63 R70 R71 L74 Y100 W101 W102	E63-V65 HydrophobicContact CG-CG2 4.4Å; E63-V65 PolarHBondContact O-N 3.16Å; E63-V65 VanDerWaalsContact O-N 3.15Å; V65-R70 HydrophobicContact CG1-CB 4.18Å; V65-R70 HydrophobicContact CG1-CG 3.94Å; V65-R71 HydrophobicContact CB-CG 4.48Å; V65-R71 HydrophobicContact CG1-CG 3.94Å; V65-R71 VanDerWaalsContact O-CZ 3.3Å; V65-R71 PolarHBondContact O-NE 2.67Å; V65-R71 PolarHBondContact O-NH2 2.74Å; V65-L74 HydrophobicContact CG1-CD1 4.16Å; V65-L74 HydrophobicContact CG2-CD1 3.79Å; V65-Y100 HydrophobicContact CG2-CD1 3.63Å; V65-Y100 HydrophobicContact CG2-CE1 4.45Å; V65-Y100 HydrophobicContact CG2-CG 4.24Å; V65-W101 PolarHBondContact N-O 3.05Å; V65-W102 HydrophobicContact CB-CE3 3.92Å; V65-W102 HydrophobicContact CB-CZ3 4.23Å; V65-W102 HydrophobicContact CG2-CE3 4.32Å; V65-W102 HydrophobicContact CG2-CZ3 4.32Å
66	L	63.7	Low	68.6	Low	41 Å²	41	67 Å²	67	22%	0.215	33%	0.325	C	S	.	.			trans	-87.5	-41.9	178.9	-88.2	-164.3	0	0	0	116	E4 Y7 V64 R71	E4-L66 HydrophobicContact CB-CD1 4.27Å; E4-L66 HydrophobicContact CG-CD1 4.07Å; Y7-L66 HydrophobicContact CD1-CD1 3.72Å; Y7-L66 HydrophobicContact CD1-CG 4.49Å; Y7-L66 HydrophobicContact CD2-CD1 3.76Å; Y7-L66 HydrophobicContact CD2-CD2 4.25Å; Y7-L66 HydrophobicContact CD2-CG 3.69Å; Y7-L66 HydrophobicContact CE1-CD1 4.35Å; Y7-L66 HydrophobicContact CE2-CD1 4.37Å; Y7-L66 HydrophobicContact CE2-CG 4.14Å; Y7-L66 HydrophobicContact CG-CD1 3.42Å; Y7-L66 VanDerWaalsContact CG-CD1 3.42Å; Y7-L66 HydrophobicContact CG-CG 3.91Å; V64-L66 PolarHBondContact O-N 3.08Å; L66-R71 PolarHBondContact O-NH1 3.07Å; L66-R71 PolarHBondContact O-NH2 2.99Å
67	Q	68.8	Low	69.9	Low	127 Å²	127	68.5 Å²	68.5	59%	0.593	33%	0.332	S	S	*	.			trans	-80.2	130.8	-164.8	-68.2	180	-11.7	0	0	112.3	C69 R70 R71	Q67-C69 VanDerWaalsContact C-N 3.25Å; Q67-C69 PolarHBondContact O-N 3.01Å; Q67-R70 HydrophobicContact CB-CB 4.31Å; Q67-R70 PolarHBondContact O-N 3.49Å; Q67-R71 WeakPolarHBondContact O-CG 3.38Å; Q67-R71 PolarHBondContact O-N 2.85Å
68	D	64.8	Low	71	Confident	94 Å²	94	63.2 Å²	63.2	50%	0.503	31%	0.306	S	S	.	.	H	α-helix	trans	-72.4	-12.2	-177.2	-69.8	-48.6	0	0	0	114.5	R71 R72	D68-R71 WeakPolarHBondContact OD1-CD 3.49Å; D68-R71 IonicContact OD1-CZ 2.67Å; D68-R71 IonicContact OD1-NE 3.97Å; D68-R71 IonicContact OD1-NH1 2.7Å; D68-R71 PolarHBondContact OD1-NH1 2.69Å; D68-R71 IonicContact OD2-NH1 3.86Å; D68-R72 WeakPolarHBondContact O-CG 3.38Å; D68-R72 PolarHBondContact O-NE 3.14Å
69	C	70.6	Confident	72	Confident	66 Å²	66	57.8 Å²	57.8	45%	0.446	28%	0.277	S	S	.	.	H	α-helix	trans	-74.6	-60.8	165.3	-60	0	0	0	0	110.4	Q67 R71 R72 E73	Q67-C69 VanDerWaalsContact C-N 3.25Å; Q67-C69 PolarHBondContact O-N 3.01Å; C69-R71 PolarHBondContact O-N 2.7Å; C69-R71 VanDerWaalsContact O-N 3.13Å; C69-R72 WeakPolarHBondContact O-CA 3.48Å; C69-R72 PolarHBondContact O-N 3.44Å; C69-R72 PolarHBondContact SG-NH2 2.85Å; C69-R72 VanDerWaalsContact SG-NH2 3.42Å; C69-E73 WeakPolarHBondContact CB-OE1 3.48Å; C69-E73 PolarHBondContact O-N 2.87Å
70	R	73.5	Confident	72.9	Confident	115 Å²	115	55.9 Å²	55.9	43%	0.434	27%	0.271	S	S	.	.	H	α-helix	trans	-53.6	-35.4	176.4	-171.7	166.4	164.7	140.9	-9.5	113.4	E63 V65 Q67 E73 L74	E63-R70 IonicContact OE1-CZ 3.49Å; E63-R70 IonicContact OE1-NE 3.54Å; E63-R70 IonicContact OE1-NH2 2.71Å; E63-R70 PolarHBondContact OE1-NH2 3.35Å; E63-R70 IonicContact OE2-NH2 3.43Å; E63-R70 PolarHBondContact OE2-NH2 2.82Å; V65-R70 HydrophobicContact CG1-CB 4.18Å; V65-R70 HydrophobicContact CG1-CG 3.94Å; Q67-R70 HydrophobicContact CB-CB 4.31Å; Q67-R70 PolarHBondContact O-N 3.49Å; R70-E73 WeakPolarHBondContact CA-OE2 3.15Å; R70-E73 PolarHBondContact O-N 2.86Å; R70-L74 HydrophobicContact CG-CD1 4.2Å; R70-L74 HydrophobicContact CG-CG 4.46Å; R70-L74 WeakPolarHBondContact O-CB 3.27Å; R70-L74 VanDerWaalsContact O-CG 3.23Å; R70-L74 WeakPolarHBondContact O-CG 3.4Å; R70-L74 PolarHBondContact O-N 3.2Å
71	R	78.7	Confident	73.1	Confident	36 Å²	36	57.4 Å²	57.4	14%	0.136	28%	0.276	C	S	.	.	H	α-helix	trans	-61	-45	170.6	-73.9	176.6	-176.7	144.2	4.4	113.1	V65 L66 Q67 D68 C69 I75 W102	V65-R71 HydrophobicContact CB-CG 4.48Å; V65-R71 HydrophobicContact CG1-CG 3.94Å; V65-R71 VanDerWaalsContact O-CZ 3.3Å; V65-R71 PolarHBondContact O-NE 2.67Å; V65-R71 PolarHBondContact O-NH2 2.74Å; L66-R71 PolarHBondContact O-NH1 3.07Å; L66-R71 PolarHBondContact O-NH2 2.99Å; Q67-R71 WeakPolarHBondContact O-CG 3.38Å; Q67-R71 PolarHBondContact O-N 2.85Å; D68-R71 WeakPolarHBondContact OD1-CD 3.49Å; D68-R71 IonicContact OD1-CZ 2.67Å; D68-R71 IonicContact OD1-NE 3.97Å; D68-R71 IonicContact OD1-NH1 2.7Å; D68-R71 PolarHBondContact OD1-NH1 2.69Å; D68-R71 IonicContact OD2-NH1 3.86Å; C69-R71 PolarHBondContact O-N 2.7Å; C69-R71 VanDerWaalsContact O-N 3.13Å; R71-I75 WeakPolarHBondContact O-CB 3.43Å; R71-I75 WeakPolarHBondContact O-CD1 3.5Å; R71-I75 WeakPolarHBondContact O-CG1 3.18Å; R71-I75 PolarHBondContact O-N 2.84Å; R71-W102 HydrophobicContact CB-CZ2 4.26Å; R71-W102 HydrophobicContact CG-CD2 3.97Å; R71-W102 HydrophobicContact CG-CE3 4.2Å; R71-W102 HydrophobicContact CG-CG 4.43Å; R71-W102 HydrophobicContact CG-CH2 4.36Å; R71-W102 HydrophobicContact CG-CZ2 4.17Å; R71-W102 HydrophobicContact CG-CZ3 4.37Å
72	R	73.8	Confident	72.2	Confident	124 Å²	124	65 Å²	65	47%	0.468	31%	0.312	S	S	.	.	H	α-helix	trans	-71.7	-33.1	178.9	-73.4	179	-67.4	151.9	4.7	112	D68 C69 N76 H112	D68-R72 WeakPolarHBondContact O-CG 3.38Å; D68-R72 PolarHBondContact O-NE 3.14Å; C69-R72 WeakPolarHBondContact O-CA 3.48Å; C69-R72 PolarHBondContact O-N 3.44Å; C69-R72 PolarHBondContact SG-NH2 2.85Å; C69-R72 VanDerWaalsContact SG-NH2 3.42Å; R72-N76 WeakPolarHBondContact O-CB 3.17Å; R72-N76 PolarHBondContact O-N 2.8Å; R72-N76 PolarHBondContact O-ND2 2.93Å; R72-H112 PolarHBondContact O-CE1 3.16Å
73	E	77.8	Confident	71.3	Confident	98 Å²	98	67.9 Å²	67.9	46%	0.458	34%	0.344	S	S	.	.	H	α-helix	trans	-63.6	-49	171.2	-70.2	144.6	-142.7	0	0	111.3	C69 R70 I75 N76 Q77	C69-E73 WeakPolarHBondContact CB-OE1 3.48Å; C69-E73 PolarHBondContact O-N 2.87Å; R70-E73 WeakPolarHBondContact CA-OE2 3.15Å; R70-E73 PolarHBondContact O-N 2.86Å; E73-I75 PolarHBondContact O-N 2.82Å; E73-N76 WeakPolarHBondContact O-CB 3.39Å; E73-N76 PolarHBondContact O-N 3.17Å; E73-Q77 WeakPolarHBondContact O-CG 3.4Å; E73-Q77 PolarHBondContact O-N 3.19Å
74	L	79.2	Confident	70.7	Confident	15 Å²	15	68.3 Å²	68.3	8%	0.079	36%	0.358	C	S	.	.	H	α-helix	trans	-64.7	-36.8	175.8	-69.7	173.1	0	0	0	112.7	V65 R70 A78 Y100	V65-L74 HydrophobicContact CG1-CD1 4.16Å; V65-L74 HydrophobicContact CG2-CD1 3.79Å; R70-L74 HydrophobicContact CG-CD1 4.2Å; R70-L74 HydrophobicContact CG-CG 4.46Å; R70-L74 WeakPolarHBondContact O-CB 3.27Å; R70-L74 VanDerWaalsContact O-CG 3.23Å; R70-L74 WeakPolarHBondContact O-CG 3.4Å; R70-L74 PolarHBondContact O-N 3.2Å; L74-A78 WeakPolarHBondContact O-CB 3.27Å; L74-A78 PolarHBondContact O-N 2.95Å; L74-Y100 HydrophobicContact CD1-CD1 3.81Å; L74-Y100 HydrophobicContact CD1-CD2 4.22Å; L74-Y100 HydrophobicContact CD1-CE1 3.81Å; L74-Y100 HydrophobicContact CD1-CE2 4.19Å; L74-Y100 HydrophobicContact CD1-CG 4.04Å; L74-Y100 HydrophobicContact CD2-CE1 4.12Å; L74-Y100 HydrophobicContact CD2-CE2 3.76Å; L74-Y100 WeakPolarHBondContact CD2-OH 3.44Å; L74-Y100 HydrophobicContact CG-CE2 4.46Å
75	I	79.7	Confident	70.1	Confident	2 Å²	2	74.9 Å²	74.9	1%	0.01	39%	0.388	C	S	.	.	H	α-helix	trans	-65.7	-41.9	172.2	-65.9	160.8	0	0	0	110.6	R71 E73 A78 H79 I96 W102 N108 V109 H112	R71-I75 WeakPolarHBondContact O-CB 3.43Å; R71-I75 WeakPolarHBondContact O-CD1 3.5Å; R71-I75 WeakPolarHBondContact O-CG1 3.18Å; R71-I75 PolarHBondContact O-N 2.84Å; E73-I75 PolarHBondContact O-N 2.82Å; I75-A78 PolarHBondContact O-N 3.03Å; I75-H79 WeakPolarHBondContact O-CB 3.33Å; I75-H79 PolarHBondContact O-N 2.86Å; I75-I96 HydrophobicContact CB-CD1 4.29Å; I75-I96 HydrophobicContact CG1-CD1 3.79Å; I75-W102 HydrophobicContact CD1-CZ2 4.07Å; I75-W102 HydrophobicContact CG1-CH2 4.38Å; I75-W102 HydrophobicContact CG1-CZ2 4.09Å; I75-N108 HydrophobicContact CD1-CB 3.95Å; I75-V109 HydrophobicContact CD1-CG2 4.32Å; I75-V109 HydrophobicContact CG1-CG2 4.04Å; I75-V109 HydrophobicContact CG2-CG2 4.29Å; I75-H112 HydrophobicContact CD1-CB 4.47Å; I75-H112 HydrophobicContact CG2-CB 3.92Å
76	N	74.4	Confident	70.2	Confident	69 Å²	69	77 Å²	77	37%	0.369	40%	0.398	S	S	.	.	H	α-helix	trans	-59.7	-50.4	174.6	-85.9	-34.6	0	0	0	111.6	R72 E73 A78 H79 I80 H112	R72-N76 WeakPolarHBondContact O-CB 3.17Å; R72-N76 PolarHBondContact O-N 2.8Å; R72-N76 PolarHBondContact O-ND2 2.93Å; E73-N76 WeakPolarHBondContact O-CB 3.39Å; E73-N76 PolarHBondContact O-N 3.17Å; N76-A78 VanDerWaalsContact C-N 3.3Å; N76-A78 PolarHBondContact O-N 3.17Å; N76-H79 PolarHBondContact O-N 3.13Å; N76-H79 VanDerWaalsContact O-N 3.09Å; N76-I80 PolarHBondContact O-N 3.23Å; N76-H112 PolarHBondContact OD1-CE1 3.21Å; N76-H112 PolarHBondContact OD1-NE2 3.29Å
77	Q	75.6	Confident	70.6	Confident	142 Å²	142	76.6 Å²	76.6	66%	0.664	40%	0.396	S	S	*	.	H	α-helix	trans	-62.6	-33.1	-179.2	-71.7	169.9	-6	0	0	113	E73	E73-Q77 WeakPolarHBondContact O-CG 3.4Å; E73-Q77 PolarHBondContact O-N 3.19Å
78	A	71.9	Confident	70.7	Confident	15 Å²	15	75.2 Å²	75.2	12%	0.124	39%	0.392	C	S	.	.	H	α-helix	trans	-87.8	-9.4	175.1	0	0	0	0	0	114.1	L74 I75 N76 L87 I95 I96	L74-A78 WeakPolarHBondContact O-CB 3.27Å; L74-A78 PolarHBondContact O-N 2.95Å; I75-A78 PolarHBondContact O-N 3.03Å; N76-A78 VanDerWaalsContact C-N 3.3Å; N76-A78 PolarHBondContact O-N 3.17Å; A78-L87 WeakPolarHBondContact O-CD1 3.44Å; A78-I95 HydrophobicContact CB-CG2 4.03Å; A78-I96 HydrophobicContact CB-CD1 3.93Å; A78-I96 HydrophobicContact CB-CG1 3.5Å; A78-I96 VanDerWaalsContact CB-CG1 3.5Å
79	H	70.5	Confident	71.1	Confident	1 Å²	1	73.1 Å²	73.1	1%	0.005	38%	0.379	C	S	.	.	H	α-helix	trans	-98.8	-28.8	179.5	178.6	48.8	0	0	0	113.1	I75 N76 H86 L87 T92 C119	I75-H79 WeakPolarHBondContact O-CB 3.33Å; I75-H79 PolarHBondContact O-N 2.86Å; N76-H79 PolarHBondContact O-N 3.13Å; N76-H79 VanDerWaalsContact O-N 3.09Å; H79-H86 AromaticContact CD2-ND1 3.56Å; H79-H86 AromaticContact CE1-ND1 3.64Å; H79-H86 AromaticContact NE2-CG 3.89Å; H79-H86 AromaticContact NE2-ND1 3.02Å; H79-H86 PolarHBondContact NE2-ND1 3.19Å; H79-H86 CarbonylContact O-C 3.54Å; H79-H86 WeakPolarHBondContact O-CA 3.45Å; H79-L87 PolarHBondContact CE1-O 3.28Å; H79-L87 VanDerWaalsContact CE1-O 3.28Å; H79-L87 PolarHBondContact ND1-O 3.15Å; H79-L87 PolarHBondContact O-N 3.42Å; H79-T92 HydrophobicContact CB-CG2 3.9Å; H79-C119 VanDerWaalsContact CE1-SG 3.59Å; H79-C119 PolarHBondContact NE2-SG 2.86Å; H79-C119 VanDerWaalsContact NE2-SG 3.42Å
80	I	76	Confident	71	Confident	75 Å²	75	75.8 Å²	75.8	39%	0.385	39%	0.385	S	S	.	.	B	Isolated β-bridge	trans	-106.3	107.1	178.3	-56.1	170.6	0	0	0	107.7	N76	N76-I80 PolarHBondContact O-N 3.23Å
81	I	71.3	Confident	71	Confident	80 Å²	80	74 Å²	74	41%	0.41	38%	0.384	S	S	.	.			trans	-69.9	155.7	170	-58.2	166.3	0	0	0	108.5	G83 G84 E85 L87	I81-G83 PolarHBondContact O-N 3.06Å; I81-G84 PolarHBondContact O-N 2.83Å; I81-E85 PolarHBondContact N-O 3.08Å; I81-E85 VanDerWaalsContact N-O 3.15Å; I81-L87 HydrophobicContact CD1-CD1 3.82Å; I81-L87 HydrophobicContact CD1-CD2 3.87Å; I81-L87 HydrophobicContact CD1-CG 3.62Å; I81-L87 HydrophobicContact CG1-CD1 3.65Å; I81-L87 HydrophobicContact CG1-CG 3.84Å
82	E	56.3	Low	70.9	Confident	211 Å²	211	72.3 Å²	72.3	99%	0.986	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-14.1	176.4	-59.7	-178.7	144.2	0	0	114.7
83	G	52.6	Low	71.1	Confident	68 Å²	68	71 Å²	71	70%	0.701	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	2.2	169	0	0	0	0	0	115.7	I81 E85	I81-G83 PolarHBondContact O-N 3.06Å; G83-E85 VanDerWaalsContact C-N 3.31Å; G83-E85 PolarHBondContact O-N 2.84Å
84	G	61.6	Low	71	Confident	46 Å²	46	70 Å²	70	47%	0.474	37%	0.368	S	S	.	.	S	Bend	trans	79.5	5.5	-178.3	0	0	0	0	0	115.3	I81	I81-G84 PolarHBondContact O-N 2.83Å
85	E	62.7	Low	71	Confident	144 Å²	144	72.6 Å²	72.6	67%	0.673	38%	0.381	S	S	*	.			trans	-85.6	139.1	179.4	-62.1	-153.5	135.5	0	0	112.9	I81 G83	I81-E85 PolarHBondContact N-O 3.08Å; I81-E85 VanDerWaalsContact N-O 3.15Å; G83-E85 VanDerWaalsContact C-N 3.31Å; G83-E85 PolarHBondContact O-N 2.84Å
86	H	70.4	Confident	71	Confident	48 Å²	48	72.6 Å²	72.6	22%	0.222	38%	0.381	C	S	.	.	B	Isolated β-bridge	trans	-90.2	109.9	-178.8	-74.9	-97.1	0	0	0	111.4	H79 C116 Q118	H79-H86 AromaticContact CD2-ND1 3.56Å; H79-H86 AromaticContact CE1-ND1 3.64Å; H79-H86 AromaticContact NE2-CG 3.89Å; H79-H86 AromaticContact NE2-ND1 3.02Å; H79-H86 PolarHBondContact NE2-ND1 3.19Å; H79-H86 CarbonylContact O-C 3.54Å; H79-H86 WeakPolarHBondContact O-CA 3.45Å; H86-C116 PolarHBondContact CE1-SG 2.86Å; H86-Q118 VanDerWaalsContact NE2-CD 3.35Å; H86-Q118 PolarHBondContact NE2-NE2 3.46Å; H86-Q118 PolarHBondContact NE2-OE1 3.11Å
87	L	72.4	Confident	71.1	Confident	33 Å²	33	70.2 Å²	70.2	17%	0.173	37%	0.37	C	S	.	.			trans	-66.4	149.2	-179.5	-86.5	169.3	0	0	0	113.7	A78 H79 I81 L91 T92 I95	A78-L87 WeakPolarHBondContact O-CD1 3.44Å; H79-L87 PolarHBondContact CE1-O 3.28Å; H79-L87 VanDerWaalsContact CE1-O 3.28Å; H79-L87 PolarHBondContact ND1-O 3.15Å; H79-L87 PolarHBondContact O-N 3.42Å; I81-L87 HydrophobicContact CD1-CD1 3.82Å; I81-L87 HydrophobicContact CD1-CD2 3.87Å; I81-L87 HydrophobicContact CD1-CG 3.62Å; I81-L87 HydrophobicContact CG1-CD1 3.65Å; I81-L87 HydrophobicContact CG1-CG 3.84Å; L87-L91 HydrophobicContact CD2-CB 3.94Å; L87-L91 HydrophobicContact CD2-CD1 3.69Å; L87-L91 HydrophobicContact CD2-CG 4.47Å; L87-T92 HydrophobicContact CB-CG2 3.45Å; L87-T92 VanDerWaalsContact CB-CG2 3.45Å; L87-I95 HydrophobicContact CD1-CD1 3.67Å
88	N	71.4	Confident	71.1	Confident	97 Å²	97	70 Å²	70	52%	0.519	37%	0.37	S	S	.	.			trans	-67.3	151.8	177.7	-171.2	10.7	0	0	0	112	Q90 L91 T92	N88-Q90 PolarHBondContact O-N 3.34Å; N88-L91 HydrophobicContact CB-CD1 4.3Å; N88-L91 PolarHBondContact O-N 2.87Å; N88-L91 VanDerWaalsContact O-N 3.14Å; N88-T92 PolarHBondContact O-N 2.89Å; N88-T92 PolarHBondContact O-OG1 2.97Å; N88-T92 VanDerWaalsContact O-OG1 3.08Å
89	Q	73.3	Confident	71.2	Confident	50 Å²	50	75.6 Å²	75.6	23%	0.234	39%	0.391	C	S	.	.	H	α-helix	trans	-56.4	-26.5	-173.9	-157.4	-147.6	-81.1	0	0	114.2	T92 W93 L106 V109 K110 I113	Q89-T92 WeakPolarHBondContact CA-OG1 3.43Å; Q89-T92 PolarHBondContact O-OG1 3.1Å; Q89-W93 WeakPolarHBondContact O-CB 3.48Å; Q89-W93 PolarHBondContact O-N 3.2Å; Q89-L106 VanDerWaalsContact NE2-CD1 3.33Å; Q89-V109 HydrophobicContact CG-CG1 4.01Å; Q89-K110 HydrophobicContact CG-CB 4.3Å; Q89-K110 VanDerWaalsContact OE1-CG 3.29Å; Q89-I113 HydrophobicContact CB-CD1 4.21Å; Q89-I113 HydrophobicContact CG-CD1 4.16Å
90	Q	67.4	Low	71.5	Confident	122 Å²	122	78.3 Å²	78.3	57%	0.57	40%	0.401	S	S	*	.	H	α-helix	trans	-78.6	-55.4	175.1	-73	164.3	-71.7	0	0	111.3	N88 T92 W93 E94	N88-Q90 PolarHBondContact O-N 3.34Å; Q90-T92 VanDerWaalsContact C-N 3.32Å; Q90-T92 PolarHBondContact O-N 3.19Å; Q90-W93 CarbonylContact O-C 3.57Å; Q90-W93 WeakPolarHBondContact O-CA 3.22Å; Q90-W93 WeakPolarHBondContact O-CB 3.4Å; Q90-W93 PolarHBondContact O-N 3.38Å; Q90-E94 PolarHBondContact O-N 2.96Å
91	L	73.4	Confident	71.6	Confident	78 Å²	78	77.6 Å²	77.6	41%	0.408	39%	0.394	S	S	.	.	H	α-helix	trans	-57.1	-42.1	178.5	-61.1	171.7	0	0	0	112.4	L87 N88 W93 E94 I95	L87-L91 HydrophobicContact CD2-CB 3.94Å; L87-L91 HydrophobicContact CD2-CD1 3.69Å; L87-L91 HydrophobicContact CD2-CG 4.47Å; N88-L91 HydrophobicContact CB-CD1 4.3Å; N88-L91 PolarHBondContact O-N 2.87Å; N88-L91 VanDerWaalsContact O-N 3.14Å; L91-W93 VanDerWaalsContact C-N 3.29Å; L91-W93 PolarHBondContact O-N 2.97Å; L91-E94 PolarHBondContact O-N 2.82Å; L91-I95 WeakPolarHBondContact O-CG1 3.22Å; L91-I95 PolarHBondContact O-N 3.1Å
92	T	76.7	Confident	71.9	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-62.7	-35.4	173.4	52.1	0	0	0	0	112.8	H79 L87 N88 Q89 Q90 I96 V109 I113	H79-T92 HydrophobicContact CB-CG2 3.9Å; L87-T92 HydrophobicContact CB-CG2 3.45Å; L87-T92 VanDerWaalsContact CB-CG2 3.45Å; N88-T92 PolarHBondContact O-N 2.89Å; N88-T92 PolarHBondContact O-OG1 2.97Å; N88-T92 VanDerWaalsContact O-OG1 3.08Å; Q89-T92 WeakPolarHBondContact CA-OG1 3.43Å; Q89-T92 PolarHBondContact O-OG1 3.1Å; Q90-T92 VanDerWaalsContact C-N 3.32Å; Q90-T92 PolarHBondContact O-N 3.19Å; T92-I96 WeakPolarHBondContact O-CB 3.39Å; T92-I96 WeakPolarHBondContact O-CD1 3.39Å; T92-I96 WeakPolarHBondContact O-CG1 3.42Å; T92-I96 PolarHBondContact O-N 3.17Å; T92-V109 WeakPolarHBondContact OG1-CG1 3.43Å; T92-I113 HydrophobicContact CG2-CD1 4.3Å
93	W	79.1	Confident	72.5	Confident	97 Å²	97	73.5 Å²	73.5	37%	0.367	36%	0.364	S	S	.	.	H	α-helix	trans	-73.2	-40.5	177.3	167.3	73.5	0	0	0	111.1	Q89 Q90 L91 I96 S97 L106	Q89-W93 WeakPolarHBondContact O-CB 3.48Å; Q89-W93 PolarHBondContact O-N 3.2Å; Q90-W93 CarbonylContact O-C 3.57Å; Q90-W93 WeakPolarHBondContact O-CA 3.22Å; Q90-W93 WeakPolarHBondContact O-CB 3.4Å; Q90-W93 PolarHBondContact O-N 3.38Å; L91-W93 VanDerWaalsContact C-N 3.29Å; L91-W93 PolarHBondContact O-N 2.97Å; W93-I96 PolarHBondContact O-N 3.4Å; W93-S97 WeakPolarHBondContact O-CB 3.29Å; W93-S97 PolarHBondContact O-N 3.37Å; W93-S97 PolarHBondContact O-OG 2.88Å; W93-L106 HydrophobicContact CB-CD1 3.82Å; W93-L106 HydrophobicContact CD2-CD1 4.31Å; W93-L106 HydrophobicContact CG-CB 4.29Å; W93-L106 HydrophobicContact CG-CD1 3.76Å
94	E	76.1	Confident	73.6	Confident	76 Å²	76	72.1 Å²	72.1	36%	0.355	35%	0.35	S	S	.	.	H	α-helix	trans	-58.1	-57	176.8	-76.2	156.7	-154.4	0	0	111.2	Q90 L91 I96 S97 Q98	Q90-E94 PolarHBondContact O-N 2.96Å; L91-E94 PolarHBondContact O-N 2.82Å; E94-I96 VanDerWaalsContact C-N 3.29Å; E94-I96 PolarHBondContact O-N 3.02Å; E94-S97 PolarHBondContact O-N 3.09Å; E94-S97 PolarHBondContact O-OG 3.47Å; E94-Q98 WeakPolarHBondContact O-CG 3.48Å; E94-Q98 PolarHBondContact O-N 3.12Å; E94-Q98 VanDerWaalsContact O-N 3.08Å
95	I	78.1	Confident	74.4	Confident	70 Å²	70	70.6 Å²	70.6	36%	0.359	33%	0.331	S	S	.	.	H	α-helix	trans	-54.5	-43.3	179.4	-67	165.6	0	0	0	111.8	A78 L87 L91	A78-I95 HydrophobicContact CB-CG2 4.03Å; L87-I95 HydrophobicContact CD1-CD1 3.67Å; L91-I95 WeakPolarHBondContact O-CG1 3.22Å; L91-I95 PolarHBondContact O-N 3.1Å
96	I	80.2	Confident	74.8	Confident	2 Å²	2	67.4 Å²	67.4	1%	0.01	32%	0.318	C	S	.	.	H	α-helix	trans	-69.1	-44.6	178	-64.5	168.5	0	0	0	110.6	I75 A78 T92 W93 E94 Q98 K99 Y100 W102 I105 V109	I75-I96 HydrophobicContact CB-CD1 4.29Å; I75-I96 HydrophobicContact CG1-CD1 3.79Å; A78-I96 HydrophobicContact CB-CD1 3.93Å; A78-I96 HydrophobicContact CB-CG1 3.5Å; A78-I96 VanDerWaalsContact CB-CG1 3.5Å; T92-I96 WeakPolarHBondContact O-CB 3.39Å; T92-I96 WeakPolarHBondContact O-CD1 3.39Å; T92-I96 WeakPolarHBondContact O-CG1 3.42Å; T92-I96 PolarHBondContact O-N 3.17Å; W93-I96 PolarHBondContact O-N 3.4Å; E94-I96 VanDerWaalsContact C-N 3.29Å; E94-I96 PolarHBondContact O-N 3.02Å; I96-Q98 PolarHBondContact O-N 3.39Å; I96-K99 PolarHBondContact O-N 3.46Å; I96-K99 VanDerWaalsContact O-N 3.13Å; I96-Y100 HydrophobicContact CG2-CD2 4.4Å; I96-Y100 PolarHBondContact O-N 2.8Å; I96-W102 HydrophobicContact CG2-CH2 3.44Å; I96-W102 VanDerWaalsContact CG2-CH2 3.44Å; I96-W102 HydrophobicContact CG2-CZ2 4.14Å; I96-W102 HydrophobicContact CG2-CZ3 3.83Å; I96-I105 HydrophobicContact CB-CG2 4.2Å; I96-I105 HydrophobicContact CG2-CD1 4.45Å; I96-I105 HydrophobicContact CG2-CG2 3.6Å; I96-V109 HydrophobicContact CD1-CG2 3.79Å
97	S	76.6	Confident	75.2	Confident	20 Å²	20	71.4 Å²	71.4	14%	0.14	34%	0.335	C	S	.	.	H	α-helix	trans	-67.9	-17.1	-176.1	74.8	0	0	0	0	114.7	L62 W93 E94	L62-S97 WeakPolarHBondContact CD2-O 3.49Å; W93-S97 WeakPolarHBondContact O-CB 3.29Å; W93-S97 PolarHBondContact O-N 3.37Å; W93-S97 PolarHBondContact O-OG 2.88Å; E94-S97 PolarHBondContact O-N 3.09Å; E94-S97 PolarHBondContact O-OG 3.47Å
98	Q	75.6	Confident	75.3	Confident	138 Å²	138	72 Å²	72	65%	0.645	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-20.8	173.8	-72.8	172.8	3.1	0	0	113.5	L62 E94 I96	L62-Q98 VanDerWaalsContact CD2-O 3.27Å; L62-Q98 WeakPolarHBondContact CD2-O 3.22Å; E94-Q98 WeakPolarHBondContact O-CG 3.48Å; E94-Q98 PolarHBondContact O-N 3.12Å; E94-Q98 VanDerWaalsContact O-N 3.08Å; I96-Q98 PolarHBondContact O-N 3.39Å
99	K	73.1	Confident	75.7	Confident	132 Å²	132	67.4 Å²	67.4	57%	0.574	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.8	-30.9	-173.4	-64.1	-176.8	-179.8	180	0	114.1	E63 I96	E63-K99 PolarHBondContact N-O 3.31Å; E63-K99 VanDerWaalsContact N-O 3.17Å; I96-K99 PolarHBondContact O-N 3.46Å; I96-K99 VanDerWaalsContact O-N 3.13Å
100	Y	77.6	Confident	76	Confident	57 Å²	57	70.4 Å²	70.4	22%	0.224	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	147.4	-171.3	-54.6	-75.3	0	0	0	112.4	E63 V65 L74 I96 W102 I105	E63-Y100 HydrophobicContact CB-CD1 4Å; E63-Y100 HydrophobicContact CB-CE1 4.42Å; V65-Y100 HydrophobicContact CG2-CD1 3.63Å; V65-Y100 HydrophobicContact CG2-CE1 4.45Å; V65-Y100 HydrophobicContact CG2-CG 4.24Å; L74-Y100 HydrophobicContact CD1-CD1 3.81Å; L74-Y100 HydrophobicContact CD1-CD2 4.22Å; L74-Y100 HydrophobicContact CD1-CE1 3.81Å; L74-Y100 HydrophobicContact CD1-CE2 4.19Å; L74-Y100 HydrophobicContact CD1-CG 4.04Å; L74-Y100 HydrophobicContact CD2-CE1 4.12Å; L74-Y100 HydrophobicContact CD2-CE2 3.76Å; L74-Y100 WeakPolarHBondContact CD2-OH 3.44Å; L74-Y100 HydrophobicContact CG-CE2 4.46Å; I96-Y100 HydrophobicContact CG2-CD2 4.4Å; I96-Y100 PolarHBondContact O-N 2.8Å; Y100-W102 HydrophobicContact CG-CZ3 4.42Å; Y100-I105 WeakPolarHBondContact O-CD1 3.34Å
101	W	77.2	Confident	76.5	Confident	60 Å²	60	66.2 Å²	66.2	23%	0.227	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	126.5	178.5	-172.8	96.7	0	0	0	112.4	M1 Y40 Y49 L62 E63 V64 V65	M1-W101 HydrophobicContact CB-CH2 3.98Å; M1-W101 HydrophobicContact CB-CZ3 3.96Å; M1-W101 HydrophobicContact CG-CH2 3.75Å; M1-W101 HydrophobicContact CG-CZ3 3.76Å; Y40-W101 HydrophobicContact CE1-CE3 4.43Å; Y40-W101 HydrophobicContact CE1-CH2 4.34Å; Y40-W101 HydrophobicContact CE1-CZ3 4.07Å; Y40-W101 VanDerWaalsContact OH-CH2 3.23Å; Y40-W101 WeakPolarHBondContact OH-CH2 3.4Å; Y49-W101 AromaticContact CD1-CD1 3.5Å; Y49-W101 VanDerWaalsContact CD1-CD1 3.5Å; Y49-W101 HydrophobicContact CD1-CD2 4.36Å; Y49-W101 AromaticContact CD1-CG 3.96Å; Y49-W101 HydrophobicContact CD1-CG 3.96Å; Y49-W101 AromaticContact CD1-NE1 3.62Å; Y49-W101 AromaticContact CE1-CD1 3.98Å; Y49-W101 AromaticContact CE1-NE1 3.76Å; Y49-W101 HydrophobicContact CG-CD2 4.28Å; Y49-W101 HydrophobicContact CG-CG 4.22Å; L62-W101 HydrophobicContact CB-CB 3.79Å; L62-W101 HydrophobicContact CD1-CB 4.42Å; E63-W101 PolarHBondContact O-N 3.14Å; V64-W101 WeakPolarHBondContact CA-O 3.36Å; V64-W101 HydrophobicContact CG1-CE3 3.99Å; V64-W101 HydrophobicContact CG1-CZ3 4.17Å; V64-W101 HydrophobicContact CG2-CE3 4.04Å; V65-W101 PolarHBondContact N-O 3.05Å
102	W	77.6	Confident	76.5	Confident	7 Å²	7	63.5 Å²	63.5	3%	0.027	29%	0.293	C	S	.	.			trans	-153.4	160.9	162	62.8	89	0	0	0	111.2	V65 R71 I75 I96 Y100 G104 I105	V65-W102 HydrophobicContact CB-CE3 3.92Å; V65-W102 HydrophobicContact CB-CZ3 4.23Å; V65-W102 HydrophobicContact CG2-CE3 4.32Å; V65-W102 HydrophobicContact CG2-CZ3 4.32Å; R71-W102 HydrophobicContact CB-CZ2 4.26Å; R71-W102 HydrophobicContact CG-CD2 3.97Å; R71-W102 HydrophobicContact CG-CE3 4.2Å; R71-W102 HydrophobicContact CG-CG 4.43Å; R71-W102 HydrophobicContact CG-CH2 4.36Å; R71-W102 HydrophobicContact CG-CZ2 4.17Å; R71-W102 HydrophobicContact CG-CZ3 4.37Å; I75-W102 HydrophobicContact CD1-CZ2 4.07Å; I75-W102 HydrophobicContact CG1-CH2 4.38Å; I75-W102 HydrophobicContact CG1-CZ2 4.09Å; I96-W102 HydrophobicContact CG2-CH2 3.44Å; I96-W102 VanDerWaalsContact CG2-CH2 3.44Å; I96-W102 HydrophobicContact CG2-CZ2 4.14Å; I96-W102 HydrophobicContact CG2-CZ3 3.83Å; Y100-W102 HydrophobicContact CG-CZ3 4.42Å; W102-G104 PolarHBondContact O-N 3.15Å; W102-G104 VanDerWaalsContact O-N 3.09Å; W102-I105 HydrophobicContact CD2-CG1 4.03Å; W102-I105 HydrophobicContact CG-CG1 4.15Å; W102-I105 HydrophobicContact CH2-CG2 4.45Å; W102-I105 HydrophobicContact CZ2-CG2 3.92Å; W102-I105 VanDerWaalsContact O-CG1 3.22Å; W102-I105 WeakPolarHBondContact O-CG1 3.34Å
103	R	70.4	Confident	76.4	Confident	198 Å²	198	64.8 Å²	64.8	75%	0.747	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	113.3	-179.5	-171.2	-179.2	-173.4	-174.3	2.7	110.6
104	G	74.6	Confident	76.3	Confident	39 Å²	39	66.6 Å²	66.6	40%	0.402	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.4	29.9	171	0	0	0	0	0	115.8	W102 L106 K107 N108	W102-G104 PolarHBondContact O-N 3.15Å; W102-G104 VanDerWaalsContact O-N 3.09Å; G104-L106 VanDerWaalsContact C-N 3.3Å; G104-L106 PolarHBondContact O-N 3.43Å; G104-K107 WeakPolarHBondContact O-CA 3.39Å; G104-K107 WeakPolarHBondContact O-CB 3.38Å; G104-K107 PolarHBondContact O-N 3.49Å; G104-N108 PolarHBondContact O-N 3.12Å; G104-N108 VanDerWaalsContact O-N 3.1Å
105	I	77.9	Confident	76	Confident	15 Å²	15	69.6 Å²	69.6	8%	0.077	32%	0.32	C	S	.	.	H	α-helix	trans	-40.1	-55.6	177.1	-46.8	-174.5	0	0	0	112.1	I96 Y100 W102 K107 N108 V109	I96-I105 HydrophobicContact CB-CG2 4.2Å; I96-I105 HydrophobicContact CG2-CD1 4.45Å; I96-I105 HydrophobicContact CG2-CG2 3.6Å; Y100-I105 WeakPolarHBondContact O-CD1 3.34Å; W102-I105 HydrophobicContact CD2-CG1 4.03Å; W102-I105 HydrophobicContact CG-CG1 4.15Å; W102-I105 HydrophobicContact CH2-CG2 4.45Å; W102-I105 HydrophobicContact CZ2-CG2 3.92Å; W102-I105 VanDerWaalsContact O-CG1 3.22Å; W102-I105 WeakPolarHBondContact O-CG1 3.34Å; I105-K107 VanDerWaalsContact C-N 3.26Å; I105-K107 PolarHBondContact O-N 2.84Å; I105-N108 PolarHBondContact O-N 3.09Å; I105-N108 VanDerWaalsContact O-N 3.1Å; I105-V109 HydrophobicContact CG2-CG2 4.17Å; I105-V109 WeakPolarHBondContact O-CB 3.48Å; I105-V109 WeakPolarHBondContact O-CG2 3.43Å; I105-V109 PolarHBondContact O-N 3.37Å
106	L	72.6	Confident	75.9	Confident	77 Å²	77	67.1 Å²	67.1	40%	0.403	31%	0.309	S	S	.	.	H	α-helix	trans	-57.7	-33.2	-179	-172.4	67.3	0	0	0	113.7	Q89 W93 G104 K110	Q89-L106 VanDerWaalsContact NE2-CD1 3.33Å; W93-L106 HydrophobicContact CB-CD1 3.82Å; W93-L106 HydrophobicContact CD2-CD1 4.31Å; W93-L106 HydrophobicContact CG-CB 4.29Å; W93-L106 HydrophobicContact CG-CD1 3.76Å; G104-L106 VanDerWaalsContact C-N 3.3Å; G104-L106 PolarHBondContact O-N 3.43Å; L106-K110 WeakPolarHBondContact O-CB 3.27Å; L106-K110 PolarHBondContact O-N 3.04Å
107	K	78.6	Confident	75.3	Confident	132 Å²	132	70.2 Å²	70.2	57%	0.574	34%	0.335	S	S	*	.	H	α-helix	trans	-72.9	-46.3	175.7	-170.9	-171.9	175	-71.9	0	110.8	G104 I105 V109 K110 D111	G104-K107 WeakPolarHBondContact O-CA 3.39Å; G104-K107 WeakPolarHBondContact O-CB 3.38Å; G104-K107 PolarHBondContact O-N 3.49Å; I105-K107 VanDerWaalsContact C-N 3.26Å; I105-K107 PolarHBondContact O-N 2.84Å; K107-V109 VanDerWaalsContact C-N 3.34Å; K107-V109 PolarHBondContact O-N 2.92Å; K107-K110 CarbonylContact O-C 3.59Å; K107-K110 PolarHBondContact O-N 2.98Å; K107-K110 VanDerWaalsContact O-N 3.14Å; K107-D111 IonicContact NZ-OD2 3.99Å; K107-D111 PolarHBondContact NZ-OD2 3.03Å; K107-D111 PolarHBondContact O-N 3.02Å
108	N	74.9	Confident	74.6	Confident	45 Å²	45	74.9 Å²	74.9	24%	0.241	35%	0.354	C	S	.	.	H	α-helix	trans	-63.5	-42.1	179.1	-71.6	29.5	0	0	0	110.9	I75 G104 I105 D111 H112	I75-N108 HydrophobicContact CD1-CB 3.95Å; G104-N108 PolarHBondContact O-N 3.12Å; G104-N108 VanDerWaalsContact O-N 3.1Å; I105-N108 PolarHBondContact O-N 3.09Å; I105-N108 VanDerWaalsContact O-N 3.1Å; N108-D111 PolarHBondContact O-N 3.22Å; N108-H112 WeakPolarHBondContact O-CB 3.36Å; N108-H112 PolarHBondContact O-N 3.22Å
109	V	78.7	Confident	74.3	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-57.3	-47.4	170.2	170	0	0	0	0	111	I75 Q89 T92 I96 I105 K107 D111 H112 I113	I75-V109 HydrophobicContact CD1-CG2 4.32Å; I75-V109 HydrophobicContact CG1-CG2 4.04Å; I75-V109 HydrophobicContact CG2-CG2 4.29Å; Q89-V109 HydrophobicContact CG-CG1 4.01Å; T92-V109 WeakPolarHBondContact OG1-CG1 3.43Å; I96-V109 HydrophobicContact CD1-CG2 3.79Å; I105-V109 HydrophobicContact CG2-CG2 4.17Å; I105-V109 WeakPolarHBondContact O-CB 3.48Å; I105-V109 WeakPolarHBondContact O-CG2 3.43Å; I105-V109 PolarHBondContact O-N 3.37Å; K107-V109 VanDerWaalsContact C-N 3.34Å; K107-V109 PolarHBondContact O-N 2.92Å; V109-D111 PolarHBondContact O-N 2.84Å; V109-H112 PolarHBondContact O-N 2.77Å; V109-I113 HydrophobicContact CG1-CD1 3.66Å; V109-I113 HydrophobicContact CG1-CG1 4.37Å; V109-I113 WeakPolarHBondContact O-CB 3.15Å; V109-I113 VanDerWaalsContact O-CG1 3.3Å; V109-I113 WeakPolarHBondContact O-CG1 3.46Å; V109-I113 PolarHBondContact O-N 3.41Å
110	K	80	Confident	73.8	Confident	113 Å²	113	67.6 Å²	67.6	49%	0.491	32%	0.324	S	S	.	.	H	α-helix	trans	-69	-26.9	179.5	-176.4	170.5	-174.9	168.9	0	114.7	Q89 L106 K107 R114	Q89-K110 HydrophobicContact CG-CB 4.3Å; Q89-K110 VanDerWaalsContact OE1-CG 3.29Å; L106-K110 WeakPolarHBondContact O-CB 3.27Å; L106-K110 PolarHBondContact O-N 3.04Å; K107-K110 CarbonylContact O-C 3.59Å; K107-K110 PolarHBondContact O-N 2.98Å; K107-K110 VanDerWaalsContact O-N 3.14Å; K110-R114 WeakPolarHBondContact O-CB 3.25Å; K110-R114 PolarHBondContact O-NH2 3.04Å
111	D	78.7	Confident	72.8	Confident	35 Å²	35	68 Å²	68	19%	0.187	34%	0.336	C	S	.	.	H	α-helix	trans	-80.1	-44.1	173.3	-70.8	-29.5	0	0	0	109.8	K107 N108 V109 R114 E115	K107-D111 IonicContact NZ-OD2 3.99Å; K107-D111 PolarHBondContact NZ-OD2 3.03Å; K107-D111 PolarHBondContact O-N 3.02Å; N108-D111 PolarHBondContact O-N 3.22Å; V109-D111 PolarHBondContact O-N 2.84Å; D111-R114 CarbonylContact O-C 3.55Å; D111-R114 WeakPolarHBondContact O-CA 3.32Å; D111-R114 VanDerWaalsContact O-CB 3.29Å; D111-R114 WeakPolarHBondContact O-CB 3.34Å; D111-R114 PolarHBondContact O-N 2.79Å; D111-R114 VanDerWaalsContact O-N 3.07Å; D111-R114 IonicContact OD1-CZ 3.77Å; D111-R114 IonicContact OD1-NH1 3.08Å; D111-R114 PolarHBondContact OD1-NH1 3.24Å; D111-R114 IonicContact OD1-NH2 2.66Å; D111-R114 PolarHBondContact OD1-NH2 3.3Å; D111-E115 PolarHBondContact O-N 3.16Å
112	H	72.5	Confident	71.9	Confident	21 Å²	21	73 Å²	73	10%	0.097	36%	0.359	C	S	.	.	H	α-helix	trans	-64.4	-43.4	177.2	-169.2	102.5	0	0	0	113.5	R72 I75 N76 N108 V109 R114 E115 C116	R72-H112 PolarHBondContact O-CE1 3.16Å; I75-H112 HydrophobicContact CD1-CB 4.47Å; I75-H112 HydrophobicContact CG2-CB 3.92Å; N76-H112 PolarHBondContact OD1-CE1 3.21Å; N76-H112 PolarHBondContact OD1-NE2 3.29Å; N108-H112 WeakPolarHBondContact O-CB 3.36Å; N108-H112 PolarHBondContact O-N 3.22Å; V109-H112 PolarHBondContact O-N 2.77Å; H112-R114 PolarHBondContact O-N 2.93Å; H112-E115 CarbonylContact O-C 3.6Å; H112-E115 WeakPolarHBondContact O-CA 3.39Å; H112-E115 PolarHBondContact O-N 3.36Å; H112-C116 PolarHBondContact O-N 3.17Å
113	I	74.3	Confident	70.7	Confident	26 Å²	26	82.1 Å²	82.1	13%	0.133	39%	0.393	C	S	.	.	H	α-helix	trans	-65.6	-24.5	173	-68.3	176.6	0	0	0	111.5	Q89 T92 V109 C119	Q89-I113 HydrophobicContact CB-CD1 4.21Å; Q89-I113 HydrophobicContact CG-CD1 4.16Å; T92-I113 HydrophobicContact CG2-CD1 4.3Å; V109-I113 HydrophobicContact CG1-CD1 3.66Å; V109-I113 HydrophobicContact CG1-CG1 4.37Å; V109-I113 WeakPolarHBondContact O-CB 3.15Å; V109-I113 VanDerWaalsContact O-CG1 3.3Å; V109-I113 WeakPolarHBondContact O-CG1 3.46Å; V109-I113 PolarHBondContact O-N 3.41Å; I113-C119 HydrophobicContact CG2-CB 4.04Å; I113-C119 WeakPolarHBondContact O-CB 3.48Å
114	R	76.1	Confident	69.1	Low	135 Å²	135	77.5 Å²	77.5	51%	0.509	39%	0.391	S	S	.	.	H	α-helix	trans	-76.9	-27.1	171.4	-165.3	-172.1	-47.7	119.4	28.6	112.1	K110 D111 H112 Q120	K110-R114 WeakPolarHBondContact O-CB 3.25Å; K110-R114 PolarHBondContact O-NH2 3.04Å; D111-R114 CarbonylContact O-C 3.55Å; D111-R114 WeakPolarHBondContact O-CA 3.32Å; D111-R114 VanDerWaalsContact O-CB 3.29Å; D111-R114 WeakPolarHBondContact O-CB 3.34Å; D111-R114 PolarHBondContact O-N 2.79Å; D111-R114 VanDerWaalsContact O-N 3.07Å; D111-R114 IonicContact OD1-CZ 3.77Å; D111-R114 IonicContact OD1-NH1 3.08Å; D111-R114 PolarHBondContact OD1-NH1 3.24Å; D111-R114 IonicContact OD1-NH2 2.66Å; D111-R114 PolarHBondContact OD1-NH2 3.3Å; H112-R114 PolarHBondContact O-N 2.93Å; R114-Q120 VanDerWaalsContact O-CG 3.29Å; R114-Q120 WeakPolarHBondContact O-CG 3.23Å; R114-Q120 PolarHBondContact O-NE2 3.03Å
115	E	71.8	Confident	67.7	Low	139 Å²	139	81.3 Å²	81.3	65%	0.65	41%	0.407	S	S	*	.	H	α-helix	trans	-84.2	-19.1	175.8	-71.3	169	-161.9	0	0	112.5	D111 H112 A117	D111-E115 PolarHBondContact O-N 3.16Å; H112-E115 CarbonylContact O-C 3.6Å; H112-E115 WeakPolarHBondContact O-CA 3.39Å; H112-E115 PolarHBondContact O-N 3.36Å; E115-A117 PolarHBondContact O-N 3.44Å
116	C	75.9	Confident	66	Low	19 Å²	19	87.7 Å²	87.7	13%	0.128	44%	0.441	C	S	.	.			trans	-67	115.1	174.7	179.7	0	0	0	0	113	H86 H112 Q118 C119 Q120	H86-C116 PolarHBondContact CE1-SG 2.86Å; H112-C116 PolarHBondContact O-N 3.17Å; C116-Q118 PolarHBondContact O-N 3.33Å; C116-C119 HydrophobicContact CB-CB 4.09Å; C116-C119 PolarHBondContact O-N 3.12Å; C116-C119 VanDerWaalsContact O-N 3.08Å; C116-Q120 WeakPolarHBondContact O-CG 3.25Å; C116-Q120 PolarHBondContact O-N 2.66Å
117	A	66.2	Low	64.2	Low	67 Å²	67	91.9 Å²	91.9	55%	0.554	46%	0.464	S	S	*	.	H	α-helix	trans	-59.6	-38.5	-176.6	0	0	0	0	0	114.2	E115 C119 Q120 S121	E115-A117 PolarHBondContact O-N 3.44Å; A117-C119 VanDerWaalsContact C-N 3.29Å; A117-C119 PolarHBondContact O-N 2.89Å; A117-Q120 PolarHBondContact O-N 2.94Å; A117-S121 PolarHBondContact O-N 2.86Å; A117-S121 PolarHBondContact O-OG 2.97Å
118	Q	63.3	Low	61.9	Low	118 Å²	118	88.6 Å²	88.6	55%	0.551	47%	0.468	S	S	*	.	H	α-helix	trans	-72.3	-20	177.9	-73.7	147.3	-74	0	0	113.3	H86 C116 S121	H86-Q118 VanDerWaalsContact NE2-CD 3.35Å; H86-Q118 PolarHBondContact NE2-NE2 3.46Å; H86-Q118 PolarHBondContact NE2-OE1 3.11Å; C116-Q118 PolarHBondContact O-N 3.33Å; Q118-S121 PolarHBondContact O-OG 3.1Å
119	C	67.9	Low	59.8	Low	20 Å²	20	92.7 Å²	92.7	14%	0.135	50%	0.5	C	S	.	.	H	α-helix	trans	-91	-24.5	171.2	-64.8	0	0	0	0	112.7	H79 I113 C116 A117	H79-C119 VanDerWaalsContact CE1-SG 3.59Å; H79-C119 PolarHBondContact NE2-SG 2.86Å; H79-C119 VanDerWaalsContact NE2-SG 3.42Å; I113-C119 HydrophobicContact CG2-CB 4.04Å; I113-C119 WeakPolarHBondContact O-CB 3.48Å; C116-C119 HydrophobicContact CB-CB 4.09Å; C116-C119 PolarHBondContact O-N 3.12Å; C116-C119 VanDerWaalsContact O-N 3.08Å; A117-C119 VanDerWaalsContact C-N 3.29Å; A117-C119 PolarHBondContact O-N 2.89Å
120	Q	62.9	Low	57.3	Low	96 Å²	96	96.1 Å²	96.1	45%	0.449	54%	0.535	S	S	.	.	H	α-helix	trans	-68.1	-48	168.9	-70.9	176.8	14.9	0	0	111.3	R114 C116 A117 K122 R123 S124	R114-Q120 VanDerWaalsContact O-CG 3.29Å; R114-Q120 WeakPolarHBondContact O-CG 3.23Å; R114-Q120 PolarHBondContact O-NE2 3.03Å; C116-Q120 WeakPolarHBondContact O-CG 3.25Å; C116-Q120 PolarHBondContact O-N 2.66Å; A117-Q120 PolarHBondContact O-N 2.94Å; Q120-K122 VanDerWaalsContact C-N 3.35Å; Q120-K122 PolarHBondContact O-N 2.86Å; Q120-R123 WeakPolarHBondContact O-CA 3.39Å; Q120-R123 WeakPolarHBondContact O-CB 3.37Å; Q120-R123 PolarHBondContact O-N 3.38Å; Q120-S124 PolarHBondContact O-N 2.94Å; Q120-S124 PolarHBondContact O-OG 3.11Å
121	S	56.4	Low	55	Low	67 Å²	67	97.2 Å²	97.2	47%	0.469	55%	0.554	S	S	.	*	H	α-helix	trans	-59	-42.7	-175.9	59.9	0	0	0	0	112.9	A117 Q118 R123 S124	A117-S121 PolarHBondContact O-N 2.86Å; A117-S121 PolarHBondContact O-OG 2.97Å; Q118-S121 PolarHBondContact O-OG 3.1Å; S121-R123 PolarHBondContact O-N 2.82Å; S121-S124 PolarHBondContact O-N 3.34Å; S121-S124 VanDerWaalsContact O-N 3.13Å
122	K	58.1	Low	52.7	Low	165 Å²	165	107 Å²	107	72%	0.717	59%	0.588	S	S	*	*	H	α-helix	trans	-63.8	-14.2	173.9	-69.5	-173.8	177.8	-175.7	0	114.6	Q120 T125	Q120-K122 VanDerWaalsContact C-N 3.35Å; Q120-K122 PolarHBondContact O-N 2.86Å; K122-T125 PolarHBondContact O-OG1 3.1Å
123	R	53.8	Low	51.1	Low	198 Å²	198	110.9 Å²	110.9	75%	0.747	62%	0.615	S	S	*	*	H	α-helix	trans	-95.7	-22.6	173.6	-73.9	174.9	166	-90.4	-5.6	113.1	Q120 S121 T125	Q120-R123 WeakPolarHBondContact O-CA 3.39Å; Q120-R123 WeakPolarHBondContact O-CB 3.37Å; Q120-R123 PolarHBondContact O-N 3.38Å; S121-R123 PolarHBondContact O-N 2.82Å; R123-T125 VanDerWaalsContact C-N 3.28Å; R123-T125 PolarHBondContact O-N 3.34Å
124	S	36.7	Very low	48.8	Very low	101 Å²	101	119.2 Å²	119.2	71%	0.706	65%	0.651	S	S	*	*	H	α-helix	trans	-78.5	-8.8	-178.5	-62.9	0	0	0	0	114.2	Q120 S121	Q120-S124 PolarHBondContact O-N 2.94Å; Q120-S124 PolarHBondContact O-OG 3.11Å; S121-S124 PolarHBondContact O-N 3.34Å; S121-S124 VanDerWaalsContact O-N 3.13Å
125	T	44.3	Very low	46.3	Very low	118 Å²	118	118.1 Å²	118.1	72%	0.724	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-8	-178.5	43.6	0	0	0	0	115	K122 R123	K122-T125 PolarHBondContact O-OG1 3.1Å; R123-T125 VanDerWaalsContact C-N 3.28Å; R123-T125 PolarHBondContact O-N 3.34Å
126	D	41.4	Very low	44	Very low	149 Å²	149	122.2 Å²	122.2	80%	0.797	67%	0.673	S	S	*	*	S	Bend	trans	-109.2	-5.7	-165.2	-149.2	31.5	0	0	0	114.7
127	D	36.9	Very low	41.7	Very low	165 Å²	165	129 Å²	129	88%	0.882	70%	0.703	S	S	*	*	S	Bend	trans	-119	73.7	-179.8	-100.3	-47.1	0	0	0	110.4
128	G	29.1	Very low	39.8	Very low	63 Å²	63	129.5 Å²	129.5	65%	0.649	71%	0.714	S	S	*	*			trans	-144.5	8.2	-160.5	0	0	0	0	0	120.1
129	S	31.9	Very low	38.1	Very low	132 Å²	132	134.1 Å²	134.1	92%	0.923	73%	0.727	S	S	*	*			trans	60	118.6	173	67.6	0	0	0	0	119.4
130	G	24.3	Very low	36.1	Very low	72 Å²	72	143.4 Å²	143.4	74%	0.742	76%	0.759	S	S	*	*			trans	-165.2	141.3	167	0	0	0	0	0	111.7
131	P	33.4	Very low	34.3	Very low	135 Å²	135	146.9 Å²	146.9	88%	0.877	77%	0.773	S	S	*	*			trans	-86.3	160.5	-171.5	34	-36.1	0	0	0	114.6
132	R	29	Very low	32.7	Very low	241 Å²	241	152.3 Å²	152.3	91%	0.909	79%	0.788	S	S	*	*			trans	-108.1	161	164.8	-73.8	-170.4	179.2	-143.4	1.9	109.6
133	P	39.1	Very low	31	Very low	103 Å²	103	147.6 Å²	147.6	67%	0.669	79%	0.786	S	S	*	*			cis	-133.6	179.2	1.1	40.8	-24.2	0	0	0	116.2
134	F	26.1	Very low	30.3	Very low	201 Å²	201	143.7 Å²	143.7	88%	0.882	79%	0.787	S	S	*	*			trans	56.3	122.4	156.4	-66.9	-63.1	0	0	0	121.8
135	S	24.6	Very low	29.8	Very low	111 Å²	111	145.5 Å²	145.5	78%	0.776	79%	0.786	S	S	*	*				163.7	136	95.1	-172.3	0	0	0	0	114.6
136	R	23.3	Very low	28.9	Very low	226 Å²	226	147.3 Å²	147.3	85%	0.853	79%	0.786	S	S	*	*			trans	-166	141.2	159	-103	-159.8	150.1	165.4	-1.2	109.8
137	Q	28.1	Very low	28.2	Very low	162 Å²	162	146.4 Å²	146.4	76%	0.757	78%	0.781	S	S	*	*			cis	-166.7	141.9	-24.3	-134.7	172	-4.5	0	0	111.6
138	G	25.6	Very low	27.9	Very low	76 Å²	76	147 Å²	147	78%	0.784	78%	0.778	S	S	*	*			trans	102.1	158	164	0	0	0	0	0	116.8
139	R	26.4	Very low	27.8	Very low	215 Å²	215	151.1 Å²	151.1	81%	0.811	79%	0.786	S	S	*	*			cis	-162.4	115.4	-7.9	-172.4	-180	-171.1	-115.7	12.4	113.1
140	R	26.2	Very low	27.7	Very low	216 Å²	216	151.3 Å²	151.3	82%	0.815	78%	0.776	S	S	*	*			trans	51.2	103.7	152.4	-60.4	-178.5	177.9	-172	-1.4	122.1
141	K	26.3	Very low	27.9	Very low	169 Å²	169	153.5 Å²	153.5	74%	0.735	77%	0.771	S	S	*	*				61.7	134.3	111.9	-152.9	-172.4	-177.8	-167.6	0	122.9
142	F	22.8	Very low	27.8	Very low	180 Å²	180	154 Å²	154	79%	0.789	76%	0.762	S	S	*	*			trans	93	138.5	161.9	-72.5	-63.7	0	0	0	119.2
143	G	21.1	Very low	27.9	Very low	66 Å²	66	149.7 Å²	149.7	68%	0.68	75%	0.752	S	S	*	*			trans	-109.7	-153.5	157.3	0	0	0	0	0	109.8
144	P	40.3	Very low	27.7	Very low	117 Å²	117	151.9 Å²	151.9	76%	0.76	75%	0.753	S	S	*	*			cis	-140.3	-153.7	25.6	41.1	-18.8	0	0	0	114.7
145	M	25.1	Very low	27.8	Very low	139 Å²	139	149 Å²	149	69%	0.685	75%	0.747	S	S	*	*			trans	70	134.6	177.3	-40.9	-50.7	-74.2	0	0	114.7
146	E	26.9	Very low	27.9	Very low	155 Å²	155	147.5 Å²	147.5	72%	0.724	75%	0.749	S	S	*	*			cis	86.2	135.7	36.7	-66.9	178.7	155.3	0	0	114.5
147	D	25.4	Very low	28.2	Very low	130 Å²	130	143.9 Å²	143.9	70%	0.695	74%	0.742	S	S	*	*			trans	77.1	110.1	162.5	-49.7	-23.5	0	0	0	122.7
148	E	32	Very low	28	Very low	177 Å²	177	143.5 Å²	143.5	83%	0.827	75%	0.745	S	S	*	*				68.7	168.9	129	-60.1	-176.4	150.5	0	0	122
149	D	25	Very low	27.9	Very low	150 Å²	150	145.3 Å²	145.3	80%	0.802	74%	0.735	S	S	*	*			trans	63.6	142.5	-176.6	-51.9	-7.4	0	0	0	118.4
150	D	30.2	Very low	27.8	Very low	136 Å²	136	142 Å²	142	73%	0.727	73%	0.733	S	S	*	*			cis	-159	163.6	-45.5	-126.9	-12.1	0	0	0	110.3
151	D	28.6	Very low	27.6	Very low	119 Å²	119	139.8 Å²	139.8	64%	0.636	73%	0.73	S	S	*	*			trans	38.5	139.9	150	-76	-26.7	0	0	0	126.5
152	E	32.7	Very low	27.5	Very low	145 Å²	145	136.4 Å²	136.4	68%	0.678	73%	0.727	S	S	*	*			trans	78.2	132.3	132.1	-72.7	174.5	172	0	0	125
153	E	30.2	Very low	27.6	Very low	151 Å²	151	133.2 Å²	133.2	71%	0.706	72%	0.723	S	S	*	*				67	150	129.9	-71.1	-175.5	-173.9	0	0	123.1
154	E	34.2	Very low	27.7	Very low	148 Å²	148	136.7 Å²	136.7	69%	0.692	73%	0.726	S	S	*	*			cis	-161.4	172.9	-29.7	-142.9	179	-165.5	0	0	110.2
155	D	28.9	Very low	27	Very low	141 Å²	141	138.5 Å²	138.5	75%	0.754	73%	0.728	S	S	*	*			trans	68.6	148.5	143.2	-99.7	5.9	0	0	0	125.1
156	G	26.4	Very low	27	Very low	79 Å²	79	136.5 Å²	136.5	81%	0.814	73%	0.728	S	S	*	*			trans	159.7	25.5	175.8	0	0	0	0	0	115
157	E	29.9	Very low	26.9	Very low	150 Å²	150	133.9 Å²	133.9	70%	0.701	73%	0.726	S	S	*	*			trans	-91.3	159.9	-174	-58.4	-157.8	166.1	0	0	114.8	I159	E157-I159 HydrophobicContact CB-CD1 4.39Å
158	D	23.3	Very low	27.1	Very low	154 Å²	154	135.6 Å²	135.6	82%	0.824	73%	0.731	S	S	*	*			trans	161.4	92.8	151.6	-97.9	-24.7	0	0	0	107.4
159	I	24.8	Very low	26.9	Very low	115 Å²	115	137.8 Å²	137.8	59%	0.59	73%	0.731	S	S	*	*				67	116.3	65.9	-50.7	169.3	0	0	0	113.3	E157	E157-I159 HydrophobicContact CB-CD1 4.39Å
160	L	24.2	Very low	27.2	Very low	146 Å²	146	135.5 Å²	135.5	76%	0.764	73%	0.725	S	S	*	*				167.2	116	123.8	-85.4	176.6	0	0	0	114.3
161	F	21.8	Very low	27	Very low	169 Å²	169	138.1 Å²	138.1	74%	0.741	73%	0.729	S	S	*	*			trans	61.2	104.8	139.4	-80.3	-116.6	0	0	0	123.9
162	S	23.6	Very low	27	Very low	97 Å²	97	139.7 Å²	139.7	68%	0.678	74%	0.737	S	S	*	*				48.7	164.7	92.1	-51.5	0	0	0	0	123.4
163	T	24.9	Very low	27.5	Very low	114 Å²	114	137.5 Å²	137.5	70%	0.699	74%	0.744	S	S	*	*			trans	86.4	141.6	158.5	74.8	0	0	0	0	117.3
164	D	23.3	Very low	27.4	Very low	138 Å²	138	140.3 Å²	140.3	74%	0.738	75%	0.754	S	S	*	*			cis	-168.1	-169.4	-16.7	-127.4	-58	0	0	0	113.1
165	L	25.4	Very low	26.9	Very low	155 Å²	155	136.7 Å²	136.7	81%	0.812	76%	0.756	S	S	*	*			trans	101.8	133.1	153.7	-55.7	-178.8	0	0	0	116.9
166	S	25.2	Very low	27.5	Very low	98 Å²	98	135.8 Å²	135.8	69%	0.685	76%	0.755	S	S	*	*			cis	-154.3	171.1	3	-157.5	0	0	0	0	114.5
167	S	25.5	Very low	27.5	Very low	99 Å²	99	137.1 Å²	137.1	69%	0.692	76%	0.759	S	S	*	*			trans	65.6	104.8	167.5	-58.1	0	0	0	0	116.8
168	Q	30	Very low	27.5	Very low	167 Å²	167	138.4 Å²	138.4	78%	0.78	76%	0.762	S	S	*	*				49.7	129.3	66.8	-52.8	-166.5	54.3	0	0	114.3
169	R	25.9	Very low	27.7	Very low	223 Å²	223	139.2 Å²	139.2	84%	0.842	76%	0.761	S	S	*	*			cis	-170.9	166.3	-9.7	-112.3	-177.9	-177.8	-175.3	3.5	105.5
170	P	31.2	Very low	27.7	Very low	102 Å²	102	142.6 Å²	142.6	66%	0.662	77%	0.774	S	S	*	*			cis	-134.9	-177.4	-22.1	43.4	-27.7	0	0	0	113.7
171	K	27.4	Very low	27.9	Very low	191 Å²	191	140.2 Å²	140.2	83%	0.83	77%	0.765	S	S	*	*			trans	58.3	154.1	149.1	-75.6	176.2	178.5	-178.6	0	121.6
172	L	28.6	Very low	28.2	Very low	152 Å²	152	135.6 Å²	135.6	80%	0.796	75%	0.751	S	S	*	*			trans	59.7	93.6	162.1	-105.5	60	0	0	0	116.2
173	A	43.6	Very low	28.5	Very low	99 Å²	99	140.4 Å²	140.4	82%	0.818	76%	0.756	S	S	*	*				60	73.3	79.3	0	0	0	0	0	113.7
174	K	26.3	Very low	29.1	Very low	210 Å²	210	138.9 Å²	138.9	91%	0.913	75%	0.746	S	S	*	*			trans	-139	149.6	159.5	-64.1	176.1	-179	175	0	105.9
175	G	25.4	Very low	29.6	Very low	72 Å²	72	138.3 Å²	138.3	74%	0.742	74%	0.743	S	S	*	*			cis	175.7	141.6	-6	0	0	0	0	0	107.6
176	T	39.8	Very low	30.1	Very low	121 Å²	121	137.1 Å²	137.1	74%	0.742	75%	0.747	S	S	*	*			trans	-70.8	133.8	-177	43.1	0	0	0	0	111.6	K178	T176-K178 PolarHBondContact O-N 3.24Å; T176-K178 VanDerWaalsContact O-N 3.16Å
177	A	27.3	Very low	30.9	Very low	108 Å²	108	142.1 Å²	142.1	89%	0.893	76%	0.757	S	S	*	*			trans	-66.8	108.5	159.5	0	0	0	0	0	107.1
178	K	29.2	Very low	31.5	Very low	177 Å²	177	139.7 Å²	139.7	77%	0.77	75%	0.748	S	S	*	*			trans	-80.1	161.8	-171	-62.9	176.2	-175.5	171.8	0	110.6	T176 E180	T176-K178 PolarHBondContact O-N 3.24Å; T176-K178 VanDerWaalsContact O-N 3.16Å; K178-E180 PolarHBondContact O-N 3.11Å
179	H	29.2	Very low	31.8	Very low	171 Å²	171	139.4 Å²	139.4	79%	0.792	75%	0.747	S	S	*	*			trans	-55.8	134	150.8	-62.3	46.9	0	0	0	107.2	V181	H179-V181 HydrophobicContact CB-CG2 4.24Å; H179-V181 PolarHBondContact O-N 3.09Å
180	E	23.3	Very low	32.3	Very low	185 Å²	185	133.1 Å²	133.1	86%	0.864	73%	0.733	S	S	*	*			trans	-70.5	86.1	158.2	-71.5	-157.5	138.8	0	0	107.9	K178 V182	K178-E180 PolarHBondContact O-N 3.11Å; E180-V182 PolarHBondContact O-N 3.35Å
181	V	28.8	Very low	32.4	Very low	96 Å²	96	135.4 Å²	135.4	58%	0.582	74%	0.739	S	S	*	*			trans	-66	85.6	157.6	-178.7	0	0	0	0	105.7	H179 Y183	H179-V181 HydrophobicContact CB-CG2 4.24Å; H179-V181 PolarHBondContact O-N 3.09Å; V181-Y183 HydrophobicContact CB-CE2 4.43Å; V181-Y183 HydrophobicContact CG1-CD2 4.3Å; V181-Y183 HydrophobicContact CG1-CE2 4.15Å; V181-Y183 VanDerWaalsContact O-CD2 3.23Å; V181-Y183 WeakPolarHBondContact O-CD2 3.11Å; V181-Y183 PolarHBondContact O-N 2.95Å
182	V	28.1	Very low	32.9	Very low	72 Å²	72	134.7 Å²	134.7	44%	0.436	74%	0.739	S	S	.	*			trans	-53.7	114.8	165.2	-179.6	0	0	0	0	106	E180 V184 V190	E180-V182 PolarHBondContact O-N 3.35Å; V182-V184 HydrophobicContact CB-CG2 4.47Å; V182-V184 HydrophobicContact CG1-CG2 4Å; V182-V184 PolarHBondContact O-N 3.2Å; V182-V190 HydrophobicContact CG1-CB 4.09Å; V182-V190 HydrophobicContact CG1-CG1 3.47Å; V182-V190 VanDerWaalsContact CG1-CG1 3.47Å; V182-V190 HydrophobicContact CG1-CG2 3.44Å; V182-V190 VanDerWaalsContact CG1-CG2 3.44Å
183	Y	30.8	Very low	33.4	Very low	198 Å²	198	136.2 Å²	136.2	78%	0.776	74%	0.739	S	S	*	*			trans	-76.4	70.4	-175.1	-95.9	-89.5	0	0	0	110.7	V181 N185	V181-Y183 HydrophobicContact CB-CE2 4.43Å; V181-Y183 HydrophobicContact CG1-CD2 4.3Å; V181-Y183 HydrophobicContact CG1-CE2 4.15Å; V181-Y183 VanDerWaalsContact O-CD2 3.23Å; V181-Y183 WeakPolarHBondContact O-CD2 3.11Å; V181-Y183 PolarHBondContact O-N 2.95Å; Y183-N185 PolarHBondContact O-N 3.49Å
184	V	35.7	Very low	33.2	Very low	82 Å²	82	138.9 Å²	138.9	50%	0.497	74%	0.739	S	S	.	*			trans	-65.3	99	170.1	-179.3	0	0	0	0	107.7	V182 G188 V190	V182-V184 HydrophobicContact CB-CG2 4.47Å; V182-V184 HydrophobicContact CG1-CG2 4Å; V182-V184 PolarHBondContact O-N 3.2Å; V184-G188 VanDerWaalsContact CG1-CA 3.48Å; V184-V190 HydrophobicContact CG2-CG2 4Å
185	N	35.1	Very low	34	Very low	127 Å²	127	133.1 Å²	133.1	68%	0.679	72%	0.723	S	S	*	*			trans	-57.3	161.9	167.2	-82.3	-33.1	0	0	0	110	Y183 K187 G188	Y183-N185 PolarHBondContact O-N 3.49Å; N185-K187 PolarHBondContact O-N 3.45Å; N185-G188 PolarHBondContact O-N 2.82Å
186	S	36.3	Very low	34.7	Very low	129 Å²	129	138.4 Å²	138.4	90%	0.902	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	14.3	-168.1	53.4	0	0	0	0	117.4
187	K	40.9	Very low	34.3	Very low	203 Å²	203	139.2 Å²	139.2	88%	0.883	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.3	-9.6	172.3	-69.5	-170.4	175.1	-175.2	0	116	N185	N185-K187 PolarHBondContact O-N 3.45Å
188	G	39.3	Very low	34.9	Very low	49 Å²	49	137.5 Å²	137.5	51%	0.505	70%	0.702	S	S	.	*			trans	115.4	1.9	165.6	0	0	0	0	0	119.5	V184 N185	V184-G188 VanDerWaalsContact CG1-CA 3.48Å; N185-G188 PolarHBondContact O-N 2.82Å
189	E	35.2	Very low	35.5	Very low	161 Å²	161	135 Å²	135	75%	0.752	69%	0.694	S	S	*	*			trans	-96.7	155.9	-168.6	-68.6	172.4	171.3	0	0	115.1
190	V	37.3	Very low	36.1	Very low	91 Å²	91	130.7 Å²	130.7	55%	0.552	68%	0.679	S	S	*	*			trans	-143.3	132.5	-175.2	-175	0	0	0	0	109.5	V182 V184	V182-V190 HydrophobicContact CG1-CB 4.09Å; V182-V190 HydrophobicContact CG1-CG1 3.47Å; V182-V190 VanDerWaalsContact CG1-CG1 3.47Å; V182-V190 HydrophobicContact CG1-CG2 3.44Å; V182-V190 VanDerWaalsContact CG1-CG2 3.44Å; V184-V190 HydrophobicContact CG2-CG2 4Å
191	N	33.1	Very low	36.7	Very low	150 Å²	150	127 Å²	127	80%	0.802	66%	0.663	S	S	*	*			trans	-105	119.5	-174.2	-76.7	-27.7	0	0	0	113.1
192	Q	36.9	Very low	37.3	Very low	175 Å²	175	127.1 Å²	127.1	82%	0.818	66%	0.66	S	S	*	*			trans	66.9	151.7	165.9	-53.3	-166	-2.5	0	0	116.6
193	F	40.7	Very low	37.9	Very low	184 Å²	184	127.8 Å²	127.8	81%	0.807	66%	0.661	S	S	*	*			cis	-158.5	133.5	-32.7	-132.9	-75.7	0	0	0	106.8
194	L	38.8	Very low	38.4	Very low	156 Å²	156	124.9 Å²	124.9	82%	0.817	65%	0.653	S	S	*	*			trans	-141.3	160.1	176.2	-80.6	176.9	0	0	0	112.2
195	P	43.5	Very low	38.5	Very low	89 Å²	89	124.4 Å²	124.4	58%	0.578	65%	0.647	S	S	*	*			trans	-84	152.7	-147.2	-17.7	33.6	0	0	0	117.4	H197 S198	P195-H197 PolarHBondContact O-N 3.33Å; P195-S198 WeakPolarHBondContact O-CB 3.23Å; P195-S198 PolarHBondContact O-N 2.96Å; P195-S198 PolarHBondContact O-OG 3.26Å
196	K	38.9	Very low	38.8	Very low	182 Å²	182	120.9 Å²	120.9	79%	0.791	63%	0.628	S	S	*	*	H	α-helix	trans	-51.2	-28.3	-178	-62.2	179	179.7	177.6	0	115.4	S198 Q199 T200	K196-S198 VanDerWaalsContact C-N 3.29Å; K196-S198 PolarHBondContact O-N 3.45Å; K196-Q199 PolarHBondContact O-N 2.86Å; K196-Q199 VanDerWaalsContact O-N 3.15Å; K196-T200 PolarHBondContact O-N 2.86Å; K196-T200 VanDerWaalsContact O-N 3.09Å; K196-T200 PolarHBondContact O-OG1 2.89Å; K196-T200 VanDerWaalsContact O-OG1 3.07Å
197	H	31.4	Very low	39	Very low	139 Å²	139	121.3 Å²	121.3	64%	0.644	62%	0.616	S	S	*	*	H	α-helix	trans	-61.5	-36.3	178.3	-174.5	86.2	0	0	0	112.5	P195 Q199 T200 M201	P195-H197 PolarHBondContact O-N 3.33Å; H197-Q199 VanDerWaalsContact C-N 3.26Å; H197-Q199 PolarHBondContact O-N 3.09Å; H197-T200 PolarHBondContact O-OG1 2.92Å; H197-M201 WeakPolarHBondContact O-CB 3.32Å; H197-M201 WeakPolarHBondContact O-CG 3.39Å; H197-M201 PolarHBondContact O-N 3.18Å; H197-M201 VanDerWaalsContact O-N 3.14Å
198	S	39.7	Very low	39.1	Very low	72 Å²	72	117.8 Å²	117.8	50%	0.503	60%	0.602	S	S	.	*	H	α-helix	trans	-63.2	-34.4	175.8	65.5	0	0	0	0	112.3	P195 K196 L202	P195-S198 WeakPolarHBondContact O-CB 3.23Å; P195-S198 PolarHBondContact O-N 2.96Å; P195-S198 PolarHBondContact O-OG 3.26Å; K196-S198 VanDerWaalsContact C-N 3.29Å; K196-S198 PolarHBondContact O-N 3.45Å; S198-L202 WeakPolarHBondContact O-CB 3.26Å; S198-L202 PolarHBondContact O-N 2.9Å; S198-L202 VanDerWaalsContact O-N 3.11Å
199	Q	42.1	Very low	39.1	Very low	125 Å²	125	123.4 Å²	123.4	58%	0.584	61%	0.608	S	S	*	*	H	α-helix	trans	-82.3	-40.1	-174.1	-151	159.4	9.4	0	0	111.7	K196 H197 M201 L202 D203	K196-Q199 PolarHBondContact O-N 2.86Å; K196-Q199 VanDerWaalsContact O-N 3.15Å; H197-Q199 VanDerWaalsContact C-N 3.26Å; H197-Q199 PolarHBondContact O-N 3.09Å; Q199-M201 VanDerWaalsContact C-N 3.34Å; Q199-M201 PolarHBondContact O-N 3.09Å; Q199-L202 CarbonylContact O-C 3.44Å; Q199-L202 WeakPolarHBondContact O-CA 3.43Å; Q199-L202 WeakPolarHBondContact O-CB 3.24Å; Q199-L202 PolarHBondContact O-N 3.36Å; Q199-L202 VanDerWaalsContact O-N 3.08Å; Q199-D203 PolarHBondContact O-N 3.47Å
200	T	43	Very low	39.4	Very low	80 Å²	80	122.4 Å²	122.4	49%	0.491	61%	0.607	S	S	.	*	H	α-helix	trans	-66.4	-32.4	171.6	38.8	0	0	0	0	113.1	K196 H197 K204	K196-T200 PolarHBondContact O-N 2.86Å; K196-T200 VanDerWaalsContact O-N 3.09Å; K196-T200 PolarHBondContact O-OG1 2.89Å; K196-T200 VanDerWaalsContact O-OG1 3.07Å; H197-T200 PolarHBondContact O-OG1 2.92Å; T200-K204 WeakPolarHBondContact O-CG 3.22Å; T200-K204 PolarHBondContact O-N 3.05Å
201	M	36.1	Very low	39.3	Very low	106 Å²	106	121.4 Å²	121.4	52%	0.522	60%	0.604	S	S	.	*	H	α-helix	trans	-64.1	-41.4	167.3	-79.7	-76.3	-87	0	0	111.8	H197 Q199 L205	H197-M201 WeakPolarHBondContact O-CB 3.32Å; H197-M201 WeakPolarHBondContact O-CG 3.39Å; H197-M201 PolarHBondContact O-N 3.18Å; H197-M201 VanDerWaalsContact O-N 3.14Å; Q199-M201 VanDerWaalsContact C-N 3.34Å; Q199-M201 PolarHBondContact O-N 3.09Å; M201-L205 WeakPolarHBondContact O-CB 3.38Å; M201-L205 PolarHBondContact O-N 3.3Å
202	L	39.3	Very low	39.7	Very low	99 Å²	99	121.4 Å²	121.4	52%	0.518	60%	0.604	S	S	.	*	H	α-helix	trans	-66.6	-38.3	178.3	-149.1	71.8	0	0	0	112.4	S198 Q199 L205 N206	S198-L202 WeakPolarHBondContact O-CB 3.26Å; S198-L202 PolarHBondContact O-N 2.9Å; S198-L202 VanDerWaalsContact O-N 3.11Å; Q199-L202 CarbonylContact O-C 3.44Å; Q199-L202 WeakPolarHBondContact O-CA 3.43Å; Q199-L202 WeakPolarHBondContact O-CB 3.24Å; Q199-L202 PolarHBondContact O-N 3.36Å; Q199-L202 VanDerWaalsContact O-N 3.08Å; L202-L205 WeakPolarHBondContact O-CB 3.47Å; L202-L205 PolarHBondContact O-N 3.39Å; L202-N206 WeakPolarHBondContact O-CB 3.31Å; L202-N206 VanDerWaalsContact O-CG 3.31Å; L202-N206 PolarHBondContact O-N 3.2Å; L202-N206 PolarHBondContact O-ND2 3.07Å
203	D	41.5	Very low	40	Very low	86 Å²	86	119.4 Å²	119.4	46%	0.46	60%	0.595	S	S	.	*	H	α-helix	trans	-73.4	-37.2	177.6	-72.5	-30.1	0	0	0	112.5	Q199 L205 N206 Q207	Q199-D203 PolarHBondContact O-N 3.47Å; D203-L205 VanDerWaalsContact C-N 3.32Å; D203-L205 PolarHBondContact O-N 3.37Å; D203-N206 PolarHBondContact O-N 2.8Å; D203-Q207 WeakPolarHBondContact O-CB 3.4Å; D203-Q207 WeakPolarHBondContact O-CG 3.4Å; D203-Q207 PolarHBondContact O-N 2.84Å
204	K	40.5	Very low	39.9	Very low	138 Å²	138	116.1 Å²	116.1	60%	0.6	58%	0.58	S	S	*	*	H	α-helix	trans	-60.1	-42.5	168.1	-76.7	179.8	177.6	179.4	0	111.3	T200 Q207 Q208	T200-K204 WeakPolarHBondContact O-CG 3.22Å; T200-K204 PolarHBondContact O-N 3.05Å; K204-Q207 PolarHBondContact O-N 3.08Å; K204-Q208 WeakPolarHBondContact O-CB 3.38Å; K204-Q208 VanDerWaalsContact O-CG 3.27Å; K204-Q208 WeakPolarHBondContact O-CG 3.47Å; K204-Q208 PolarHBondContact O-N 3.12Å
205	L	37.9	Very low	40.1	Very low	72 Å²	72	112.5 Å²	112.5	38%	0.377	57%	0.567	S	S	.	*	H	α-helix	trans	-64.3	-36.6	173.7	-94.2	158.9	0	0	0	113.2	M201 L202 D203 R209	M201-L205 WeakPolarHBondContact O-CB 3.38Å; M201-L205 PolarHBondContact O-N 3.3Å; L202-L205 WeakPolarHBondContact O-CB 3.47Å; L202-L205 PolarHBondContact O-N 3.39Å; D203-L205 VanDerWaalsContact C-N 3.32Å; D203-L205 PolarHBondContact O-N 3.37Å; L205-R209 WeakPolarHBondContact O-CG 3.27Å; L205-R209 PolarHBondContact O-N 3.43Å
206	N	41.6	Very low	40.6	Very low	53 Å²	53	109.6 Å²	109.6	28%	0.283	55%	0.547	S	S	.	.	H	α-helix	trans	-73.7	-39.6	176.6	-74.4	-31.5	0	0	0	112.1	L202 D203 Q208 R209 I210	L202-N206 WeakPolarHBondContact O-CB 3.31Å; L202-N206 VanDerWaalsContact O-CG 3.31Å; L202-N206 PolarHBondContact O-N 3.2Å; L202-N206 PolarHBondContact O-ND2 3.07Å; D203-N206 PolarHBondContact O-N 2.8Å; N206-Q208 VanDerWaalsContact C-N 3.34Å; N206-Q208 PolarHBondContact O-N 3.21Å; N206-R209 WeakPolarHBondContact O-CB 3.43Å; N206-R209 PolarHBondContact O-N 2.97Å; N206-R209 VanDerWaalsContact O-N 3.16Å; N206-R209 PolarHBondContact OD1-NH1 3.48Å; N206-I210 VanDerWaalsContact O-CG1 3.23Å; N206-I210 WeakPolarHBondContact O-CG1 3.28Å; N206-I210 PolarHBondContact O-N 3.33Å
207	Q	40.6	Very low	41.2	Very low	137 Å²	137	101 Å²	101	64%	0.64	51%	0.509	S	S	*	.	H	α-helix	trans	-61.6	-41.2	171.7	-73	177.7	-5.8	0	0	111.5	D203 K204 R209 I210 S211	D203-Q207 WeakPolarHBondContact O-CB 3.4Å; D203-Q207 WeakPolarHBondContact O-CG 3.4Å; D203-Q207 PolarHBondContact O-N 2.84Å; K204-Q207 PolarHBondContact O-N 3.08Å; Q207-R209 VanDerWaalsContact C-N 3.33Å; Q207-R209 PolarHBondContact O-N 2.95Å; Q207-I210 PolarHBondContact O-N 2.99Å; Q207-S211 PolarHBondContact O-N 3.2Å
208	Q	44.5	Very low	42.4	Very low	129 Å²	129	95.4 Å²	95.4	60%	0.603	49%	0.485	S	S	*	.	H	α-helix	trans	-64.2	-32.8	172.9	-74.2	174	-5.4	0	0	113.3	K204 N206 S211	K204-Q208 WeakPolarHBondContact O-CB 3.38Å; K204-Q208 VanDerWaalsContact O-CG 3.27Å; K204-Q208 WeakPolarHBondContact O-CG 3.47Å; K204-Q208 PolarHBondContact O-N 3.12Å; N206-Q208 VanDerWaalsContact C-N 3.34Å; N206-Q208 PolarHBondContact O-N 3.21Å; Q208-S211 PolarHBondContact O-OG 3.46Å; Q208-S211 VanDerWaalsContact O-OG 3.08Å
209	R	38.3	Very low	43.2	Very low	167 Å²	167	92.3 Å²	92.3	63%	0.63	46%	0.463	S	S	*	.	H	α-helix	trans	-68.9	-38.5	170.7	-74.9	166.1	173	167.9	-4.7	112.3	L205 N206 Q207 N212	L205-R209 WeakPolarHBondContact O-CG 3.27Å; L205-R209 PolarHBondContact O-N 3.43Å; N206-R209 WeakPolarHBondContact O-CB 3.43Å; N206-R209 PolarHBondContact O-N 2.97Å; N206-R209 VanDerWaalsContact O-N 3.16Å; N206-R209 PolarHBondContact OD1-NH1 3.48Å; Q207-R209 VanDerWaalsContact C-N 3.33Å; Q207-R209 PolarHBondContact O-N 2.95Å; R209-N212 PolarHBondContact O-N 3.2Å
210	I	41.1	Very low	43.8	Very low	140 Å²	140	88.4 Å²	88.4	72%	0.718	45%	0.445	S	S	*	.	H	α-helix	trans	-73.6	-33.5	-177.4	-67.6	166	0	0	0	111.5	N206 Q207 N212	N206-I210 VanDerWaalsContact O-CG1 3.23Å; N206-I210 WeakPolarHBondContact O-CG1 3.28Å; N206-I210 PolarHBondContact O-N 3.33Å; Q207-I210 PolarHBondContact O-N 2.99Å; I210-N212 PolarHBondContact O-N 3.04Å
211	S	36.1	Very low	44.4	Very low	70 Å²	70	85.6 Å²	85.6	49%	0.49	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-15.8	177.2	70.5	0	0	0	0	113.9	Q207 Q208 Q213	Q207-S211 PolarHBondContact O-N 3.2Å; Q208-S211 PolarHBondContact O-OG 3.46Å; Q208-S211 VanDerWaalsContact O-OG 3.08Å; S211-Q213 VanDerWaalsContact C-N 3.26Å; S211-Q213 PolarHBondContact O-N 2.69Å
212	N	41.7	Very low	45	Very low	151 Å²	151	86.7 Å²	86.7	81%	0.807	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	32.1	165.6	-143.6	-3.4	0	0	0	114.5	R209 I210	R209-N212 PolarHBondContact O-N 3.2Å; I210-N212 PolarHBondContact O-N 3.04Å
213	Q	43.1	Very low	45.5	Very low	133 Å²	133	85.1 Å²	85.1	62%	0.621	44%	0.439	S	S	*	.			trans	-111.9	156.9	172.2	-60.8	-179.7	17.1	0	0	110	S211	S211-Q213 VanDerWaalsContact C-N 3.26Å; S211-Q213 PolarHBondContact O-N 2.69Å
214	F	37.4	Very low	45.7	Very low	114 Å²	114	85.7 Å²	85.7	50%	0.5	44%	0.439	S	S	.	.			trans	76.7	131.7	169.4	-61.4	-65.8	0	0	0	117.8	D216 H253	F214-D216 WeakPolarHBondContact CA-OD1 3.4Å; F214-D216 WeakPolarHBondContact CB-OD1 3.33Å; F214-H253 HydrophobicContact CD1-CB 3.92Å; F214-H253 AromaticContact CD1-CG 3.81Å; F214-H253 AromaticContact CD1-ND1 3.6Å; F214-H253 HydrophobicContact CE1-CB 4.02Å; F214-H253 AromaticContact CE1-CG 3.84Å; F214-H253 AromaticContact CE1-ND1 3.98Å; F214-H253 AromaticContact CG-ND1 3.95Å
215	C	42.8	Very low	46.2	Very low	80 Å²	80	86.1 Å²	86.1	54%	0.541	44%	0.443	S	S	.	.			trans	-150.6	55.1	-168.3	-81	0	0	0	0	110.1	I217	C215-I217 PolarHBondContact O-N 2.89Å
216	D	54.7	Low	47	Very low	29 Å²	29	85.3 Å²	85.3	16%	0.155	44%	0.437	C	S	.	.			trans	-85	-2.8	-139.4	-67.4	4.4	0	0	0	117.7	F214 H253 E254 A255	F214-D216 WeakPolarHBondContact CA-OD1 3.4Å; F214-D216 WeakPolarHBondContact CB-OD1 3.33Å; D216-H253 VanDerWaalsContact CA-O 3.25Å; D216-H253 WeakPolarHBondContact CA-O 3.11Å; D216-H253 VanDerWaalsContact CB-O 3.23Å; D216-H253 WeakPolarHBondContact CB-O 3.44Å; D216-H253 VanDerWaalsContact OD1-O 3.11Å; D216-H253 IonicContact OD2-CE1 3.51Å; D216-H253 IonicContact OD2-CG 3.44Å; D216-H253 IonicContact OD2-ND1 2.64Å; D216-H253 PolarHBondContact OD2-ND1 3.32Å; D216-E254 WeakPolarHBondContact O-CA 3.34Å; D216-A255 PolarHBondContact O-N 3.38Å
217	I	52.5	Low	47.3	Very low	0 Å²	0	91.5 Å²	91.5	0%	0	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	130.2	177.7	-69.2	-172.1	0	0	0	113.1	C215 L219 R227 A228 K230 F244 A255 V257	C215-I217 PolarHBondContact O-N 2.89Å; I217-L219 HydrophobicContact CG2-CD2 3.55Å; I217-L219 HydrophobicContact CG2-CG 4.11Å; I217-R227 WeakPolarHBondContact O-CA 3.2Å; I217-A228 PolarHBondContact N-O 3.16Å; I217-A228 PolarHBondContact O-N 3.43Å; I217-K230 HydrophobicContact CD1-CB 3.61Å; I217-K230 HydrophobicContact CD1-CD 4.13Å; I217-K230 HydrophobicContact CD1-CG 3.71Å; I217-K230 HydrophobicContact CG1-CB 3.95Å; I217-K230 HydrophobicContact CG1-CG 4.45Å; I217-F244 HydrophobicContact CD1-CD1 3.73Å; I217-F244 HydrophobicContact CD1-CD2 4.4Å; I217-F244 HydrophobicContact CD1-CE1 3.44Å; I217-F244 VanDerWaalsContact CD1-CE1 3.44Å; I217-F244 HydrophobicContact CD1-CE2 4.15Å; I217-F244 HydrophobicContact CD1-CG 4.22Å; I217-F244 HydrophobicContact CD1-CZ 3.67Å; I217-A255 WeakPolarHBondContact CA-O 3.48Å; I217-A255 HydrophobicContact CG1-CB 4.14Å; I217-V257 HydrophobicContact CD1-CG2 4.4Å; I217-V257 HydrophobicContact CG2-CG2 4.31Å
218	T	56.6	Low	48	Very low	23 Å²	23	86.2 Å²	86.2	14%	0.141	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	108.8	164	-57.7	0	0	0	0	108.7	E225 H226 A255 V256 V257	T218-E225 HydrophobicContact CG2-CB 3.91Å; T218-E225 HydrophobicContact CG2-CG 4.1Å; T218-H226 CarbonylContact C-O 3.2Å; T218-H226 WeakPolarHBondContact CA-O 3.44Å; T218-A255 PolarHBondContact N-O 3.45Å; T218-A255 VanDerWaalsContact N-O 3.13Å; T218-V256 WeakPolarHBondContact O-CA 3.36Å; T218-V257 PolarHBondContact O-N 3.03Å
219	L	56.3	Low	48.5	Very low	7 Å²	7	85.2 Å²	85.2	4%	0.037	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	135.8	169.6	-55.8	-178	0	0	0	109.5	I217 H226 A228 L233 V257 L259	I217-L219 HydrophobicContact CG2-CD2 3.55Å; I217-L219 HydrophobicContact CG2-CG 4.11Å; L219-H226 HydrophobicContact CB-CB 4.46Å; L219-H226 PolarHBondContact N-O 2.86Å; L219-H226 PolarHBondContact O-N 2.77Å; L219-A228 HydrophobicContact CD1-CB 4.44Å; L219-L233 HydrophobicContact CD1-CD1 3.93Å; L219-L233 HydrophobicContact CD2-CD1 4.26Å; L219-L233 HydrophobicContact CG-CD1 4.4Å; L219-V257 WeakPolarHBondContact CA-O 3.35Å; L219-V257 HydrophobicContact CD2-CB 3.98Å; L219-L259 HydrophobicContact CD1-CD1 4.08Å; L219-L259 HydrophobicContact CD2-CD1 3.88Å; L219-L259 HydrophobicContact CG-CD1 4.38Å
220	L	54.3	Low	49.3	Very low	42 Å²	42	80 Å²	80	22%	0.22	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	118.3	167.8	-82.4	165.3	0	0	0	108.9	E225 V256 V257 D258 L259 S260	L220-E225 HydrophobicContact CD2-CG 3.58Å; L220-E225 HydrophobicContact CG-CG 4.48Å; L220-V256 HydrophobicContact CD1-CG1 3.67Å; L220-V256 HydrophobicContact CG-CG1 4.26Å; L220-V257 PolarHBondContact N-O 3.03Å; L220-V257 VanDerWaalsContact N-O 3.17Å; L220-D258 HydrophobicContact CB-CB 4.38Å; L220-L259 PolarHBondContact O-N 3.39Å; L220-S260 PolarHBondContact O-N 3.04Å
221	I	55.2	Low	49.8	Very low	21 Å²	21	76.4 Å²	76.4	11%	0.108	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	121.8	178.5	-57.1	176.2	0	0	0	107.9	G223 E224 L259 F267	I221-G223 PolarHBondContact O-N 2.96Å; I221-E224 PolarHBondContact N-O 3.22Å; I221-E224 VanDerWaalsContact N-O 3.14Å; I221-E224 PolarHBondContact O-N 2.98Å; I221-L259 HydrophobicContact CG1-CB 4.14Å; I221-F267 HydrophobicContact CD1-CE2 4.48Å; I221-F267 HydrophobicContact CD1-CZ 4.43Å
222	E	48.5	Very low	50.5	Low	129 Å²	129	76.9 Å²	76.9	60%	0.603	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	12.4	-178.5	-61.2	-176.1	150.3	0	0	116
223	G	49.5	Very low	51.1	Low	66 Å²	66	71 Å²	71	68%	0.68	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.7	7.2	-176.1	0	0	0	0	0	115.5	I221	I221-G223 PolarHBondContact O-N 2.96Å
224	E	46	Very low	51.7	Low	99 Å²	99	65.6 Å²	65.6	46%	0.463	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	138	167.6	-61.3	-168.5	157	0	0	110.3	I221	I221-E224 PolarHBondContact N-O 3.22Å; I221-E224 VanDerWaalsContact N-O 3.14Å; I221-E224 PolarHBondContact O-N 2.98Å
225	E	51.7	Low	52.1	Low	147 Å²	147	64.4 Å²	64.4	69%	0.687	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.6	115.6	178.4	-73.9	173.5	-161.4	0	0	109.9	T218 L220	T218-E225 HydrophobicContact CG2-CB 3.91Å; T218-E225 HydrophobicContact CG2-CG 4.1Å; L220-E225 HydrophobicContact CD2-CG 3.58Å; L220-E225 HydrophobicContact CG-CG 4.48Å
226	H	54.9	Low	52.1	Low	54 Å²	54	63.1 Å²	63.1	25%	0.25	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	125.6	177.1	-60.7	-68.4	0	0	0	110.3	T218 L219	T218-H226 CarbonylContact C-O 3.2Å; T218-H226 WeakPolarHBondContact CA-O 3.44Å; L219-H226 HydrophobicContact CB-CB 4.46Å; L219-H226 PolarHBondContact N-O 2.86Å; L219-H226 PolarHBondContact O-N 2.77Å
227	R	47.2	Very low	52	Low	183 Å²	183	63.6 Å²	63.6	69%	0.691	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.3	133.9	177.7	-67.2	-177.6	174.8	-142.5	-11.6	110.7	I217	I217-R227 WeakPolarHBondContact O-CA 3.2Å
228	A	54.7	Low	51.8	Low	27 Å²	27	71.3 Å²	71.3	22%	0.223	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	154.4	-178.6	0	0	0	0	0	110.9	I217 L219 L233	I217-A228 PolarHBondContact N-O 3.16Å; I217-A228 PolarHBondContact O-N 3.43Å; L219-A228 HydrophobicContact CD1-CB 4.44Å; A228-L233 HydrophobicContact CB-CD1 3.76Å; A228-L233 HydrophobicContact CB-CG 4.42Å
229	H	56.6	Low	51.6	Low	108 Å²	108	75.7 Å²	75.7	50%	0.5	41%	0.41	S	S	.	.			trans	-83.1	121.7	177.9	-68.8	-87	0	0	0	110.9	A231 V232 L233	H229-A231 VanDerWaalsContact C-N 3.3Å; H229-A231 PolarHBondContact O-N 2.9Å; H229-V232 HydrophobicContact CB-CB 4.47Å; H229-V232 HydrophobicContact CB-CG2 3.98Å; H229-V232 PolarHBondContact O-N 3.34Å; H229-L233 PolarHBondContact O-N 3.31Å
230	K	53.9	Low	51.5	Low	57 Å²	57	76 Å²	76	25%	0.248	41%	0.411	C	S	.	.	H	α-helix	trans	-44.3	-50.8	176.4	179.6	175	165.5	-173.2	0	113.1	I217 V232 L233 A234 F244 A249 V250	I217-K230 HydrophobicContact CD1-CB 3.61Å; I217-K230 HydrophobicContact CD1-CD 4.13Å; I217-K230 HydrophobicContact CD1-CG 3.71Å; I217-K230 HydrophobicContact CG1-CB 3.95Å; I217-K230 HydrophobicContact CG1-CG 4.45Å; K230-V232 VanDerWaalsContact C-N 3.32Å; K230-V232 PolarHBondContact O-N 3.39Å; K230-L233 PolarHBondContact O-N 2.82Å; K230-A234 WeakPolarHBondContact O-CB 3.34Å; K230-A234 PolarHBondContact O-N 3.22Å; K230-F244 HydrophobicContact CG-CD2 4.14Å; K230-F244 HydrophobicContact CG-CE2 4.32Å; K230-A249 WeakPolarHBondContact CE-O 3.37Å; K230-A249 PolarHBondContact NZ-O 2.93Å; K230-V250 PolarHBondContact NZ-O 2.97Å
231	A	51.8	Low	51.5	Low	65 Å²	65	77.5 Å²	77.5	54%	0.537	42%	0.419	S	S	.	.	H	α-helix	trans	-60.5	-35.4	-179.2	0	0	0	0	0	113.8	H229 A235	H229-A231 VanDerWaalsContact C-N 3.3Å; H229-A231 PolarHBondContact O-N 2.9Å; A231-A235 WeakPolarHBondContact O-CB 3.37Å; A231-A235 PolarHBondContact O-N 3.04Å
232	V	50.3	Low	51.5	Low	80 Å²	80	83.1 Å²	83.1	49%	0.485	45%	0.445	S	S	.	.	H	α-helix	trans	-70.3	-45.7	178.4	179.5	0	0	0	0	110.1	H229 K230 A235 C236	H229-V232 HydrophobicContact CB-CB 4.47Å; H229-V232 HydrophobicContact CB-CG2 3.98Å; H229-V232 PolarHBondContact O-N 3.34Å; K230-V232 VanDerWaalsContact C-N 3.32Å; K230-V232 PolarHBondContact O-N 3.39Å; V232-A235 PolarHBondContact O-N 3.01Å; V232-C236 PolarHBondContact O-N 3.38Å; V232-C236 VanDerWaalsContact O-N 3.15Å; V232-C236 PolarHBondContact O-SG 3.11Å
233	L	55.2	Low	51.9	Low	26 Å²	26	77.9 Å²	77.9	14%	0.136	42%	0.421	C	S	.	.	H	α-helix	trans	-67.2	-40	-179.7	-66.4	172.8	0	0	0	112.5	L219 A228 H229 K230 C236 S237 F240 F244	L219-L233 HydrophobicContact CD1-CD1 3.93Å; L219-L233 HydrophobicContact CD2-CD1 4.26Å; L219-L233 HydrophobicContact CG-CD1 4.4Å; A228-L233 HydrophobicContact CB-CD1 3.76Å; A228-L233 HydrophobicContact CB-CG 4.42Å; H229-L233 PolarHBondContact O-N 3.31Å; K230-L233 PolarHBondContact O-N 2.82Å; L233-C236 PolarHBondContact O-N 2.86Å; L233-S237 PolarHBondContact O-N 3.41Å; L233-F240 WeakPolarHBondContact O-CB 3.47Å; L233-F244 HydrophobicContact CB-CE2 3.86Å; L233-F244 HydrophobicContact CB-CZ 3.8Å; L233-F244 HydrophobicContact CD1-CZ 4.01Å
234	A	55.4	Low	52.4	Low	21 Å²	21	75 Å²	75	17%	0.174	39%	0.39	C	S	.	.	H	α-helix	trans	-68.1	-37.2	176.8	0	0	0	0	0	112.6	K230 C236 N241 F244	K230-A234 WeakPolarHBondContact O-CB 3.34Å; K230-A234 PolarHBondContact O-N 3.22Å; A234-C236 VanDerWaalsContact C-N 3.33Å; A234-N241 HydrophobicContact CB-CB 4.15Å; A234-F244 HydrophobicContact CB-CD2 4.17Å; A234-F244 HydrophobicContact CB-CE2 4.19Å
235	A	46.7	Very low	52.8	Low	89 Å²	89	77.7 Å²	77.7	74%	0.736	40%	0.397	S	S	*	.	H	α-helix	trans	-71.7	-25	176.9	0	0	0	0	0	113.4	A231 V232	A231-A235 WeakPolarHBondContact O-CB 3.37Å; A231-A235 PolarHBondContact O-N 3.04Å; V232-A235 PolarHBondContact O-N 3.01Å
236	C	43.2	Very low	52.8	Low	52 Å²	52	76.2 Å²	76.2	35%	0.351	39%	0.39	S	S	.	.	H	α-helix	trans	-85	-14.9	178.8	-68.1	0	0	0	0	114.3	V232 L233 A234 A274	V232-C236 PolarHBondContact O-N 3.38Å; V232-C236 VanDerWaalsContact O-N 3.15Å; V232-C236 PolarHBondContact O-SG 3.11Å; L233-C236 PolarHBondContact O-N 2.86Å; A234-C236 VanDerWaalsContact C-N 3.33Å; C236-A274 HydrophobicContact CB-CB 4.14Å
237	S	51.1	Low	52.7	Low	39 Å²	39	77.8 Å²	77.8	27%	0.273	40%	0.396	S	S	.	.			trans	-165.3	132.9	172.6	-168.9	0	0	0	0	112.8	L233 Y239 F240 N241	L233-S237 PolarHBondContact O-N 3.41Å; S237-Y239 PolarHBondContact O-N 2.73Å; S237-Y239 PolarHBondContact OG-N 3.34Å; S237-F240 PolarHBondContact O-N 3.24Å; S237-N241 PolarHBondContact O-N 3.26Å
238	E	49.8	Very low	52.5	Low	163 Å²	163	71.4 Å²	71.4	76%	0.762	39%	0.387	S	S	*	.	H	α-helix	trans	-54.5	-36.8	171.2	-65.2	173.1	144	0	0	111.7	F240 N241 E242	E238-F240 VanDerWaalsContact C-N 3.3Å; E238-F240 PolarHBondContact O-N 2.99Å; E238-N241 CarbonylContact O-C 3.45Å; E238-N241 WeakPolarHBondContact O-CA 3.22Å; E238-N241 VanDerWaalsContact O-CB 3.32Å; E238-N241 WeakPolarHBondContact O-CB 3.41Å; E238-N241 PolarHBondContact O-N 2.89Å; E238-E242 PolarHBondContact O-N 2.81Å
239	Y	52.3	Low	52.4	Low	115 Å²	115	70.2 Å²	70.2	45%	0.451	38%	0.378	S	S	.	.	H	α-helix	trans	-55.9	-39.4	174.8	176.3	-102.5	0	0	0	113.3	S237 L243 F262	S237-Y239 PolarHBondContact O-N 2.73Å; S237-Y239 PolarHBondContact OG-N 3.34Å; Y239-L243 VanDerWaalsContact O-CB 3.27Å; Y239-L243 WeakPolarHBondContact O-CB 3.27Å; Y239-L243 PolarHBondContact O-N 2.64Å; Y239-F262 HydrophobicContact CE1-CE2 4.24Å; Y239-F262 AromaticContact CE1-CZ 3.84Å; Y239-F262 HydrophobicContact CE1-CZ 3.84Å
240	F	54.2	Low	51.9	Low	13 Å²	13	68.1 Å²	68.1	6%	0.057	37%	0.372	C	S	.	.	H	α-helix	trans	-75.8	-32.1	175.5	-78	-60	0	0	0	112.1	L233 S237 E238 L243 F244 L259 L270	L233-F240 WeakPolarHBondContact O-CB 3.47Å; S237-F240 PolarHBondContact O-N 3.24Å; E238-F240 VanDerWaalsContact C-N 3.3Å; E238-F240 PolarHBondContact O-N 2.99Å; F240-L243 HydrophobicContact CD1-CD2 4.24Å; F240-L243 PolarHBondContact O-N 3.37Å; F240-F244 HydrophobicContact CB-CE2 4.26Å; F240-F244 HydrophobicContact CB-CZ 4.43Å; F240-F244 WeakPolarHBondContact O-CD2 3.34Å; F240-F244 WeakPolarHBondContact O-CG 3.47Å; F240-F244 PolarHBondContact O-N 2.89Å; F240-L259 HydrophobicContact CE1-CD1 4.18Å; F240-L259 HydrophobicContact CE1-CD2 4.4Å; F240-L270 HydrophobicContact CE2-CD1 4.4Å
241	N	53.7	Low	51.3	Low	74 Å²	74	71.3 Å²	71.3	40%	0.396	40%	0.396	S	S	.	.	H	α-helix	trans	-62.9	-50.3	174.2	-160.9	19.7	0	0	0	110.6	A234 S237 E238 L243 F244 Y245	A234-N241 HydrophobicContact CB-CB 4.15Å; S237-N241 PolarHBondContact O-N 3.26Å; E238-N241 CarbonylContact O-C 3.45Å; E238-N241 WeakPolarHBondContact O-CA 3.22Å; E238-N241 VanDerWaalsContact O-CB 3.32Å; E238-N241 WeakPolarHBondContact O-CB 3.41Å; E238-N241 PolarHBondContact O-N 2.89Å; N241-L243 PolarHBondContact O-N 3.27Å; N241-F244 PolarHBondContact O-N 2.83Å; N241-F244 VanDerWaalsContact O-N 3.14Å; N241-Y245 WeakPolarHBondContact O-CD2 3.24Å; N241-Y245 PolarHBondContact O-N 2.98Å; N241-Y245 VanDerWaalsContact O-N 3.07Å
242	E	54.3	Low	50.9	Low	138 Å²	138	71.8 Å²	71.8	65%	0.645	39%	0.393	S	S	*	.	H	α-helix	trans	-59.5	-43.4	173.4	-69.8	-171.2	153	0	0	112.3	E238 F244 Y245 E246	E238-E242 PolarHBondContact O-N 2.81Å; E242-F244 PolarHBondContact O-N 3.13Å; E242-Y245 CarbonylContact O-C 3.59Å; E242-Y245 WeakPolarHBondContact O-CA 3.32Å; E242-Y245 WeakPolarHBondContact O-CB 3.36Å; E242-Y245 PolarHBondContact O-N 2.92Å; E242-E246 PolarHBondContact O-N 3.05Å
243	L	56.8	Low	50.5	Low	20 Å²	20	73.1 Å²	73.1	11%	0.105	39%	0.393	C	S	.	.	H	α-helix	trans	-61.5	-31.5	176.5	-164.6	81.8	0	0	0	112.5	Y239 F240 N241 K247 V257 L259	Y239-L243 VanDerWaalsContact O-CB 3.27Å; Y239-L243 WeakPolarHBondContact O-CB 3.27Å; Y239-L243 PolarHBondContact O-N 2.64Å; F240-L243 HydrophobicContact CD1-CD2 4.24Å; F240-L243 PolarHBondContact O-N 3.37Å; N241-L243 PolarHBondContact O-N 3.27Å; L243-K247 WeakPolarHBondContact O-CB 3.14Å; L243-K247 WeakPolarHBondContact O-CG 3.32Å; L243-K247 PolarHBondContact O-N 2.82Å; L243-V257 HydrophobicContact CD2-CG1 3.94Å; L243-L259 HydrophobicContact CD2-CD2 3.57Å
244	F	60.2	Low	50.2	Low	4 Å²	4	79.7 Å²	79.7	2%	0.018	42%	0.423	C	S	.	.	H	α-helix	trans	-74.9	-31.9	173.1	-60.5	-34.7	0	0	0	112.5	I217 K230 L233 A234 F240 N241 E242 A249 V257	I217-F244 HydrophobicContact CD1-CD1 3.73Å; I217-F244 HydrophobicContact CD1-CD2 4.4Å; I217-F244 HydrophobicContact CD1-CE1 3.44Å; I217-F244 VanDerWaalsContact CD1-CE1 3.44Å; I217-F244 HydrophobicContact CD1-CE2 4.15Å; I217-F244 HydrophobicContact CD1-CG 4.22Å; I217-F244 HydrophobicContact CD1-CZ 3.67Å; K230-F244 HydrophobicContact CG-CD2 4.14Å; K230-F244 HydrophobicContact CG-CE2 4.32Å; L233-F244 HydrophobicContact CB-CE2 3.86Å; L233-F244 HydrophobicContact CB-CZ 3.8Å; L233-F244 HydrophobicContact CD1-CZ 4.01Å; A234-F244 HydrophobicContact CB-CD2 4.17Å; A234-F244 HydrophobicContact CB-CE2 4.19Å; F240-F244 HydrophobicContact CB-CE2 4.26Å; F240-F244 HydrophobicContact CB-CZ 4.43Å; F240-F244 WeakPolarHBondContact O-CD2 3.34Å; F240-F244 WeakPolarHBondContact O-CG 3.47Å; F240-F244 PolarHBondContact O-N 2.89Å; N241-F244 PolarHBondContact O-N 2.83Å; N241-F244 VanDerWaalsContact O-N 3.14Å; E242-F244 PolarHBondContact O-N 3.13Å; F244-A249 HydrophobicContact CB-CB 4.32Å; F244-A249 WeakPolarHBondContact O-CB 3.08Å; F244-A249 PolarHBondContact O-N 2.88Å; F244-V257 HydrophobicContact CD1-CG2 3.95Å; F244-V257 HydrophobicContact CE1-CB 4.46Å; F244-V257 HydrophobicContact CE1-CG1 4.38Å; F244-V257 HydrophobicContact CE1-CG2 3.95Å
245	Y	54.8	Low	50.1	Low	156 Å²	156	79.1 Å²	79.1	61%	0.612	42%	0.419	S	S	*	.	H	α-helix	trans	-66.4	-50.8	168.3	-89.3	-89	0	0	0	111.8	N241 E242 K247 G248 V250	N241-Y245 WeakPolarHBondContact O-CD2 3.24Å; N241-Y245 PolarHBondContact O-N 2.98Å; N241-Y245 VanDerWaalsContact O-N 3.07Å; E242-Y245 CarbonylContact O-C 3.59Å; E242-Y245 WeakPolarHBondContact O-CA 3.32Å; E242-Y245 WeakPolarHBondContact O-CB 3.36Å; E242-Y245 PolarHBondContact O-N 2.92Å; Y245-K247 PolarHBondContact O-N 3.43Å; Y245-G248 PolarHBondContact O-N 3.23Å; Y245-V250 HydrophobicContact CD1-CG2 3.57Å; Y245-V250 HydrophobicContact CD2-CG2 4.29Å; Y245-V250 HydrophobicContact CE1-CG2 3.69Å; Y245-V250 HydrophobicContact CE2-CG2 4.4Å; Y245-V250 HydrophobicContact CG-CG2 3.89Å
246	E	52.8	Low	50.4	Low	117 Å²	117	79.3 Å²	79.3	55%	0.547	41%	0.411	S	S	.	.	H	α-helix	trans	-57.9	-32.8	179.9	-163.3	-138.6	169.3	0	0	112.4	K54 E242 G248	K54-E246 IonicContact NZ-OE1 3.55Å; K54-E246 PolarHBondContact NZ-OE1 2.98Å; K54-E246 IonicContact NZ-OE2 3.61Å; E242-E246 PolarHBondContact O-N 3.05Å; E246-G248 VanDerWaalsContact C-N 3.32Å
247	K	52.8	Low	50.9	Low	87 Å²	87	76.9 Å²	76.9	38%	0.378	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-0	177.4	-64.8	-91.7	-177.9	148.4	0	113.8	L243 Y245 A249 V257 D258	L243-K247 WeakPolarHBondContact O-CB 3.14Å; L243-K247 WeakPolarHBondContact O-CG 3.32Å; L243-K247 PolarHBondContact O-N 2.82Å; Y245-K247 PolarHBondContact O-N 3.43Å; K247-A249 HydrophobicContact CB-CB 4.5Å; K247-A249 PolarHBondContact O-N 3.17Å; K247-V257 HydrophobicContact CG-CG1 4.44Å; K247-D258 PolarHBondContact NZ-O 3.08Å
248	G	42.4	Very low	50.9	Low	49 Å²	49	78.6 Å²	78.6	51%	0.505	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.3	18.1	-175.5	0	0	0	0	0	114	Y245 E246 V250	Y245-G248 PolarHBondContact O-N 3.23Å; E246-G248 VanDerWaalsContact C-N 3.32Å; G248-V250 PolarHBondContact O-N 2.66Å; G248-V250 VanDerWaalsContact O-N 3.15Å
249	A	51.3	Low	51.2	Low	2 Å²	2	71.4 Å²	71.4	2%	0.017	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	11.8	-171.5	0	0	0	0	0	113.8	K230 F244 K247 A255	K230-A249 WeakPolarHBondContact CE-O 3.37Å; K230-A249 PolarHBondContact NZ-O 2.93Å; F244-A249 HydrophobicContact CB-CB 4.32Å; F244-A249 WeakPolarHBondContact O-CB 3.08Å; F244-A249 PolarHBondContact O-N 2.88Å; K247-A249 HydrophobicContact CB-CB 4.5Å; K247-A249 PolarHBondContact O-N 3.17Å; A249-A255 HydrophobicContact CB-CB 3.46Å; A249-A255 VanDerWaalsContact CB-CB 3.46Å
250	V	46	Very low	51	Low	63 Å²	63	69.4 Å²	69.4	38%	0.382	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-46.4	-173.5	-176.1	0	0	0	0	111.3	K230 Y245 G248	K230-V250 PolarHBondContact NZ-O 2.97Å; Y245-V250 HydrophobicContact CD1-CG2 3.57Å; Y245-V250 HydrophobicContact CD2-CG2 4.29Å; Y245-V250 HydrophobicContact CE1-CG2 3.69Å; Y245-V250 HydrophobicContact CE2-CG2 4.4Å; Y245-V250 HydrophobicContact CG-CG2 3.89Å; G248-V250 PolarHBondContact O-N 2.66Å; G248-V250 VanDerWaalsContact O-N 3.15Å
251	T	42.6	Very low	50.6	Low	124 Å²	124	72.4 Å²	72.4	76%	0.761	41%	0.405	S	S	*	.	S	Bend	trans	-105	0.4	-167.4	53.4	0	0	0	0	115.5
252	T	42.1	Very low	50.1	Low	75 Å²	75	72.1 Å²	72.1	46%	0.46	40%	0.4	S	S	.	.			trans	-115.5	130.7	-177.4	49.5	0	0	0	0	112.2	E254	T252-E254 VanDerWaalsContact C-N 3.26Å; T252-E254 PolarHBondContact O-N 2.87Å
253	H	43.7	Very low	49.8	Very low	108 Å²	108	68.1 Å²	68.1	50%	0.5	39%	0.391	S	S	.	.	S	Bend	trans	-77.1	1.8	-177.2	-74.1	-72.1	0	0	0	115.1	F214 D216	F214-H253 HydrophobicContact CD1-CB 3.92Å; F214-H253 AromaticContact CD1-CG 3.81Å; F214-H253 AromaticContact CD1-ND1 3.6Å; F214-H253 HydrophobicContact CE1-CB 4.02Å; F214-H253 AromaticContact CE1-CG 3.84Å; F214-H253 AromaticContact CE1-ND1 3.98Å; F214-H253 AromaticContact CG-ND1 3.95Å; D216-H253 VanDerWaalsContact CA-O 3.25Å; D216-H253 WeakPolarHBondContact CA-O 3.11Å; D216-H253 VanDerWaalsContact CB-O 3.23Å; D216-H253 WeakPolarHBondContact CB-O 3.44Å; D216-H253 VanDerWaalsContact OD1-O 3.11Å; D216-H253 IonicContact OD2-CE1 3.51Å; D216-H253 IonicContact OD2-CG 3.44Å; D216-H253 IonicContact OD2-ND1 2.64Å; D216-H253 PolarHBondContact OD2-ND1 3.32Å
254	E	48.9	Very low	49.4	Very low	164 Å²	164	70.8 Å²	70.8	77%	0.766	40%	0.401	S	S	*	.			trans	-138.5	88.2	170	-72	-162.2	147.5	0	0	109.9	D216 T252	D216-E254 WeakPolarHBondContact O-CA 3.34Å; T252-E254 VanDerWaalsContact C-N 3.26Å; T252-E254 PolarHBondContact O-N 2.87Å
255	A	51.5	Low	48.7	Very low	9 Å²	9	74.1 Å²	74.1	7%	0.074	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	126.6	175.8	0	0	0	0	0	111.9	D216 I217 T218 A249	D216-A255 PolarHBondContact O-N 3.38Å; I217-A255 WeakPolarHBondContact CA-O 3.48Å; I217-A255 HydrophobicContact CG1-CB 4.14Å; T218-A255 PolarHBondContact N-O 3.45Å; T218-A255 VanDerWaalsContact N-O 3.13Å; A249-A255 HydrophobicContact CB-CB 3.46Å; A249-A255 VanDerWaalsContact CB-CB 3.46Å
256	V	53.2	Low	48.3	Very low	93 Å²	93	69.6 Å²	69.6	56%	0.564	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100	103	177.1	-178	0	0	0	0	109.3	T218 L220	T218-V256 WeakPolarHBondContact O-CA 3.36Å; L220-V256 HydrophobicContact CD1-CG1 3.67Å; L220-V256 HydrophobicContact CG-CG1 4.26Å
257	V	53.8	Low	48.2	Very low	1 Å²	1	66.7 Å²	66.7	1%	0.006	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	96.6	-174.5	-174.7	0	0	0	0	109.4	I217 T218 L219 L220 L243 F244 K247 L259	I217-V257 HydrophobicContact CD1-CG2 4.4Å; I217-V257 HydrophobicContact CG2-CG2 4.31Å; T218-V257 PolarHBondContact O-N 3.03Å; L219-V257 WeakPolarHBondContact CA-O 3.35Å; L219-V257 HydrophobicContact CD2-CB 3.98Å; L220-V257 PolarHBondContact N-O 3.03Å; L220-V257 VanDerWaalsContact N-O 3.17Å; L243-V257 HydrophobicContact CD2-CG1 3.94Å; F244-V257 HydrophobicContact CD1-CG2 3.95Å; F244-V257 HydrophobicContact CE1-CB 4.46Å; F244-V257 HydrophobicContact CE1-CG1 4.38Å; F244-V257 HydrophobicContact CE1-CG2 3.95Å; K247-V257 HydrophobicContact CG-CG1 4.44Å; V257-L259 HydrophobicContact CG1-CD2 4.48Å; V257-L259 HydrophobicContact CG1-CG 4.34Å; V257-L259 PolarHBondContact O-N 3.39Å
258	D	51.2	Low	48	Very low	76 Å²	76	63.8 Å²	63.8	41%	0.406	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	118.7	173	-164.7	-22.7	0	0	0	110.7	L220 K247 S260	L220-D258 HydrophobicContact CB-CB 4.38Å; K247-D258 PolarHBondContact NZ-O 3.08Å; D258-S260 WeakPolarHBondContact OD1-CB 3.29Å; D258-S260 PolarHBondContact OD1-N 3.15Å; D258-S260 PolarHBondContact OD1-OG 2.6Å
259	L	57	Low	48.1	Very low	12 Å²	12	65.4 Å²	65.4	6%	0.063	40%	0.396	C	S	.	.			trans	-117.7	18.1	-179.2	-74	176.7	0	0	0	111.4	L219 L220 I221 F240 L243 V257 G261 F262	L219-L259 HydrophobicContact CD1-CD1 4.08Å; L219-L259 HydrophobicContact CD2-CD1 3.88Å; L219-L259 HydrophobicContact CG-CD1 4.38Å; L220-L259 PolarHBondContact O-N 3.39Å; I221-L259 HydrophobicContact CG1-CB 4.14Å; F240-L259 HydrophobicContact CE1-CD1 4.18Å; F240-L259 HydrophobicContact CE1-CD2 4.4Å; L243-L259 HydrophobicContact CD2-CD2 3.57Å; V257-L259 HydrophobicContact CG1-CD2 4.48Å; V257-L259 HydrophobicContact CG1-CG 4.34Å; V257-L259 PolarHBondContact O-N 3.39Å; L259-G261 PolarHBondContact O-N 2.83Å; L259-F262 HydrophobicContact CD2-CD2 4.21Å; L259-F262 HydrophobicContact CD2-CE2 4.4Å; L259-F262 PolarHBondContact O-N 3.45Å
260	S	47.8	Very low	47.6	Very low	73 Å²	73	68.5 Å²	68.5	51%	0.51	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-0.9	-173.5	53.1	0	0	0	0	117.2	L220 D258	L220-S260 PolarHBondContact O-N 3.04Å; D258-S260 WeakPolarHBondContact OD1-CB 3.29Å; D258-S260 PolarHBondContact OD1-N 3.15Å; D258-S260 PolarHBondContact OD1-OG 2.6Å
261	G	44.7	Very low	47.6	Very low	76 Å²	76	68 Å²	68	78%	0.784	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-17.3	168.2	0	0	0	0	0	115.3	L259 A263	L259-G261 PolarHBondContact O-N 2.83Å; G261-A263 PolarHBondContact O-N 2.94Å
262	F	44.1	Very low	47.5	Very low	68 Å²	68	65.1 Å²	65.1	30%	0.298	39%	0.387	S	S	.	.	S	Bend	trans	-80.8	117.4	-179.9	-86.4	-91.3	0	0	0	111.5	Y239 L259	Y239-F262 HydrophobicContact CE1-CE2 4.24Å; Y239-F262 AromaticContact CE1-CZ 3.84Å; Y239-F262 HydrophobicContact CE1-CZ 3.84Å; L259-F262 HydrophobicContact CD2-CD2 4.21Å; L259-F262 HydrophobicContact CD2-CE2 4.4Å; L259-F262 PolarHBondContact O-N 3.45Å
263	A	48.3	Very low	47.4	Very low	54 Å²	54	68.6 Å²	68.6	45%	0.446	40%	0.396	S	S	.	.			trans	-64.5	140.8	172.6	0	0	0	0	0	110.9	G261 A265 S266	G261-A263 PolarHBondContact O-N 2.94Å; A263-A265 PolarHBondContact O-N 3.38Å; A263-S266 WeakPolarHBondContact O-CB 3.43Å; A263-S266 PolarHBondContact O-N 3.19Å
264	K	47.5	Very low	47.2	Very low	76 Å²	76	64.7 Å²	64.7	33%	0.33	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-19.4	-175.3	-159.6	162.6	-167.8	150.8	0	115.2	M298	K264-M298 HydrophobicContact CD-CE 4.22Å; K264-M298 HydrophobicContact CG-CE 3.8Å
265	A	45.9	Very low	46.9	Very low	73 Å²	73	62.7 Å²	62.7	60%	0.603	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-32.4	173.7	0	0	0	0	0	113.6	A263 F267 L268 P269	A263-A265 PolarHBondContact O-N 3.38Å; A265-F267 VanDerWaalsContact C-N 3.33Å; A265-L268 PolarHBondContact O-N 2.95Å; A265-P269 WeakPolarHBondContact O-CD 3.27Å
266	S	47.8	Very low	46.4	Very low	62 Å²	62	66 Å²	66	43%	0.434	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-25.6	-179	-50.5	0	0	0	0	113	A263	A263-S266 WeakPolarHBondContact O-CB 3.43Å; A263-S266 PolarHBondContact O-N 3.19Å
267	F	49.3	Very low	45.7	Very low	55 Å²	55	64.9 Å²	64.9	24%	0.241	39%	0.385	C	S	.	.	H	α-helix	trans	-76.5	-22.9	178.6	-170.4	-113.3	0	0	0	112.7	I221 A265 L271	I221-F267 HydrophobicContact CD1-CE2 4.48Å; I221-F267 HydrophobicContact CD1-CZ 4.43Å; A265-F267 VanDerWaalsContact C-N 3.33Å; F267-L271 HydrophobicContact CD1-CD1 4.3Å; F267-L271 HydrophobicContact CE1-CD1 3.65Å; F267-L271 HydrophobicContact CE1-CD2 4.38Å; F267-L271 HydrophobicContact CE2-CD1 4.26Å; F267-L271 HydrophobicContact CZ-CD1 3.62Å; F267-L271 PolarHBondContact O-N 3.36Å; F267-L271 VanDerWaalsContact O-N 3.12Å
268	L	49.6	Very low	45.3	Very low	26 Å²	26	71.1 Å²	71.1	14%	0.136	42%	0.423	C	S	.	.	H	α-helix	trans	-68.1	-49	-177	-69.7	-176.4	0	0	0	113.9	A265 L270 L271 D272 M298 E300 V301	A265-L268 PolarHBondContact O-N 2.95Å; L268-L270 VanDerWaalsContact C-N 3.27Å; L268-L270 PolarHBondContact O-N 2.84Å; L268-L271 PolarHBondContact O-N 3.36Å; L268-D272 WeakPolarHBondContact O-CB 3.26Å; L268-D272 PolarHBondContact O-N 3.06Å; L268-M298 HydrophobicContact CD1-CE 3.82Å; L268-M298 HydrophobicContact CD2-CE 3.66Å; L268-M298 HydrophobicContact CD2-SD 4.45Å; L268-M298 HydrophobicContact CG-CE 4Å; L268-E300 HydrophobicContact CD1-CB 4.48Å; L268-E300 WeakPolarHBondContact CD1-OE2 3.14Å; L268-V301 HydrophobicContact CD2-CG2 3.33Å
269	P	43.4	Very low	44.8	Very low	83 Å²	83	74.6 Å²	74.6	54%	0.539	44%	0.44	S	S	.	.	H	α-helix	trans	-63.9	-30.3	177.2	-23.7	35	0	0	0	113.5	A265 D272 F273	A265-P269 WeakPolarHBondContact O-CD 3.27Å; P269-D272 PolarHBondContact O-N 3.05Å; P269-F273 WeakPolarHBondContact O-CB 3.47Å; P269-F273 PolarHBondContact O-N 3Å
270	L	42.4	Very low	43.9	Very low	68 Å²	68	80.3 Å²	80.3	36%	0.356	48%	0.476	S	S	.	.	H	α-helix	trans	-68.9	-38.8	174.9	-78.2	164.8	0	0	0	111.7	F240 L268 A274	F240-L270 HydrophobicContact CE2-CD1 4.4Å; L268-L270 VanDerWaalsContact C-N 3.27Å; L268-L270 PolarHBondContact O-N 2.84Å; L270-A274 VanDerWaalsContact O-CB 3.26Å; L270-A274 WeakPolarHBondContact O-CB 3.3Å; L270-A274 PolarHBondContact O-N 3.31Å; L270-A274 VanDerWaalsContact O-N 3.1Å
271	L	45.1	Very low	43.4	Very low	53 Å²	53	82 Å²	82	28%	0.277	47%	0.474	S	S	.	.	H	α-helix	trans	-67	-43.1	170.3	-122.8	71.4	0	0	0	111.6	F267 L268 F273 A274 Y275	F267-L271 HydrophobicContact CD1-CD1 4.3Å; F267-L271 HydrophobicContact CE1-CD1 3.65Å; F267-L271 HydrophobicContact CE1-CD2 4.38Å; F267-L271 HydrophobicContact CE2-CD1 4.26Å; F267-L271 HydrophobicContact CZ-CD1 3.62Å; F267-L271 PolarHBondContact O-N 3.36Å; F267-L271 VanDerWaalsContact O-N 3.12Å; L268-L271 PolarHBondContact O-N 3.36Å; L271-F273 PolarHBondContact O-N 3.27Å; L271-A274 PolarHBondContact O-N 3.44Å; L271-Y275 HydrophobicContact CG-CD2 4.3Å; L271-Y275 HydrophobicContact CG-CE2 4.33Å; L271-Y275 WeakPolarHBondContact O-CB 3.31Å; L271-Y275 WeakPolarHBondContact O-CD2 3.35Å; L271-Y275 PolarHBondContact O-N 3.05Å
272	D	39.7	Very low	43.5	Very low	62 Å²	62	82.8 Å²	82.8	33%	0.332	46%	0.461	S	S	.	.	H	α-helix	trans	-62.8	-43.6	-179.2	-156.8	30.7	0	0	0	110.8	L268 P269 Y275 T276 I304	L268-D272 WeakPolarHBondContact O-CB 3.26Å; L268-D272 PolarHBondContact O-N 3.06Å; P269-D272 PolarHBondContact O-N 3.05Å; D272-Y275 PolarHBondContact O-N 3.43Å; D272-T276 VanDerWaalsContact O-CB 3.3Å; D272-T276 WeakPolarHBondContact O-CB 3.07Å; D272-T276 VanDerWaalsContact O-CG2 3.23Å; D272-T276 WeakPolarHBondContact O-CG2 3.33Å; D272-T276 PolarHBondContact O-N 2.89Å; D272-T276 PolarHBondContact O-OG1 3.3Å; D272-I304 WeakPolarHBondContact OD1-CG2 3.03Å
273	F	40	Very low	43.2	Very low	148 Å²	148	84.5 Å²	84.5	65%	0.649	47%	0.468	S	S	*	.	H	α-helix	trans	-62.2	-48	173.6	-171.3	-105.2	0	0	0	112.2	P269 L271 Y275 T276 S277	P269-F273 WeakPolarHBondContact O-CB 3.47Å; P269-F273 PolarHBondContact O-N 3Å; L271-F273 PolarHBondContact O-N 3.27Å; F273-Y275 VanDerWaalsContact C-N 3.25Å; F273-Y275 PolarHBondContact O-N 2.98Å; F273-T276 PolarHBondContact O-N 3.19Å; F273-T276 PolarHBondContact O-OG1 2.76Å; F273-S277 PolarHBondContact O-N 3.12Å
274	A	41	Very low	42.9	Very low	27 Å²	27	86.1 Å²	86.1	22%	0.223	48%	0.475	C	S	.	.	H	α-helix	trans	-64.9	-23.2	179.5	0	0	0	0	0	114.5	C236 L270 L271 S277	C236-A274 HydrophobicContact CB-CB 4.14Å; L270-A274 VanDerWaalsContact O-CB 3.26Å; L270-A274 WeakPolarHBondContact O-CB 3.3Å; L270-A274 PolarHBondContact O-N 3.31Å; L270-A274 VanDerWaalsContact O-N 3.1Å; L271-A274 PolarHBondContact O-N 3.44Å; A274-S277 PolarHBondContact O-OG 3.24Å
275	Y	42.7	Very low	42.9	Very low	122 Å²	122	85.6 Å²	85.6	48%	0.478	48%	0.478	S	S	.	.	H	α-helix	trans	-105.4	-7.5	178.3	-80.6	-89.8	0	0	0	114.4	L271 D272 F273 I289	L271-Y275 HydrophobicContact CG-CD2 4.3Å; L271-Y275 HydrophobicContact CG-CE2 4.33Å; L271-Y275 WeakPolarHBondContact O-CB 3.31Å; L271-Y275 WeakPolarHBondContact O-CD2 3.35Å; L271-Y275 PolarHBondContact O-N 3.05Å; D272-Y275 PolarHBondContact O-N 3.43Å; F273-Y275 VanDerWaalsContact C-N 3.25Å; F273-Y275 PolarHBondContact O-N 2.98Å; Y275-I289 HydrophobicContact CD1-CD1 4.29Å; Y275-I289 HydrophobicContact CE1-CD1 3.49Å; Y275-I289 VanDerWaalsContact CE1-CD1 3.49Å; Y275-I289 HydrophobicContact CE2-CD1 4.37Å
276	T	40.3	Very low	42.9	Very low	77 Å²	77	83.3 Å²	83.3	47%	0.472	46%	0.455	S	S	.	.	H	α-helix	trans	-95.7	-17.7	172.8	50.9	0	0	0	0	113.6	D272 F273 V278	D272-T276 VanDerWaalsContact O-CB 3.3Å; D272-T276 WeakPolarHBondContact O-CB 3.07Å; D272-T276 VanDerWaalsContact O-CG2 3.23Å; D272-T276 WeakPolarHBondContact O-CG2 3.33Å; D272-T276 PolarHBondContact O-N 2.89Å; D272-T276 PolarHBondContact O-OG1 3.3Å; F273-T276 PolarHBondContact O-N 3.19Å; F273-T276 PolarHBondContact O-OG1 2.76Å; T276-V278 WeakPolarHBondContact O-CG2 3.35Å; T276-V278 PolarHBondContact O-N 2.79Å
277	S	37.9	Very low	42.8	Very low	70 Å²	70	82.4 Å²	82.4	49%	0.49	45%	0.452	S	S	.	.	S	Bend	trans	-61.9	116.1	165.2	55.4	0	0	0	0	110.6	F273 A274 L279	F273-S277 PolarHBondContact O-N 3.12Å; A274-S277 PolarHBondContact O-OG 3.24Å; S277-L279 VanDerWaalsContact C-N 3.3Å; S277-L279 PolarHBondContact O-N 3.22Å
278	V	46.4	Very low	42.5	Very low	133 Å²	133	84.6 Å²	84.6	81%	0.806	47%	0.466	S	S	*	.			trans	-79.3	67.5	-164.4	-167.2	0	0	0	0	113	T276	T276-V278 WeakPolarHBondContact O-CG2 3.35Å; T276-V278 PolarHBondContact O-N 2.79Å
279	L	40.5	Very low	42.2	Very low	149 Å²	149	85.1 Å²	85.1	78%	0.78	47%	0.468	S	S	*	.	S	Bend	trans	-126.1	105	172.9	-81.1	167.2	0	0	0	111.3	S277	S277-L279 VanDerWaalsContact C-N 3.3Å; S277-L279 PolarHBondContact O-N 3.22Å
280	T	36.9	Very low	42.4	Very low	132 Å²	132	81.6 Å²	81.6	81%	0.81	45%	0.446	S	S	*	.			trans	65.5	85.3	174.7	63.5	0	0	0	0	117	N282	T280-N282 PolarHBondContact O-N 3.01Å
281	F	38	Very low	42.5	Very low	108 Å²	108	81.2 Å²	81.2	47%	0.474	44%	0.444	S	S	.	.			trans	-66.8	122.9	166.7	-112.9	-102.1	0	0	0	111.7	M286 V308 V312	F281-M286 HydrophobicContact CE1-CG 4.5Å; F281-V308 HydrophobicContact CE1-CG1 3.88Å; F281-V308 HydrophobicContact CZ-CG1 3.53Å; F281-V312 HydrophobicContact CE1-CG2 4.35Å
282	N	45.8	Very low	42.4	Very low	93 Å²	93	83.3 Å²	83.3	50%	0.497	46%	0.455	S	S	.	.			trans	-125.3	106.7	173.2	-163.2	-33.5	0	0	0	111	T280 C284 V285 M286	T280-N282 PolarHBondContact O-N 3.01Å; N282-C284 PolarHBondContact O-N 2.91Å; N282-C284 VanDerWaalsContact O-N 3.16Å; N282-C284 PolarHBondContact OD1-N 3.4Å; N282-V285 HydrophobicContact CB-CB 4.45Å; N282-V285 HydrophobicContact CB-CG2 4.05Å; N282-V285 PolarHBondContact O-N 3.32Å; N282-M286 PolarHBondContact O-N 3.37Å
283	F	39.6	Very low	42.6	Very low	104 Å²	104	80.7 Å²	80.7	46%	0.456	44%	0.442	S	S	.	.	H	α-helix	trans	-59.4	-29	-172.1	-71.5	-80.8	0	0	0	114	A287 V312	F283-A287 WeakPolarHBondContact O-CB 3.5Å; F283-A287 PolarHBondContact O-N 2.81Å; F283-V312 HydrophobicContact CE1-CG1 4.19Å; F283-V312 HydrophobicContact CZ-CG1 4.2Å
284	C	41.4	Very low	42.9	Very low	87 Å²	87	79.9 Å²	79.9	59%	0.588	44%	0.435	S	S	*	.	H	α-helix	trans	-67.5	-42.5	176.4	-59.6	0	0	0	0	111.3	N282 A287 D288	N282-C284 PolarHBondContact O-N 2.91Å; N282-C284 VanDerWaalsContact O-N 3.16Å; N282-C284 PolarHBondContact OD1-N 3.4Å; C284-A287 WeakPolarHBondContact O-CB 3.1Å; C284-A287 PolarHBondContact O-N 2.87Å; C284-D288 PolarHBondContact O-N 3.02Å
285	V	48	Very low	42.8	Very low	66 Å²	66	86.1 Å²	86.1	40%	0.4	46%	0.459	S	S	.	.	H	α-helix	trans	-65.7	-42.1	179.1	-177.6	0	0	0	0	110.7	N282 A287 D288 I289	N282-V285 HydrophobicContact CB-CB 4.45Å; N282-V285 HydrophobicContact CB-CG2 4.05Å; N282-V285 PolarHBondContact O-N 3.32Å; V285-A287 PolarHBondContact O-N 3.35Å; V285-D288 PolarHBondContact O-N 2.87Å; V285-I289 HydrophobicContact CG1-CD1 3.78Å; V285-I289 HydrophobicContact CG1-CG1 4.35Å; V285-I289 WeakPolarHBondContact O-CB 3.45Å; V285-I289 VanDerWaalsContact O-CG1 3.3Å; V285-I289 WeakPolarHBondContact O-CG1 3.5Å; V285-I289 PolarHBondContact O-N 3.35Å
286	M	45.6	Very low	42.8	Very low	25 Å²	25	83.1 Å²	83.1	12%	0.123	45%	0.451	C	S	.	.	H	α-helix	trans	-62.5	-39.5	172.9	-83	-70.3	-78.1	0	0	112.8	F281 N282 D288 A290 C305 V308	F281-M286 HydrophobicContact CE1-CG 4.5Å; N282-M286 PolarHBondContact O-N 3.37Å; M286-D288 VanDerWaalsContact C-N 3.34Å; M286-D288 PolarHBondContact O-N 3.13Å; M286-A290 VanDerWaalsContact O-CB 3.24Å; M286-A290 WeakPolarHBondContact O-CB 3.44Å; M286-A290 PolarHBondContact O-N 3.2Å; M286-C305 HydrophobicContact CE-CB 4.2Å; M286-V308 HydrophobicContact CE-CB 4.26Å; M286-V308 HydrophobicContact CE-CG1 3.78Å
287	A	45.3	Very low	42.7	Very low	43 Å²	43	86.2 Å²	86.2	36%	0.355	46%	0.464	S	S	.	.	H	α-helix	trans	-62.4	-41.9	175.4	0	0	0	0	0	111.7	F283 C284 V285 A290 N291	F283-A287 WeakPolarHBondContact O-CB 3.5Å; F283-A287 PolarHBondContact O-N 2.81Å; C284-A287 WeakPolarHBondContact O-CB 3.1Å; C284-A287 PolarHBondContact O-N 2.87Å; V285-A287 PolarHBondContact O-N 3.35Å; A287-A290 PolarHBondContact O-N 3.14Å; A287-N291 WeakPolarHBondContact O-CB 3.4Å; A287-N291 PolarHBondContact O-N 2.87Å; A287-N291 PolarHBondContact O-ND2 3.14Å; A287-N291 VanDerWaalsContact O-ND2 3.14Å; A287-N291 PolarHBondContact O-OD1 2.98Å
288	D	43	Very low	42.9	Very low	101 Å²	101	84.8 Å²	84.8	54%	0.54	45%	0.45	S	S	.	.	H	α-helix	trans	-78.2	-33.1	-179.2	-76.4	-32.1	0	0	0	114.2	C284 V285 M286 N291 L292	C284-D288 PolarHBondContact O-N 3.02Å; V285-D288 PolarHBondContact O-N 2.87Å; M286-D288 VanDerWaalsContact C-N 3.34Å; M286-D288 PolarHBondContact O-N 3.13Å; D288-N291 WeakPolarHBondContact O-CB 3.37Å; D288-N291 PolarHBondContact O-N 3.34Å; D288-N291 PolarHBondContact OD1-ND2 2.66Å; D288-L292 WeakPolarHBondContact O-CB 3.43Å; D288-L292 PolarHBondContact O-N 2.98Å
289	I	44	Very low	43.2	Very low	36 Å²	36	83 Å²	83	19%	0.185	44%	0.44	C	S	.	.	H	α-helix	trans	-62.6	-44.9	167.1	-69.9	169.2	0	0	0	109.9	Y275 V285 N291 L292 A293 V301	Y275-I289 HydrophobicContact CD1-CD1 4.29Å; Y275-I289 HydrophobicContact CE1-CD1 3.49Å; Y275-I289 VanDerWaalsContact CE1-CD1 3.49Å; Y275-I289 HydrophobicContact CE2-CD1 4.37Å; V285-I289 HydrophobicContact CG1-CD1 3.78Å; V285-I289 HydrophobicContact CG1-CG1 4.35Å; V285-I289 WeakPolarHBondContact O-CB 3.45Å; V285-I289 VanDerWaalsContact O-CG1 3.3Å; V285-I289 WeakPolarHBondContact O-CG1 3.5Å; V285-I289 PolarHBondContact O-N 3.35Å; I289-N291 VanDerWaalsContact C-N 3.3Å; I289-N291 PolarHBondContact O-N 3.01Å; I289-L292 PolarHBondContact O-N 2.73Å; I289-A293 WeakPolarHBondContact O-CB 3.49Å; I289-A293 PolarHBondContact O-N 3.41Å; I289-V301 HydrophobicContact CG2-CG1 4.48Å
290	A	46.2	Very low	43.6	Very low	10 Å²	10	81.5 Å²	81.5	8%	0.083	43%	0.429	C	S	.	.	H	α-helix	trans	-67.9	-29	175.6	0	0	0	0	0	112.4	M286 A287 R294 L302 C305	M286-A290 VanDerWaalsContact O-CB 3.24Å; M286-A290 WeakPolarHBondContact O-CB 3.44Å; M286-A290 PolarHBondContact O-N 3.2Å; A287-A290 PolarHBondContact O-N 3.14Å; A290-R294 VanDerWaalsContact C-CZ 3.45Å; A290-R294 VanDerWaalsContact C-NH2 3.34Å; A290-R294 VanDerWaalsContact CB-NH2 3.25Å; A290-R294 VanDerWaalsContact O-CB 3.26Å; A290-R294 WeakPolarHBondContact O-CB 3.07Å; A290-R294 WeakPolarHBondContact O-CG 3.48Å; A290-R294 PolarHBondContact O-N 3.47Å; A290-R294 PolarHBondContact O-NE 3.43Å; A290-R294 VanDerWaalsContact O-NE 3.16Å; A290-R294 PolarHBondContact O-NH2 3.33Å; A290-L302 HydrophobicContact CB-CD2 4.22Å; A290-L302 WeakPolarHBondContact O-CD2 3.29Å; A290-C305 HydrophobicContact CB-CB 4.46Å
291	N	45.7	Very low	44.2	Very low	59 Å²	59	76.2 Å²	76.2	32%	0.316	40%	0.396	S	S	.	.	H	α-helix	trans	-64.7	-48.4	168.6	-68.3	-30.6	0	0	0	110.7	A287 D288 I289 R294 H295	A287-N291 WeakPolarHBondContact O-CB 3.4Å; A287-N291 PolarHBondContact O-N 2.87Å; A287-N291 PolarHBondContact O-ND2 3.14Å; A287-N291 VanDerWaalsContact O-ND2 3.14Å; A287-N291 PolarHBondContact O-OD1 2.98Å; D288-N291 WeakPolarHBondContact O-CB 3.37Å; D288-N291 PolarHBondContact O-N 3.34Å; D288-N291 PolarHBondContact OD1-ND2 2.66Å; I289-N291 VanDerWaalsContact C-N 3.3Å; I289-N291 PolarHBondContact O-N 3.01Å; N291-R294 PolarHBondContact O-N 2.85Å; N291-R294 PolarHBondContact OD1-NH1 3.14Å; N291-H295 PolarHBondContact O-CD2 3.43Å; N291-H295 PolarHBondContact O-N 3.07Å
292	L	41.7	Very low	45	Very low	97 Å²	97	72.9 Å²	72.9	51%	0.508	38%	0.383	S	S	.	.	H	α-helix	trans	-64.3	-45.3	-179.8	-170.9	63.9	0	0	0	111.8	D288 I289 R294 H295 L296	D288-L292 WeakPolarHBondContact O-CB 3.43Å; D288-L292 PolarHBondContact O-N 2.98Å; I289-L292 PolarHBondContact O-N 2.73Å; L292-R294 VanDerWaalsContact C-N 3.34Å; L292-R294 PolarHBondContact O-N 3.13Å; L292-H295 CarbonylContact O-C 3.45Å; L292-H295 WeakPolarHBondContact O-CA 3.15Å; L292-H295 WeakPolarHBondContact O-CB 3.37Å; L292-H295 PolarHBondContact O-N 2.86Å; L292-L296 HydrophobicContact CD1-CD1 4.25Å; L292-L296 HydrophobicContact CG-CD1 4.02Å; L292-L296 WeakPolarHBondContact O-CG 3.14Å; L292-L296 PolarHBondContact O-N 3.04Å
293	A	44.8	Very low	45.6	Very low	7 Å²	7	74.8 Å²	74.8	6%	0.058	39%	0.389	C	S	.	.	H	α-helix	trans	-64.5	-34.4	174.6	0	0	0	0	0	112.6	I289 H295 L296 L297 M298 V301 L302	I289-A293 WeakPolarHBondContact O-CB 3.49Å; I289-A293 PolarHBondContact O-N 3.41Å; A293-H295 VanDerWaalsContact C-N 3.32Å; A293-L296 PolarHBondContact O-N 2.81Å; A293-L297 PolarHBondContact O-N 3.3Å; A293-M298 HydrophobicContact CB-CB 4.46Å; A293-M298 PolarHBondContact O-N 2.9Å; A293-M298 VanDerWaalsContact O-N 3.07Å; A293-V301 HydrophobicContact CB-CB 4.12Å; A293-V301 HydrophobicContact CB-CG1 3.88Å; A293-L302 HydrophobicContact CB-CD2 3.69Å; A293-L302 HydrophobicContact CB-CG 3.93Å
294	R	45.8	Very low	46.3	Very low	131 Å²	131	72.6 Å²	72.6	49%	0.494	38%	0.381	S	S	.	.	H	α-helix	trans	-67.7	-28.2	169.4	-85.6	177.2	-93.2	105.8	-3.5	113.2	A290 N291 L292 L302	A290-R294 VanDerWaalsContact C-CZ 3.45Å; A290-R294 VanDerWaalsContact C-NH2 3.34Å; A290-R294 VanDerWaalsContact CB-NH2 3.25Å; A290-R294 VanDerWaalsContact O-CB 3.26Å; A290-R294 WeakPolarHBondContact O-CB 3.07Å; A290-R294 WeakPolarHBondContact O-CG 3.48Å; A290-R294 PolarHBondContact O-N 3.47Å; A290-R294 PolarHBondContact O-NE 3.43Å; A290-R294 VanDerWaalsContact O-NE 3.16Å; A290-R294 PolarHBondContact O-NH2 3.33Å; N291-R294 PolarHBondContact O-N 2.85Å; N291-R294 PolarHBondContact OD1-NH1 3.14Å; L292-R294 VanDerWaalsContact C-N 3.34Å; L292-R294 PolarHBondContact O-N 3.13Å; R294-L302 HydrophobicContact CB-CD1 4.4Å; R294-L302 HydrophobicContact CG-CD1 3.53Å; R294-L302 HydrophobicContact CG-CD2 3.72Å; R294-L302 HydrophobicContact CG-CG 4.28Å
295	H	38.6	Very low	47.1	Very low	159 Å²	159	69 Å²	69	74%	0.736	36%	0.357	S	S	*	.	H	α-helix	trans	-78.7	-36.2	172.6	-79	-60.8	0	0	0	113.1	N291 L292 A293	N291-H295 PolarHBondContact O-CD2 3.43Å; N291-H295 PolarHBondContact O-N 3.07Å; L292-H295 CarbonylContact O-C 3.45Å; L292-H295 WeakPolarHBondContact O-CA 3.15Å; L292-H295 WeakPolarHBondContact O-CB 3.37Å; L292-H295 PolarHBondContact O-N 2.86Å; A293-H295 VanDerWaalsContact C-N 3.32Å
296	L	42.6	Very low	47.8	Very low	58 Å²	58	72.6 Å²	72.6	30%	0.304	37%	0.37	S	S	.	.	H	α-helix	trans	-89.3	1.6	179.6	-63.4	175	0	0	0	114.2	L292 A293 M298	L292-L296 HydrophobicContact CD1-CD1 4.25Å; L292-L296 HydrophobicContact CG-CD1 4.02Å; L292-L296 WeakPolarHBondContact O-CG 3.14Å; L292-L296 PolarHBondContact O-N 3.04Å; A293-L296 PolarHBondContact O-N 2.81Å; L296-M298 VanDerWaalsContact C-N 3.29Å; L296-M298 HydrophobicContact CB-CG 4.08Å; L296-M298 PolarHBondContact O-N 2.73Å
297	L	38.6	Very low	48.4	Very low	143 Å²	143	74.2 Å²	74.2	75%	0.749	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.2	29.6	178.9	-58	175.5	0	0	0	114.9	A293 T299	A293-L297 PolarHBondContact O-N 3.3Å; L297-T299 PolarHBondContact O-N 2.91Å; L297-T299 VanDerWaalsContact O-N 3.15Å
298	M	42.2	Very low	49	Very low	39 Å²	39	73.5 Å²	73.5	19%	0.192	38%	0.375	C	S	.	.			trans	-84.4	90.1	-178.8	-58.9	-156.8	76	0	0	110.7	K264 L268 A293 L296 E300 V301 L302	K264-M298 HydrophobicContact CD-CE 4.22Å; K264-M298 HydrophobicContact CG-CE 3.8Å; L268-M298 HydrophobicContact CD1-CE 3.82Å; L268-M298 HydrophobicContact CD2-CE 3.66Å; L268-M298 HydrophobicContact CD2-SD 4.45Å; L268-M298 HydrophobicContact CG-CE 4Å; A293-M298 HydrophobicContact CB-CB 4.46Å; A293-M298 PolarHBondContact O-N 2.9Å; A293-M298 VanDerWaalsContact O-N 3.07Å; L296-M298 VanDerWaalsContact C-N 3.29Å; L296-M298 HydrophobicContact CB-CG 4.08Å; L296-M298 PolarHBondContact O-N 2.73Å; M298-E300 PolarHBondContact O-N 2.97Å; M298-V301 HydrophobicContact CB-CB 4.31Å; M298-V301 HydrophobicContact CB-CG2 4.1Å; M298-L302 WeakPolarHBondContact O-CG 3.47Å; M298-L302 PolarHBondContact O-N 2.88Å
299	T	52.4	Low	49.7	Very low	96 Å²	96	72.6 Å²	72.6	59%	0.589	37%	0.367	S	S	*	.	H	α-helix	trans	-64.5	-35.3	-173.5	43.6	0	0	0	0	113.8	L297 L302 Q303	L297-T299 PolarHBondContact O-N 2.91Å; L297-T299 VanDerWaalsContact O-N 3.15Å; T299-L302 PolarHBondContact O-N 3.14Å; T299-Q303 WeakPolarHBondContact O-CB 3.43Å; T299-Q303 PolarHBondContact O-N 2.9Å
300	E	50.3	Low	50.7	Low	117 Å²	117	76.1 Å²	76.1	55%	0.547	38%	0.381	S	S	.	.	H	α-helix	trans	-65.8	-48.1	-179.9	-72.1	147.1	-157.9	0	0	111.5	L268 M298 L302 Q303 I304	L268-E300 HydrophobicContact CD1-CB 4.48Å; L268-E300 WeakPolarHBondContact CD1-OE2 3.14Å; M298-E300 PolarHBondContact O-N 2.97Å; E300-L302 VanDerWaalsContact C-N 3.25Å; E300-L302 PolarHBondContact O-N 3.34Å; E300-Q303 WeakPolarHBondContact O-CB 3.36Å; E300-Q303 PolarHBondContact O-N 2.95Å; E300-I304 WeakPolarHBondContact O-CG1 3.45Å; E300-I304 PolarHBondContact O-N 3.48Å
301	V	48.9	Very low	51.1	Low	21 Å²	21	81.3 Å²	81.3	13%	0.127	40%	0.404	C	S	.	.	H	α-helix	trans	-57.3	-40.2	173.8	-178.2	0	0	0	0	111.4	L268 I289 A293 M298 Q303 I304 C305	L268-V301 HydrophobicContact CD2-CG2 3.33Å; I289-V301 HydrophobicContact CG2-CG1 4.48Å; A293-V301 HydrophobicContact CB-CB 4.12Å; A293-V301 HydrophobicContact CB-CG1 3.88Å; M298-V301 HydrophobicContact CB-CB 4.31Å; M298-V301 HydrophobicContact CB-CG2 4.1Å; V301-Q303 VanDerWaalsContact C-N 3.34Å; V301-I304 PolarHBondContact O-N 3.17Å; V301-C305 PolarHBondContact O-N 2.94Å; V301-C305 PolarHBondContact O-SG 3.07Å
302	L	55.2	Low	51.6	Low	38 Å²	38	79.8 Å²	79.8	20%	0.199	40%	0.396	C	S	.	.	H	α-helix	trans	-69.2	-33.8	177.4	-66	172.9	0	0	0	112.7	A290 A293 R294 M298 T299 E300 C305 E306	A290-L302 HydrophobicContact CB-CD2 4.22Å; A290-L302 WeakPolarHBondContact O-CD2 3.29Å; A293-L302 HydrophobicContact CB-CD2 3.69Å; A293-L302 HydrophobicContact CB-CG 3.93Å; R294-L302 HydrophobicContact CB-CD1 4.4Å; R294-L302 HydrophobicContact CG-CD1 3.53Å; R294-L302 HydrophobicContact CG-CD2 3.72Å; R294-L302 HydrophobicContact CG-CG 4.28Å; M298-L302 WeakPolarHBondContact O-CG 3.47Å; M298-L302 PolarHBondContact O-N 2.88Å; T299-L302 PolarHBondContact O-N 3.14Å; E300-L302 VanDerWaalsContact C-N 3.25Å; E300-L302 PolarHBondContact O-N 3.34Å; L302-C305 PolarHBondContact O-N 3.34Å; L302-E306 VanDerWaalsContact O-CB 3.22Å; L302-E306 WeakPolarHBondContact O-CB 3.32Å; L302-E306 PolarHBondContact O-N 2.95Å
303	Q	56.9	Low	52.5	Low	133 Å²	133	80.9 Å²	80.9	62%	0.621	40%	0.399	S	S	*	.	H	α-helix	trans	-71.7	-32.7	176.2	-162.6	167.5	-11	0	0	111.5	T299 E300 V301 S307	T299-Q303 WeakPolarHBondContact O-CB 3.43Å; T299-Q303 PolarHBondContact O-N 2.9Å; E300-Q303 WeakPolarHBondContact O-CB 3.36Å; E300-Q303 PolarHBondContact O-N 2.95Å; V301-Q303 VanDerWaalsContact C-N 3.34Å; Q303-S307 WeakPolarHBondContact O-CB 3.3Å; Q303-S307 PolarHBondContact O-N 3.39Å; Q303-S307 PolarHBondContact O-OG 3.03Å
304	I	55.4	Low	52.9	Low	58 Å²	58	84.9 Å²	84.9	30%	0.297	42%	0.416	S	S	.	.	H	α-helix	trans	-67.6	-49.6	168.6	-67	160.6	0	0	0	110.4	D272 E300 V301 E306 S307 V308	D272-I304 WeakPolarHBondContact OD1-CG2 3.03Å; E300-I304 WeakPolarHBondContact O-CG1 3.45Å; E300-I304 PolarHBondContact O-N 3.48Å; V301-I304 PolarHBondContact O-N 3.17Å; I304-E306 PolarHBondContact O-N 3.15Å; I304-S307 WeakPolarHBondContact CA-OG 3.34Å; I304-S307 PolarHBondContact O-N 3.34Å; I304-S307 PolarHBondContact O-OG 3.4Å; I304-V308 HydrophobicContact CG2-CG2 4.35Å; I304-V308 WeakPolarHBondContact O-CB 3.27Å; I304-V308 VanDerWaalsContact O-CG2 3.28Å; I304-V308 WeakPolarHBondContact O-CG2 3.27Å; I304-V308 PolarHBondContact O-N 3.49Å
305	C	57.1	Low	53.1	Low	12 Å²	12	84.8 Å²	84.8	8%	0.081	42%	0.421	C	S	.	.	H	α-helix	trans	-58.2	-37.4	174.8	-67.1	0	0	0	0	112.1	M286 A290 V301 L302 H309	M286-C305 HydrophobicContact CE-CB 4.2Å; A290-C305 HydrophobicContact CB-CB 4.46Å; V301-C305 PolarHBondContact O-N 2.94Å; V301-C305 PolarHBondContact O-SG 3.07Å; L302-C305 PolarHBondContact O-N 3.34Å; C305-H309 VanDerWaalsContact O-CB 3.32Å; C305-H309 WeakPolarHBondContact O-CB 3.47Å; C305-H309 PolarHBondContact O-CD2 2.86Å; C305-H309 PolarHBondContact O-N 2.91Å
306	E	64.4	Low	53.7	Low	142 Å²	142	82.3 Å²	82.3	66%	0.664	41%	0.409	S	S	*	.	H	α-helix	trans	-71.9	-39.8	177.1	-171.2	169.7	-163.7	0	0	111.9	L302 I304 K310	L302-E306 VanDerWaalsContact O-CB 3.22Å; L302-E306 WeakPolarHBondContact O-CB 3.32Å; L302-E306 PolarHBondContact O-N 2.95Å; I304-E306 PolarHBondContact O-N 3.15Å; E306-K310 WeakPolarHBondContact O-CB 3.42Å; E306-K310 PolarHBondContact O-N 3.28Å
307	S	58.3	Low	53.7	Low	59 Å²	59	84.3 Å²	84.3	41%	0.413	42%	0.419	S	S	.	.	H	α-helix	trans	-68.3	-37.4	173.8	62.5	0	0	0	0	112.7	Q303 I304 K310 Q311	Q303-S307 WeakPolarHBondContact O-CB 3.3Å; Q303-S307 PolarHBondContact O-N 3.39Å; Q303-S307 PolarHBondContact O-OG 3.03Å; I304-S307 WeakPolarHBondContact CA-OG 3.34Å; I304-S307 PolarHBondContact O-N 3.34Å; I304-S307 PolarHBondContact O-OG 3.4Å; S307-K310 PolarHBondContact O-N 3.32Å; S307-Q311 WeakPolarHBondContact O-CG 3.28Å; S307-Q311 PolarHBondContact O-N 3.26Å
308	V	56.1	Low	53.9	Low	27 Å²	27	81.1 Å²	81.1	16%	0.164	41%	0.406	C	S	.	.	H	α-helix	trans	-67.8	-45.5	174.9	167	0	0	0	0	111	F281 M286 I304 K310 Q311 V312	F281-V308 HydrophobicContact CE1-CG1 3.88Å; F281-V308 HydrophobicContact CZ-CG1 3.53Å; M286-V308 HydrophobicContact CE-CB 4.26Å; M286-V308 HydrophobicContact CE-CG1 3.78Å; I304-V308 HydrophobicContact CG2-CG2 4.35Å; I304-V308 WeakPolarHBondContact O-CB 3.27Å; I304-V308 VanDerWaalsContact O-CG2 3.28Å; I304-V308 WeakPolarHBondContact O-CG2 3.27Å; I304-V308 PolarHBondContact O-N 3.49Å; V308-K310 VanDerWaalsContact C-N 3.29Å; V308-K310 PolarHBondContact O-N 3.48Å; V308-Q311 PolarHBondContact O-N 3.24Å; V308-V312 WeakPolarHBondContact O-CG2 3.36Å; V308-V312 PolarHBondContact O-N 2.92Å
309	H	57.6	Low	53.9	Low	82 Å²	82	84.1 Å²	84.1	38%	0.38	43%	0.426	S	S	.	.	H	α-helix	trans	-57.9	-43.8	171.4	-98	-103.3	0	0	0	111.4	C305 V312 E313	C305-H309 VanDerWaalsContact O-CB 3.32Å; C305-H309 WeakPolarHBondContact O-CB 3.47Å; C305-H309 PolarHBondContact O-CD2 2.86Å; C305-H309 PolarHBondContact O-N 2.91Å; H309-V312 PolarHBondContact O-N 2.85Å; H309-E313 WeakPolarHBondContact O-CB 3.35Å; H309-E313 WeakPolarHBondContact O-CG 3.38Å; H309-E313 PolarHBondContact O-N 3.08Å
310	K	65.8	Low	53.4	Low	110 Å²	110	88.2 Å²	88.2	48%	0.478	43%	0.432	S	S	.	.	H	α-helix	trans	-64.2	-40.4	177.6	-176.7	177.8	172.1	-68.2	0	112.3	E306 S307 V308 E313 E314	E306-K310 WeakPolarHBondContact O-CB 3.42Å; E306-K310 PolarHBondContact O-N 3.28Å; S307-K310 PolarHBondContact O-N 3.32Å; V308-K310 VanDerWaalsContact C-N 3.29Å; V308-K310 PolarHBondContact O-N 3.48Å; K310-E313 PolarHBondContact O-N 3.34Å; K310-E314 WeakPolarHBondContact CE-OE1 3.37Å; K310-E314 HydrophobicContact CG-CG 4.46Å; K310-E314 IonicContact NZ-OE1 3.22Å; K310-E314 PolarHBondContact NZ-OE1 2.81Å; K310-E314 IonicContact NZ-OE2 3.93Å; K310-E314 PolarHBondContact NZ-OE2 2.82Å; K310-E314 WeakPolarHBondContact O-CB 3.46Å; K310-E314 VanDerWaalsContact O-CG 3.28Å; K310-E314 WeakPolarHBondContact O-CG 3.46Å; K310-E314 PolarHBondContact O-N 3.37Å
311	Q	54.7	Low	52.7	Low	120 Å²	120	90.2 Å²	90.2	56%	0.561	44%	0.441	S	S	*	.	H	α-helix	trans	-64.3	-39.9	172.7	-81.1	-177.4	-25	0	0	112.2	S307 V308 E314 Q315	S307-Q311 WeakPolarHBondContact O-CG 3.28Å; S307-Q311 PolarHBondContact O-N 3.26Å; V308-Q311 PolarHBondContact O-N 3.24Å; Q311-E314 PolarHBondContact O-N 3.03Å; Q311-Q315 WeakPolarHBondContact O-CB 3.36Å; Q311-Q315 VanDerWaalsContact O-CG 3.28Å; Q311-Q315 WeakPolarHBondContact O-CG 3.49Å; Q311-Q315 PolarHBondContact O-N 3.07Å
312	V	56.4	Low	52.1	Low	27 Å²	27	98 Å²	98	16%	0.164	47%	0.473	C	S	.	.	H	α-helix	trans	-68.6	-35	175.5	171.5	0	0	0	0	111.8	F281 F283 V308 H309 K316	F281-V312 HydrophobicContact CE1-CG2 4.35Å; F283-V312 HydrophobicContact CE1-CG1 4.19Å; F283-V312 HydrophobicContact CZ-CG1 4.2Å; V308-V312 WeakPolarHBondContact O-CG2 3.36Å; V308-V312 PolarHBondContact O-N 2.92Å; H309-V312 PolarHBondContact O-N 2.85Å; V312-K316 HydrophobicContact CG1-CD 4.32Å; V312-K316 WeakPolarHBondContact O-CB 3.33Å; V312-K316 VanDerWaalsContact O-CG 3.27Å; V312-K316 WeakPolarHBondContact O-CG 3.48Å; V312-K316 PolarHBondContact O-N 2.94Å
313	E	59.9	Low	51.5	Low	120 Å²	120	98.8 Å²	98.8	56%	0.561	49%	0.491	S	S	*	.	H	α-helix	trans	-70	-41.6	172.1	-75.6	-177.1	174.6	0	0	111.9	H309 K310 K316 L317	H309-E313 WeakPolarHBondContact O-CB 3.35Å; H309-E313 WeakPolarHBondContact O-CG 3.38Å; H309-E313 PolarHBondContact O-N 3.08Å; K310-E313 PolarHBondContact O-N 3.34Å; E313-K316 PolarHBondContact O-N 2.9Å; E313-L317 WeakPolarHBondContact O-CB 3.33Å; E313-L317 WeakPolarHBondContact O-CD1 3.32Å; E313-L317 WeakPolarHBondContact O-CG 3.26Å; E313-L317 PolarHBondContact O-N 2.82Å
314	E	54.3	Low	50.2	Low	91 Å²	91	99.5 Å²	99.5	43%	0.425	50%	0.499	S	S	.	.	H	α-helix	trans	-65.8	-40.4	175.2	-74.8	173.2	150.7	0	0	111.5	K310 Q311 L317 T318	K310-E314 WeakPolarHBondContact CE-OE1 3.37Å; K310-E314 HydrophobicContact CG-CG 4.46Å; K310-E314 IonicContact NZ-OE1 3.22Å; K310-E314 PolarHBondContact NZ-OE1 2.81Å; K310-E314 IonicContact NZ-OE2 3.93Å; K310-E314 PolarHBondContact NZ-OE2 2.82Å; K310-E314 WeakPolarHBondContact O-CB 3.46Å; K310-E314 VanDerWaalsContact O-CG 3.28Å; K310-E314 WeakPolarHBondContact O-CG 3.46Å; K310-E314 PolarHBondContact O-N 3.37Å; Q311-E314 PolarHBondContact O-N 3.03Å; E314-L317 PolarHBondContact O-N 3.2Å; E314-T318 WeakPolarHBondContact O-CG2 3.33Å; E314-T318 PolarHBondContact O-N 3.39Å; E314-T318 PolarHBondContact O-OG1 3.39Å
315	Q	49.8	Very low	48.9	Very low	128 Å²	128	103.2 Å²	103.2	60%	0.598	52%	0.524	S	S	*	.	H	α-helix	trans	-62.1	-48.2	170.9	-76.4	177.2	-2.1	0	0	111.5	Q311 L317 T318 V319	Q311-Q315 WeakPolarHBondContact O-CB 3.36Å; Q311-Q315 VanDerWaalsContact O-CG 3.28Å; Q311-Q315 WeakPolarHBondContact O-CG 3.49Å; Q311-Q315 PolarHBondContact O-N 3.07Å; Q315-L317 VanDerWaalsContact C-N 3.32Å; Q315-L317 PolarHBondContact O-N 3.26Å; Q315-T318 PolarHBondContact O-N 2.98Å; Q315-T318 PolarHBondContact O-OG1 2.61Å; Q315-V319 WeakPolarHBondContact O-CG2 3.47Å; Q315-V319 PolarHBondContact O-N 3.5Å
316	K	51.6	Low	47.6	Very low	108 Å²	108	110.3 Å²	110.3	47%	0.47	56%	0.555	S	S	.	*	H	α-helix	trans	-59.2	-41.2	174.7	-77.6	174.8	179.8	179.9	0	112.2	V312 E313 V319 Y320	V312-K316 HydrophobicContact CG1-CD 4.32Å; V312-K316 WeakPolarHBondContact O-CB 3.33Å; V312-K316 VanDerWaalsContact O-CG 3.27Å; V312-K316 WeakPolarHBondContact O-CG 3.48Å; V312-K316 PolarHBondContact O-N 2.94Å; E313-K316 PolarHBondContact O-N 2.9Å; K316-V319 PolarHBondContact O-N 3.18Å; K316-Y320 VanDerWaalsContact O-CD2 3.24Å; K316-Y320 WeakPolarHBondContact O-CD2 3.42Å; K316-Y320 PolarHBondContact O-N 3.05Å
317	L	42	Very low	45.9	Very low	100 Å²	100	109.6 Å²	109.6	52%	0.524	56%	0.561	S	S	.	*	H	α-helix	trans	-64.1	-39.7	176	-75.4	164.3	0	0	0	111.9	E313 E314 Q315 Y320 Q321	E313-L317 WeakPolarHBondContact O-CB 3.33Å; E313-L317 WeakPolarHBondContact O-CD1 3.32Å; E313-L317 WeakPolarHBondContact O-CG 3.26Å; E313-L317 PolarHBondContact O-N 2.82Å; E314-L317 PolarHBondContact O-N 3.2Å; Q315-L317 VanDerWaalsContact C-N 3.32Å; Q315-L317 PolarHBondContact O-N 3.26Å; L317-Y320 PolarHBondContact O-N 2.94Å; L317-Q321 WeakPolarHBondContact O-CB 3.43Å; L317-Q321 VanDerWaalsContact O-CG 3.31Å; L317-Q321 WeakPolarHBondContact O-CG 3.43Å; L317-Q321 PolarHBondContact O-N 3.22Å
318	T	43.4	Very low	44.3	Very low	76 Å²	76	112.1 Å²	112.1	47%	0.466	57%	0.573	S	S	.	*	H	α-helix	trans	-70.7	-27.6	173.9	59.1	0	0	0	0	113.7	E314 Q315 K322	E314-T318 WeakPolarHBondContact O-CG2 3.33Å; E314-T318 PolarHBondContact O-N 3.39Å; E314-T318 PolarHBondContact O-OG1 3.39Å; Q315-T318 PolarHBondContact O-N 2.98Å; Q315-T318 PolarHBondContact O-OG1 2.61Å; T318-K322 WeakPolarHBondContact O-CG 3.35Å; T318-K322 PolarHBondContact O-N 2.98Å
319	V	40.9	Very low	43	Very low	101 Å²	101	117.4 Å²	117.4	61%	0.612	61%	0.606	S	S	*	*	H	α-helix	trans	-68.9	-47.5	170	169.7	0	0	0	0	110.4	Q315 K316 Q321 K322 G323	Q315-V319 WeakPolarHBondContact O-CG2 3.47Å; Q315-V319 PolarHBondContact O-N 3.5Å; K316-V319 PolarHBondContact O-N 3.18Å; V319-Q321 PolarHBondContact O-N 3.43Å; V319-K322 PolarHBondContact O-N 3.25Å; V319-K322 VanDerWaalsContact O-N 3.16Å; V319-G323 PolarHBondContact O-N 2.81Å
320	Y	41.5	Very low	41.5	Very low	182 Å²	182	117.7 Å²	117.7	71%	0.714	62%	0.622	S	S	*	*	H	α-helix	trans	-64.4	-36.2	175.3	-81.1	-68.3	0	0	0	112.9	K316 L317 K322 G323	K316-Y320 VanDerWaalsContact O-CD2 3.24Å; K316-Y320 WeakPolarHBondContact O-CD2 3.42Å; K316-Y320 PolarHBondContact O-N 3.05Å; L317-Y320 PolarHBondContact O-N 2.94Å; Y320-K322 PolarHBondContact O-N 2.75Å; Y320-G323 PolarHBondContact O-N 2.92Å
321	Q	37	Very low	39.7	Very low	159 Å²	159	116 Å²	116	74%	0.743	64%	0.636	S	S	*	*	H	α-helix	trans	-69.9	-17	174.5	-76.3	178.6	-4.8	0	0	114.1	L317 V319	L317-Q321 WeakPolarHBondContact O-CB 3.43Å; L317-Q321 VanDerWaalsContact O-CG 3.31Å; L317-Q321 WeakPolarHBondContact O-CG 3.43Å; L317-Q321 PolarHBondContact O-N 3.22Å; V319-Q321 PolarHBondContact O-N 3.43Å
322	K	36.6	Very low	38.3	Very low	185 Å²	185	117.2 Å²	117.2	80%	0.804	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	-1.1	167.8	-74.9	-178.8	174.5	-179.1	0	113	T318 V319 Y320	T318-K322 WeakPolarHBondContact O-CG 3.35Å; T318-K322 PolarHBondContact O-N 2.98Å; V319-K322 PolarHBondContact O-N 3.25Å; V319-K322 VanDerWaalsContact O-N 3.16Å; Y320-K322 PolarHBondContact O-N 2.75Å
323	G	41.2	Very low	36.9	Very low	55 Å²	55	123.9 Å²	123.9	57%	0.567	69%	0.685	S	S	*	*	S	Bend	trans	-93	-8.1	-168	0	0	0	0	0	116.3	V319 Y320	V319-G323 PolarHBondContact O-N 2.81Å; Y320-G323 PolarHBondContact O-N 2.92Å
324	D	29.7	Very low	35.3	Very low	147 Å²	147	122.5 Å²	122.5	79%	0.786	69%	0.694	S	S	*	*			trans	-130.1	119.2	-177.5	-92.1	-52	0	0	0	112.2
325	V	28.7	Very low	34	Very low	136 Å²	136	125.5 Å²	125.5	82%	0.824	72%	0.719	S	S	*	*			trans	-133.6	121.6	157	178.1	0	0	0	0	108.6
326	H	30	Very low	32.8	Very low	161 Å²	161	126.8 Å²	126.8	75%	0.745	73%	0.73	S	S	*	*			trans	-20.1	156.5	161.4	-53.3	-78.5	0	0	0	117.6
327	T	27.7	Very low	31.5	Very low	128 Å²	128	128.3 Å²	128.3	79%	0.785	74%	0.743	S	S	*	*			cis	-175.9	161.5	44.5	7.6	0	0	0	0	108.9
328	V	26.4	Very low	30.7	Very low	111 Å²	111	127.8 Å²	127.8	67%	0.673	75%	0.748	S	S	*	*			cis	-175	140.2	-33.5	101.7	0	0	0	0	110.5
329	V	27.6	Very low	29.8	Very low	139 Å²	139	133.1 Å²	133.1	84%	0.842	77%	0.765	S	S	*	*			trans	67.3	150.9	156.5	171.8	0	0	0	0	117.4
330	A	26.9	Very low	29	Very low	88 Å²	88	134.4 Å²	134.4	73%	0.727	77%	0.772	S	S	*	*			cis	-134.5	176.3	0.6	0	0	0	0	0	110.4
331	G	28.1	Very low	28.3	Very low	74 Å²	74	133.5 Å²	133.5	76%	0.763	77%	0.774	S	S	*	*			cis	115	68	-5.5	0	0	0	0	0	116.3
332	V	25.6	Very low	28.3	Very low	146 Å²	146	130.7 Å²	130.7	89%	0.885	77%	0.77	S	S	*	*			trans	-135.7	157.7	168.7	-177.6	0	0	0	0	110.4
333	L	26.6	Very low	27.7	Very low	167 Å²	167	126.6 Å²	126.6	87%	0.874	76%	0.757	S	S	*	*			trans	-104.8	162.5	-170	-74.4	162.6	0	0	0	114.5
334	A	26.3	Very low	27	Very low	91 Å²	91	127.7 Å²	127.7	75%	0.752	76%	0.761	S	S	*	*			trans	-29.7	155	170.6	0	0	0	0	0	120.4
335	T	25.4	Very low	26.9	Very low	154 Å²	154	125.9 Å²	125.9	95%	0.945	74%	0.744	S	S	*	*				-142.9	171.9	127.7	14.2	0	0	0	0	111.1
336	D	25.6	Very low	26.8	Very low	155 Å²	155	127.3 Å²	127.3	83%	0.829	74%	0.744	S	S	*	*			trans	-105.4	177.5	-168.5	-152.4	-13.8	0	0	0	112.7
337	D	24.4	Very low	26.9	Very low	139 Å²	139	123.3 Å²	123.3	74%	0.743	73%	0.73	S	S	*	*			trans	70.7	-176.9	162.2	-131.5	-40.2	0	0	0	118.6
338	S	24.8	Very low	27.4	Very low	89 Å²	89	122.1 Å²	122.1	62%	0.622	72%	0.723	S	S	*	*			trans	-139.6	162.4	-133.4	63.8	0	0	0	0	117.9
339	K	23.9	Very low	27.7	Very low	189 Å²	189	121.1 Å²	121.1	82%	0.822	71%	0.713	S	S	*	*			trans	83.2	115.1	162.3	-72.5	-177.1	173.1	-179.9	0	121.2
340	V	24.7	Very low	28.1	Very low	127 Å²	127	120.7 Å²	120.7	77%	0.77	71%	0.706	S	S	*	*			trans	81	101.5	132.9	-179.7	0	0	0	0	118.8
341	E	26.7	Very low	28.9	Very low	163 Å²	163	124.7 Å²	124.7	76%	0.762	72%	0.715	S	S	*	*				40.9	154.5	115.3	-65.7	-66.3	125.4	0	0	121.5
342	P	36.9	Very low	29.8	Very low	100 Å²	100	129.6 Å²	129.6	65%	0.649	72%	0.724	S	S	*	*			cis	-142	-177.8	17.6	42.6	-23.6	0	0	0	119.3
343	D	23.8	Very low	31	Very low	99 Å²	99	125.4 Å²	125.4	53%	0.529	71%	0.71	S	S	.	*			trans	81.5	143.2	147.3	-79	-17	0	0	0	123.4	H359	D343-H359 PolarHBondContact O-CE1 2.97Å
344	A	28.2	Very low	31.2	Very low	79 Å²	79	121.5 Å²	121.5	65%	0.653	70%	0.697	S	S	*	*			trans	-149.1	156.6	-172.2	0	0	0	0	0	114.6
345	Y	27.6	Very low	31.5	Very low	108 Å²	108	122 Å²	122	42%	0.424	69%	0.69	S	S	.	*			trans	-139.3	146.6	171.5	-65.8	-130.2	0	0	0	113.9	H359 G360 A361 C362	Y345-H359 PolarHBondContact O-N 2.97Å; Y345-G360 VanDerWaalsContact CG-N 3.25Å; Y345-G360 VanDerWaalsContact CZ-C 3.48Å; Y345-A361 VanDerWaalsContact CE2-CA 3.49Å; Y345-A361 VanDerWaalsContact OH-C 3.27Å; Y345-A361 VanDerWaalsContact OH-CA 3.3Å; Y345-A361 WeakPolarHBondContact OH-CA 3.38Å; Y345-A361 PolarHBondContact OH-N 3.08Å; Y345-C362 PolarHBondContact OH-N 3.05Å
346	M	26.2	Very low	31.7	Very low	167 Å²	167	119.9 Å²	119.9	82%	0.823	68%	0.677	S	S	*	*			trans	-86.3	172.2	175.2	-55.4	-175.6	-65.3	0	0	113.9
347	V	31.7	Very low	32.1	Very low	76 Å²	76	117 Å²	117	46%	0.461	67%	0.665	S	S	.	*			trans	-133.9	143.8	148.6	165.2	0	0	0	0	108.6	V357	V347-V357 WeakPolarHBondContact CG2-O 3.36Å
348	T	37.6	Very low	32.3	Very low	103 Å²	103	114.8 Å²	114.8	63%	0.632	66%	0.657	S	S	*	*			trans	-106.8	163.4	179.9	48.6	0	0	0	0	111.7
349	I	32.3	Very low	32.2	Very low	90 Å²	90	116.5 Å²	116.5	46%	0.462	66%	0.655	S	S	.	*			trans	-136.4	143.9	162.8	-36.5	102.1	0	0	0	109.2	S354 T355	I349-S354 VanDerWaalsContact CG2-O 3.25Å; I349-S354 WeakPolarHBondContact CG2-O 3.42Å; I349-T355 WeakPolarHBondContact CG1-O 3.33Å
350	D	36.4	Very low	32.2	Very low	131 Å²	131	109.3 Å²	109.3	70%	0.701	63%	0.634	S	S	*	*			trans	-90	-176.4	178.9	-47.5	-54.7	0	0	0	112.6	D352 G353	D350-D352 VanDerWaalsContact C-N 3.34Å; D350-D352 PolarHBondContact O-N 2.94Å; D350-G353 PolarHBondContact O-N 2.89Å
351	D	44.8	Very low	32.2	Very low	172 Å²	172	106.9 Å²	106.9	92%	0.92	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-7	-146.5	-67.5	-56.5	0	0	0	119.5
352	D	45.9	Very low	32	Very low	177 Å²	177	103.2 Å²	103.2	95%	0.947	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-5.9	171.9	-78.1	-42.6	0	0	0	113.6	D350	D350-D352 VanDerWaalsContact C-N 3.34Å; D350-D352 PolarHBondContact O-N 2.94Å
353	G	51.8	Low	31.3	Very low	58 Å²	58	105.1 Å²	105.1	60%	0.598	62%	0.622	S	S	*	*			trans	76.1	72.3	153.2	0	0	0	0	0	120.1	D350	D350-G353 PolarHBondContact O-N 2.89Å
354	S	29.4	Very low	31.4	Very low	85 Å²	85	109.3 Å²	109.3	59%	0.594	64%	0.639	S	S	*	*			trans	-171.5	148.1	145.4	52.5	0	0	0	0	116.1	I349	I349-S354 VanDerWaalsContact CG2-O 3.25Å; I349-S354 WeakPolarHBondContact CG2-O 3.42Å
355	T	32.2	Very low	31.2	Very low	100 Å²	100	114.2 Å²	114.2	61%	0.613	65%	0.648	S	S	*	*			trans	89.4	103.5	163.6	68.2	0	0	0	0	123.8	I349	I349-T355 WeakPolarHBondContact CG1-O 3.33Å
356	V	29.7	Very low	31.3	Very low	111 Å²	111	114.2 Å²	114.2	67%	0.673	66%	0.661	S	S	*	*				56.5	134.6	97.7	160.7	0	0	0	0	118.2
357	V	35.5	Very low	31.2	Very low	93 Å²	93	112.5 Å²	112.5	56%	0.564	66%	0.66	S	S	*	*			cis	-172.4	148.4	1.7	105.8	0	0	0	0	115.3	V347	V347-V357 WeakPolarHBondContact CG2-O 3.36Å
358	T	27.1	Very low	30.9	Very low	94 Å²	94	115.3 Å²	115.3	58%	0.577	68%	0.678	S	S	*	*			trans	49.9	139.2	154.7	68.4	0	0	0	0	128.1
359	H	24.6	Very low	30.3	Very low	124 Å²	124	117.3 Å²	117.3	57%	0.574	69%	0.689	S	S	*	*			trans	73	115.3	136.8	-116.9	-83.2	0	0	0	127.3	D343 Y345	D343-H359 PolarHBondContact O-CE1 2.97Å; Y345-H359 PolarHBondContact O-N 2.97Å
360	G	23.3	Very low	29.8	Very low	38 Å²	38	120.5 Å²	120.5	39%	0.392	71%	0.706	S	S	.	*			trans	109.9	147	136.2	0	0	0	0	0	118.4	Y345	Y345-G360 VanDerWaalsContact CG-N 3.25Å; Y345-G360 VanDerWaalsContact CZ-C 3.48Å
361	A	23.7	Very low	29.2	Very low	77 Å²	77	120.4 Å²	120.4	64%	0.636	71%	0.711	S	S	*	*			cis	-163.5	125.3	-17.1	0	0	0	0	0	113.2	Y345	Y345-A361 VanDerWaalsContact CE2-CA 3.49Å; Y345-A361 VanDerWaalsContact OH-C 3.27Å; Y345-A361 VanDerWaalsContact OH-CA 3.3Å; Y345-A361 WeakPolarHBondContact OH-CA 3.38Å; Y345-A361 PolarHBondContact OH-N 3.08Å
362	C	23.1	Very low	28.3	Very low	86 Å²	86	120.8 Å²	120.8	58%	0.581	71%	0.707	S	S	*	*			trans	63.9	158.7	165	-137.5	0	0	0	0	116	Y345	Y345-C362 PolarHBondContact OH-N 3.05Å
363	I	23.3	Very low	27.3	Very low	140 Å²	140	116.2 Å²	116.2	72%	0.718	69%	0.693	S	S	*	*			cis	-157.5	163	40.2	-76.3	178.3	0	0	0	111.4
364	Q	25.7	Very low	25.9	Very low	186 Å²	186	120.1 Å²	120.1	87%	0.869	71%	0.705	S	S	*	*			trans	102.4	157.6	156.8	-99.8	160.3	53.1	0	0	121
365	Q	23.1	Very low	25.6	Very low	183 Å²	183	120.8 Å²	120.8	86%	0.855	72%	0.716	S	S	*	*			trans	-109.9	-177	-159	-52.9	-179.7	-36.8	0	0	111.9
366	P	29.2	Very low	25.1	Very low	107 Å²	107	119.6 Å²	119.6	70%	0.695	72%	0.723	S	S	*	*			cis	-137.7	-162.7	3.8	34.7	-10.2	0	0	0	115.7
367	V	24.4	Very low	24.7	Very low	131 Å²	131	122.4 Å²	122.4	79%	0.794	74%	0.735	S	S	*	*			trans	77.6	119.4	169.1	-175.3	0	0	0	0	114.9
368	T	26.7	Very low	24.1	Very low	136 Å²	136	122.3 Å²	122.3	83%	0.834	74%	0.744	S	S	*	*			cis	-141.7	159.9	-2	-7.6	0	0	0	0	110.2
369	V	24.2	Very low	23.9	Very low	145 Å²	145	123.7 Å²	123.7	88%	0.879	75%	0.752	S	S	*	*			trans	-109.6	147.2	-162.9	174.3	0	0	0	0	114.4
370	L	22.8	Very low	23.8	Very low	157 Å²	157	126.4 Å²	126.4	82%	0.822	77%	0.765	S	S	*	*			trans	-71.1	142.6	175.1	-79.6	157.6	0	0	0	114.8
371	T	23.6	Very low	24	Very low	129 Å²	129	129.8 Å²	129.8	79%	0.791	79%	0.789	S	S	*	*			trans	-107	139.9	143.3	48.5	0	0	0	0	107.6
372	H	24.9	Very low	24.1	Very low	180 Å²	180	129.1 Å²	129.1	83%	0.833	79%	0.79	S	S	*	*			cis	91	138.9	19.4	-145.5	-69.2	0	0	0	115.5
373	A	24.6	Very low	24.3	Very low	81 Å²	81	134.4 Å²	134.4	67%	0.669	81%	0.806	S	S	*	*			trans	70.2	130.9	-175.7	0	0	0	0	0	115.7
374	V	22.7	Very low	24.5	Very low	139 Å²	139	133.2 Å²	133.2	84%	0.842	81%	0.81	S	S	*	*			cis	81.1	106	41.8	179.8	0	0	0	0	113.9
375	A	23.1	Very low	24.5	Very low	100 Å²	100	132.6 Å²	132.6	83%	0.826	81%	0.807	S	S	*	*			trans	26.4	132.3	149.9	0	0	0	0	0	122.5
376	G	22.1	Very low	24.6	Very low	74 Å²	74	130.4 Å²	130.4	76%	0.763	81%	0.807	S	S	*	*				112.7	116.8	125.7	0	0	0	0	0	118.4
377	D	21.2	Very low	24.4	Very low	170 Å²	170	130.9 Å²	130.9	91%	0.909	81%	0.807	S	S	*	*			trans	45.2	101.3	150	-67.7	-11.3	0	0	0	120.9
378	A	22.8	Very low	24.4	Very low	92 Å²	92	128.5 Å²	128.5	76%	0.76	80%	0.801	S	S	*	*				124.2	152.9	104.5	0	0	0	0	0	119.6
379	V	22.5	Very low	24.2	Very low	123 Å²	123	130.4 Å²	130.4	75%	0.745	81%	0.805	S	S	*	*			trans	84.2	102	162	-168	0	0	0	0	119.4
380	E	23.9	Very low	24.3	Very low	181 Å²	181	130.5 Å²	130.5	85%	0.846	80%	0.799	S	S	*	*			trans	55.6	136.9	138.5	-60.6	-177.7	145.7	0	0	125.3
381	A	25.6	Very low	24.3	Very low	108 Å²	108	127.7 Å²	127.7	89%	0.893	80%	0.799	S	S	*	*			trans	57.9	141.3	147.8	0	0	0	0	0	121.4
382	G	26.1	Very low	24.5	Very low	64 Å²	64	130.8 Å²	130.8	66%	0.66	80%	0.804	S	S	*	*			cis	164.8	162.9	-6.4	0	0	0	0	0	112.8
383	Q	29.1	Very low	24.5	Very low	196 Å²	196	126 Å²	126	92%	0.916	80%	0.804	S	S	*	*			trans	65.5	146.6	175.8	-53.9	177.4	-15.5	0	0	114.7
384	S	25.9	Very low	24.4	Very low	116 Å²	116	125.7 Å²	125.7	81%	0.811	81%	0.808	S	S	*	*			cis	-141.7	164.9	19.2	-59.8	0	0	0	0	113
385	E	26.9	Very low	24.5	Very low	172 Å²	172	128.6 Å²	128.6	80%	0.804	81%	0.813	S	S	*	*			trans	-93.4	160.1	173.9	-61.8	177.4	114	0	0	113.2	V387	E385-V387 HydrophobicContact CB-CG2 4.46Å
386	T	25.1	Very low	24.6	Very low	138 Å²	138	127.6 Å²	127.6	85%	0.847	81%	0.812	S	S	*	*			trans	-171.7	118.7	147.2	8.3	0	0	0	0	106.5
387	V	24.5	Very low	24.8	Very low	117 Å²	117	132 Å²	132	71%	0.709	81%	0.813	S	S	*	*			cis	61.7	119.8	37.9	-168.7	0	0	0	0	111.1	E385	E385-V387 HydrophobicContact CB-CG2 4.46Å
388	A	24.5	Very low	25.3	Very low	81 Å²	81	132.2 Å²	132.2	67%	0.669	81%	0.808	S	S	*	*			cis	-163.8	-178.6	-18.1	0	0	0	0	0	107
389	L	23.3	Very low	25.6	Very low	175 Å²	175	131.2 Å²	131.2	92%	0.916	81%	0.806	S	S	*	*			trans	-154.2	144.8	146.9	-114.1	172	0	0	0	111.8
390	I	25.3	Very low	25.9	Very low	147 Å²	147	132.7 Å²	132.7	75%	0.754	81%	0.81	S	S	*	*			trans	-128.5	138.6	-178.2	-61.5	165.7	0	0	0	107.2
391	A	23.4	Very low	26	Very low	99 Å²	99	129.8 Å²	129.8	82%	0.818	81%	0.805	S	S	*	*			trans	-153.3	135.6	161.4	0	0	0	0	0	111.5
392	H	28.2	Very low	25.9	Very low	193 Å²	193	132.3 Å²	132.3	89%	0.894	80%	0.803	S	S	*	*			trans	-124.1	160.4	166.7	-91.9	-92.8	0	0	0	108.5
393	G	23.1	Very low	25.8	Very low	81 Å²	81	135.4 Å²	135.4	84%	0.835	81%	0.809	S	S	*	*			trans	112.1	146	172.1	0	0	0	0	0	113.4
394	G	23.8	Very low	25.6	Very low	73 Å²	73	133.5 Å²	133.5	75%	0.753	80%	0.804	S	S	*	*			cis	-157.7	-176.4	2	0	0	0	0	0	112.6
395	E	25.1	Very low	25.5	Very low	201 Å²	201	136.1 Å²	136.1	94%	0.939	81%	0.807	S	S	*	*			trans	-83.2	165.5	-167.4	-58.2	118.1	129.3	0	0	116
396	G	25.2	Very low	25.4	Very low	78 Å²	78	133.9 Å²	133.9	80%	0.804	81%	0.811	S	S	*	*			trans	174	87.9	175.1	0	0	0	0	0	114.2
397	E	26.4	Very low	25.3	Very low	168 Å²	168	130.3 Å²	130.3	79%	0.785	80%	0.801	S	S	*	*			trans	-57.3	156.1	-179.8	-52	166.6	135.1	0	0	113.6
398	H	31.7	Very low	25.5	Very low	173 Å²	173	131.7 Å²	131.7	80%	0.801	81%	0.814	S	S	*	*				-163.5	153	56.4	-101.2	74.8	0	0	0	112.8
399	G	27.7	Very low	25.4	Very low	71 Å²	71	131.8 Å²	131.8	73%	0.732	82%	0.823	S	S	*	*			trans	84.7	127.4	161.4	0	0	0	0	0	116.2
400	D	28.6	Very low	25.7	Very low	155 Å²	155	133.3 Å²	133.3	83%	0.829	83%	0.825	S	S	*	*			cis	-151.2	146.1	0.3	-128.2	-26.9	0	0	0	112.6
401	T	26.8	Very low	25.9	Very low	119 Å²	119	129.8 Å²	129.8	73%	0.73	83%	0.825	S	S	*	*			trans	38.6	102.5	159.2	-51.9	0	0	0	0	120.7
402	L	23.3	Very low	26.2	Very low	162 Å²	162	133 Å²	133	85%	0.848	83%	0.828	S	S	*	*			trans	179.6	117.2	135.1	-105.7	169.3	0	0	0	113.3
403	T	24.5	Very low	26.1	Very low	128 Å²	128	132.9 Å²	132.9	79%	0.785	83%	0.828	S	S	*	*			trans	177.4	149.2	132.7	21.1	0	0	0	0	114
404	L	24.3	Very low	26.3	Very low	157 Å²	157	132.4 Å²	132.4	82%	0.822	82%	0.823	S	S	*	*			trans	43.4	129.3	145.1	-64.9	164.4	0	0	0	121.8
405	I	23.3	Very low	26.4	Very low	171 Å²	171	138 Å²	138	88%	0.877	83%	0.829	S	S	*	*				-165.3	138.2	116.4	-95.7	150.4	0	0	0	108.6
406	S	24.9	Very low	26.4	Very low	125 Å²	125	135.9 Å²	135.9	87%	0.874	83%	0.83	S	S	*	*			trans	-164.6	145.4	140.6	-166.9	0	0	0	0	110.4
407	G	24.3	Very low	26.3	Very low	62 Å²	62	140 Å²	140	64%	0.639	83%	0.83	S	S	*	*			trans	-165.4	155.7	174.7	0	0	0	0	0	111.1
408	C	27.2	Very low	26.2	Very low	147 Å²	147	137.7 Å²	137.7	99%	0.993	83%	0.828	S	S	*	*			trans	40.7	119.8	168.3	-64.5	0	0	0	0	119.7
409	G	24.1	Very low	25.8	Very low	82 Å²	82	135 Å²	135	85%	0.845	82%	0.823	S	S	*	*			trans	-179.8	133.9	160.3	0	0	0	0	0	113
410	E	28.9	Very low	25.6	Very low	207 Å²	207	136.5 Å²	136.5	97%	0.967	82%	0.818	S	S	*	*			trans	-107.7	160.7	171.7	-59.3	174	113.6	0	0	109.6
411	G	29.1	Very low	25.6	Very low	73 Å²	73	135 Å²	135	75%	0.753	82%	0.815	S	S	*	*			trans	128.1	100	154.4	0	0	0	0	0	118.9
412	L	29.2	Very low	25.7	Very low	167 Å²	167	136.6 Å²	136.6	87%	0.874	81%	0.814	S	S	*	*			trans	5.6	140.5	138.8	-50	171.5	0	0	0	120.8
413	E	27.4	Very low	26	Very low	191 Å²	191	134.6 Å²	134.6	89%	0.893	81%	0.813	S	S	*	*				164.1	162.5	108.1	-87	-166.8	175.4	0	0	114
414	G	25.7	Very low	26.1	Very low	71 Å²	71	131.6 Å²	131.6	73%	0.732	81%	0.808	S	S	*	*			trans	74.4	94.3	164.5	0	0	0	0	0	117.5
415	E	26.5	Very low	26.6	Very low	189 Å²	189	133.8 Å²	133.8	88%	0.883	81%	0.814	S	S	*	*				57.4	115	74	-66.9	-154.2	145.1	0	0	117.7
416	T	24.4	Very low	27	Very low	157 Å²	157	130.2 Å²	130.2	96%	0.963	81%	0.81	S	S	*	*			trans	-156.7	158.2	135.4	-3.6	0	0	0	0	110.4
417	M	24.1	Very low	27.1	Very low	164 Å²	164	128 Å²	128	81%	0.808	81%	0.807	S	S	*	*			trans	-123.6	-178	-160.5	-124.1	-172.6	72.9	0	0	113.5
418	T	23.7	Very low	27.4	Very low	121 Å²	121	129.9 Å²	129.9	74%	0.742	82%	0.817	S	S	*	*			trans	86.1	147.1	163.4	76.6	0	0	0	0	117.7
419	V	23.3	Very low	27.6	Very low	116 Å²	116	127 Å²	127	70%	0.703	80%	0.798	S	S	*	*			cis	-158.6	123.3	-14.6	127.4	0	0	0	0	105.4
420	V	24.7	Very low	28	Very low	102 Å²	102	131.6 Å²	131.6	62%	0.618	80%	0.798	S	S	*	*				64.7	105.6	78	178.8	0	0	0	0	115.6	H422	V420-H422 VanDerWaalsContact CG1-CE1 3.42Å; V420-H422 WeakPolarHBondContact CG1-CE1 3.15Å
421	T	28.8	Very low	28	Very low	123 Å²	123	127.3 Å²	127.3	76%	0.755	79%	0.791	S	S	*	*			trans	-166.1	122	135.8	44.6	0	0	0	0	108.6
422	H	29.1	Very low	27.9	Very low	153 Å²	153	132 Å²	132	71%	0.708	80%	0.797	S	S	*	*				65	139.9	82.5	-43.2	-24.7	0	0	0	113.3	V420	V420-H422 VanDerWaalsContact CG1-CE1 3.42Å; V420-H422 WeakPolarHBondContact CG1-CE1 3.15Å
423	S	29.3	Very low	27.9	Very low	120 Å²	120	127.8 Å²	127.8	84%	0.839	79%	0.787	S	S	*	*			cis	-178.8	155.3	-6.4	43.7	0	0	0	0	108.4
424	G	27	Very low	27.8	Very low	66 Å²	66	125.4 Å²	125.4	68%	0.68	79%	0.785	S	S	*	*			cis	161.2	171.3	-4.8	0	0	0	0	0	112.5
425	Q	33.6	Very low	27.8	Very low	202 Å²	202	127.7 Å²	127.7	94%	0.944	78%	0.784	S	S	*	*			trans	64.9	146.8	158.6	-70.3	175.8	-61	0	0	119.8
426	A	31.6	Very low	28	Very low	97 Å²	97	124.7 Å²	124.7	80%	0.802	78%	0.784	S	S	*	*			cis	-146.1	155.6	-7.8	0	0	0	0	0	108.1
427	G	26.9	Very low	28.3	Very low	79 Å²	79	121.3 Å²	121.3	81%	0.814	77%	0.772	S	S	*	*				108.7	146.8	62.7	0	0	0	0	0	108.7
428	A	31.6	Very low	28.4	Very low	101 Å²	101	120 Å²	120	84%	0.835	78%	0.778	S	S	*	*			cis	-149	-161.9	4.9	0	0	0	0	0	107.9
429	S	31.7	Very low	28.6	Very low	86 Å²	86	122.8 Å²	122.8	60%	0.601	79%	0.787	S	S	*	*			cis	-159.9	151	9.1	49.7	0	0	0	0	112.6
430	E	31	Very low	28.8	Very low	179 Å²	179	122.2 Å²	122.2	84%	0.836	80%	0.795	S	S	*	*			trans	63.7	150.5	141.3	-72.5	153	-134	0	0	120.6
431	S	29.4	Very low	29.1	Very low	117 Å²	117	125.9 Å²	125.9	82%	0.818	81%	0.807	S	S	*	*			cis	-133.4	150.1	25.3	-54.4	0	0	0	0	114.1
432	L	27.8	Very low	29	Very low	170 Å²	170	129.6 Å²	129.6	89%	0.89	82%	0.816	S	S	*	*			trans	-115.3	166.2	175.7	-121.5	175.2	0	0	0	112.3
433	A	29.5	Very low	28.9	Very low	80 Å²	80	130.8 Å²	130.8	66%	0.661	82%	0.822	S	S	*	*			trans	-39.1	168.5	-175.9	0	0	0	0	0	120.3
434	V	24.5	Very low	29.8	Very low	141 Å²	141	129.7 Å²	129.7	86%	0.855	81%	0.812	S	S	*	*			trans	-122.5	100.9	141.2	-179.8	0	0	0	0	110.4
435	V	24.6	Very low	29.6	Very low	118 Å²	118	135 Å²	135	72%	0.715	82%	0.819	S	S	*	*			trans	47.3	117.1	144.2	-172.4	0	0	0	0	120.2	A437	V435-A437 HydrophobicContact CG1-CB 4.36Å
436	S	31.3	Very low	29.2	Very low	126 Å²	126	131.4 Å²	131.4	88%	0.881	81%	0.811	S	S	*	*			trans	-102.2	145.2	140.4	-74.6	0	0	0	0	109.4
437	A	30.5	Very low	29	Very low	86 Å²	86	133.8 Å²	133.8	71%	0.711	82%	0.815	S	S	*	*			trans	-159.7	118.8	162.3	0	0	0	0	0	112.5	V435	V435-A437 HydrophobicContact CG1-CB 4.36Å
438	C	26.5	Very low	28.9	Very low	137 Å²	137	138.7 Å²	138.7	93%	0.926	82%	0.816	S	S	*	*				-176.4	148.1	125	-92.8	0	0	0	0	110.4
439	L	28.8	Very low	28.6	Very low	179 Å²	179	138.3 Å²	138.3	94%	0.937	81%	0.814	S	S	*	*			trans	-108.9	153.7	-178.2	-69.6	158.1	0	0	0	110.6
440	A	27.8	Very low	28.2	Very low	104 Å²	104	139.5 Å²	139.5	86%	0.86	82%	0.822	S	S	*	*			trans	-161.9	149.2	145.9	0	0	0	0	0	109.9
441	M	30.9	Very low	28	Very low	180 Å²	180	135 Å²	135	89%	0.887	82%	0.816	S	S	*	*			trans	-117.1	157.3	169.4	-63.5	174.8	63.5	0	0	108.6
442	E	25.5	Very low	27.7	Very low	200 Å²	200	139.1 Å²	139.1	94%	0.935	82%	0.819	S	S	*	*			trans	-169.9	163.8	142.8	-110.6	161.4	-159.2	0	0	113.7
443	Q	27.4	Very low	27.5	Very low	179 Å²	179	136.5 Å²	136.5	84%	0.836	81%	0.81	S	S	*	*			trans	-161.3	175.3	-174.6	-113.9	-166.5	37.2	0	0	106.9
444	P	47.3	Very low	27.3	Very low	97 Å²	97	140.8 Å²	140.8	63%	0.63	82%	0.821	S	S	*	*			cis	-135.1	-161.6	-21.3	39.1	-19.9	0	0	0	112.4
445	Q	24.4	Very low	27.3	Very low	177 Å²	177	140.5 Å²	140.5	83%	0.827	81%	0.814	S	S	*	*			trans	135.7	127	156.5	-75.9	177.2	10.6	0	0	110.6
446	V	25.4	Very low	27.3	Very low	127 Å²	127	141.4 Å²	141.4	77%	0.77	82%	0.82	S	S	*	*			cis	87.2	106.1	31.2	-179.8	0	0	0	0	114.6
447	V	25.3	Very low	27.1	Very low	146 Å²	146	142.7 Å²	142.7	89%	0.885	82%	0.817	S	S	*	*			trans	-156.2	160.8	133.8	-170.1	0	0	0	0	108
448	E	26.5	Very low	26.8	Very low	182 Å²	182	142.5 Å²	142.5	85%	0.85	82%	0.815	S	S	*	*			trans	-110.6	-164.5	-166.1	-50.9	171.1	98.8	0	0	115.7
449	A	24.6	Very low	26.7	Very low	94 Å²	94	141.8 Å²	141.8	78%	0.777	80%	0.802	S	S	*	*			trans	88.9	150.3	159	0	0	0	0	0	119.8
450	S	24.2	Very low	26.6	Very low	111 Å²	111	140.7 Å²	140.7	78%	0.776	79%	0.79	S	S	*	*			cis	174.8	166.7	-48.1	51.1	0	0	0	0	110.3
451	A	25.1	Very low	26.4	Very low	85 Å²	85	144.7 Å²	144.7	70%	0.702	79%	0.791	S	S	*	*			trans	73	127.7	174.7	0	0	0	0	0	116
452	F	24.5	Very low	26	Very low	203 Å²	203	140.3 Å²	140.3	89%	0.89	78%	0.783	S	S	*	*				74.2	143.4	55.7	-64.1	-42.7	0	0	0	112.7
453	V	23.4	Very low	26.4	Very low	115 Å²	115	136.2 Å²	136.2	70%	0.697	77%	0.773	S	S	*	*			cis	-159.4	157.2	-5	115.8	0	0	0	0	107.9
454	L	24.7	Very low	26.2	Very low	169 Å²	169	132 Å²	132	89%	0.885	76%	0.764	S	S	*	*			trans	-169.8	141	130.6	-104.3	173.6	0	0	0	112.5
455	D	23.9	Very low	25.1	Very low	135 Å²	135	135.4 Å²	135.4	72%	0.722	77%	0.772	S	S	*	*			trans	-102.3	169.2	-176.3	-158.2	-21.3	0	0	0	110.2
456	V	25.7	Very low	25	Very low	138 Å²	138	135.2 Å²	135.2	84%	0.836	77%	0.77	S	S	*	*			trans	167.9	113.9	135.4	158.9	0	0	0	0	107.2
457	D	25.8	Very low	25	Very low	153 Å²	153	134.2 Å²	134.2	82%	0.818	77%	0.765	S	S	*	*			trans	-117.3	178.7	168.8	-155.3	-16.1	0	0	0	109.9
458	A	25.5	Very low	25	Very low	82 Å²	82	133.6 Å²	133.6	68%	0.678	76%	0.761	S	S	*	*			trans	71.3	136	-175.8	0	0	0	0	0	114.5
459	D	24.6	Very low	24.8	Very low	122 Å²	122	132.6 Å²	132.6	65%	0.652	76%	0.761	S	S	*	*				-162	163.5	67.4	-145.7	-22.7	0	0	0	115.4
460	K	25.9	Very low	24.8	Very low	155 Å²	155	137 Å²	137	67%	0.674	77%	0.765	S	S	*	*			trans	62.7	95.3	157.2	-78.3	151.6	-174.5	70.1	0	122.2
461	H	22.9	Very low	25	Very low	189 Å²	189	136.3 Å²	136.3	88%	0.875	76%	0.76	S	S	*	*				49.4	138.3	109.3	-76.3	-88.2	0	0	0	123.3
462	A	22.6	Very low	25.2	Very low	88 Å²	88	141.2 Å²	141.2	73%	0.727	77%	0.768	S	S	*	*			trans	-87.4	-160.8	160.6	0	0	0	0	0	110.4
463	P	34.3	Very low	25.2	Very low	113 Å²	113	136.3 Å²	136.3	73%	0.734	77%	0.765	S	S	*	*			cis	-141.4	-167.6	9.8	38.8	-14.4	0	0	0	116.6
464	S	23.6	Very low	25.3	Very low	91 Å²	91	135.8 Å²	135.8	64%	0.636	77%	0.773	S	S	*	*			trans	58.1	173.9	160	-11.8	0	0	0	0	119.6
465	E	24.5	Very low	25.4	Very low	169 Å²	169	132.2 Å²	132.2	79%	0.79	77%	0.768	S	S	*	*			cis	-166.5	157.7	-2.9	-115.7	141.3	-118.3	0	0	105.4
466	E	23	Very low	26.3	Very low	172 Å²	172	130.9 Å²	130.9	80%	0.804	77%	0.767	S	S	*	*			cis	-163.1	-169.8	-23.7	-138.7	-160.6	170.5	0	0	110.7
467	V	24.1	Very low	26.5	Very low	107 Å²	107	130.3 Å²	130.3	65%	0.648	76%	0.764	S	S	*	*			trans	24.1	136	157.4	-173.6	0	0	0	0	122.3
468	V	24.7	Very low	26.8	Very low	133 Å²	133	132.6 Å²	132.6	81%	0.806	77%	0.77	S	S	*	*				176.3	136.2	121.1	157.3	0	0	0	0	113.5
469	L	23.9	Very low	27.2	Very low	161 Å²	161	133 Å²	133	84%	0.843	77%	0.772	S	S	*	*			trans	-39.8	169.1	176.8	-60.4	162.1	0	0	0	121.7
470	E	24.3	Very low	27.4	Very low	187 Å²	187	136.9 Å²	136.9	87%	0.874	79%	0.787	S	S	*	*			trans	-65.9	180	155.9	-53.5	-176.5	130.6	0	0	111.1
471	S	28.9	Very low	27.4	Very low	96 Å²	96	139.1 Å²	139.1	67%	0.671	80%	0.796	S	S	*	*			cis	-167.8	173.4	34	63.9	0	0	0	0	115.6
472	E	27.5	Very low	27.5	Very low	187 Å²	187	138.7 Å²	138.7	87%	0.874	79%	0.792	S	S	*	*			trans	32.1	145	145.2	-67.4	-170.5	132.7	0	0	124.7
473	A	25.1	Very low	27.7	Very low	100 Å²	100	141.6 Å²	141.6	83%	0.826	79%	0.791	S	S	*	*				-163.9	125.4	121.5	0	0	0	0	0	113.2
474	A	25.1	Very low	27.2	Very low	105 Å²	105	141.5 Å²	141.5	87%	0.868	79%	0.788	S	S	*	*			trans	145.8	126.3	133.3	0	0	0	0	0	115.1
475	A	27.6	Very low	27.3	Very low	93 Å²	93	144.7 Å²	144.7	77%	0.769	80%	0.797	S	S	*	*			trans	-97.8	-170.2	170.2	0	0	0	0	0	109.8
476	P	42.6	Very low	27.9	Very low	107 Å²	107	141.7 Å²	141.7	70%	0.695	79%	0.792	S	S	*	*			cis	-146.3	170.9	11.3	43.8	-23.1	0	0	0	119.7
477	T	30.8	Very low	28.3	Very low	126 Å²	126	139.9 Å²	139.9	77%	0.773	79%	0.793	S	S	*	*			trans	57.5	133.3	143.8	49.6	0	0	0	0	125.2
478	E	31.6	Very low	28.8	Very low	202 Å²	202	140.7 Å²	140.7	94%	0.944	80%	0.8	S	S	*	*			trans	78.1	162.7	150.2	-68	-155.2	143.5	0	0	121.6
479	A	34.1	Very low	28.9	Very low	89 Å²	89	141.6 Å²	141.6	74%	0.736	80%	0.796	S	S	*	*			trans	-127	163	-143.4	0	0	0	0	0	115.3
480	Q	27.6	Very low	28.9	Very low	204 Å²	204	142 Å²	142	95%	0.953	79%	0.79	S	S	*	*			trans	-174.7	172	130.5	-103.2	175.2	51.7	0	0	114.5
481	K	25.7	Very low	29	Very low	202 Å²	202	143.8 Å²	143.8	88%	0.878	79%	0.789	S	S	*	*			trans	-94.8	153.9	-175.3	-64.6	174	175	174.6	0	113.2
482	K	25	Very low	28.7	Very low	180 Å²	180	147.9 Å²	147.9	78%	0.783	80%	0.795	S	S	*	*				-175.2	133.5	118	-104.9	-179.8	173.8	-178.5	0	116.8
483	E	28.1	Very low	28.6	Very low	150 Å²	150	150.9 Å²	150.9	70%	0.701	80%	0.798	S	S	*	*				26.7	143.2	122.5	-58.1	-178.5	122.1	0	0	120.7
484	T	24.1	Very low	28.4	Very low	110 Å²	110	150.1 Å²	150.1	68%	0.675	80%	0.801	S	S	*	*			cis	-170.6	147.6	0.1	17.8	0	0	0	0	112.7
485	L	25.3	Very low	28.5	Very low	159 Å²	159	156.7 Å²	156.7	83%	0.832	80%	0.803	S	S	*	*			trans	62.8	169.2	148.2	-64.4	170.1	0	0	0	119.9
486	P	37	Very low	29.4	Very low	106 Å²	106	157.3 Å²	157.3	69%	0.688	80%	0.799	S	S	*	*			cis	-135.2	160.8	-42.8	36.7	-20.7	0	0	0	116.6
487	V	31.2	Very low	29.2	Very low	133 Å²	133	157.5 Å²	157.5	81%	0.806	80%	0.8	S	S	*	*			trans	32.1	122.2	147	-173.6	0	0	0	0	121.7
488	P	35.4	Very low	29	Very low	124 Å²	124	160.4 Å²	160.4	81%	0.805	80%	0.802	S	S	*	*			trans	-101.9	164	170.6	38.5	-34	0	0	0	116.2
489	Q	26.9	Very low	28.6	Very low	153 Å²	153	156.3 Å²	156.3	72%	0.715	79%	0.791	S	S	*	*			trans	-130.3	158.2	164.4	-76.5	-166.9	4.3	0	0	112.1
490	K	23.8	Very low	28.2	Very low	168 Å²	168	162.1 Å²	162.1	73%	0.73	80%	0.8	S	S	*	*			trans	68.7	110.1	152	-70.9	151.8	176.7	152.9	0	120.7
491	R	25.8	Very low	28.1	Very low	225 Å²	225	162.5 Å²	162.5	85%	0.849	79%	0.792	S	S	*	*				69.8	133.9	119.9	-80.1	-179.7	156.4	-172.5	-5.3	122.8
492	K	22.9	Very low	28	Very low	182 Å²	182	160 Å²	160	79%	0.791	78%	0.784	S	S	*	*			trans	102.5	121.8	143.1	-74.9	169.3	176.4	-177.4	0	120.2
493	R	24.7	Very low	28.1	Very low	250 Å²	250	155.3 Å²	155.3	94%	0.943	78%	0.778	S	S	*	*			trans	41.9	130	132.6	-62.5	-177.5	168.5	-152.4	-2.3	121.5
494	G	22.3	Very low	28	Very low	85 Å²	85	156.7 Å²	156.7	88%	0.876	79%	0.785	S	S	*	*			trans	173.7	145.8	153.8	0	0	0	0	0	116.7
495	R	26.4	Very low	28	Very low	242 Å²	242	158.1 Å²	158.1	91%	0.913	79%	0.793	S	S	*	*			trans	-157.9	170.9	175.1	-159.9	-153	-175.8	-152.8	2.9	106.3
496	P	46.2	Very low	28.1	Very low	106 Å²	106	159.6 Å²	159.6	69%	0.688	80%	0.796	S	S	*	*			cis	-100.3	-136.6	-29.6	45.1	-31.3	0	0	0	108.6
497	P	38.4	Very low	27.4	Very low	112 Å²	112	158.2 Å²	158.2	73%	0.727	80%	0.801	S	S	*	*			cis	-109.1	-153.2	-23.3	27.1	-2	0	0	0	110.6
498	K	25.9	Very low	27	Very low	187 Å²	187	163.3 Å²	163.3	81%	0.813	81%	0.806	S	S	*	*			cis	-129.3	170.2	3.6	-92	-168.9	175.1	-178.2	0	108.9
499	V	25.1	Very low	26.8	Very low	116 Å²	116	163.7 Å²	163.7	70%	0.703	80%	0.8	S	S	*	*			cis	90.2	113.5	28.7	-178	0	0	0	0	116.4
500	K	23.8	Very low	27.7	Very low	211 Å²	211	161.8 Å²	161.8	92%	0.917	80%	0.8	S	S	*	*			trans	-133.3	162.8	136.1	-99.1	-166.8	174.6	-172.1	0	109.6
501	R	26.9	Very low	28.9	Very low	212 Å²	212	159 Å²	159	80%	0.8	80%	0.8	S	S	*	*			trans	-140.3	171.2	-174.3	-128.9	-178	179.4	-172.8	-2.9	105.3
502	E	23.6	Very low	29.1	Very low	150 Å²	150	157 Å²	157	70%	0.701	80%	0.8	S	S	*	*			cis	-143.3	156.6	31	-102.9	107.4	-142.7	0	0	108.9
503	A	27.5	Very low	29.2	Very low	81 Å²	81	157.7 Å²	157.7	67%	0.669	81%	0.806	S	S	*	*				62.8	147.7	89	0	0	0	0	0	114.5
504	E	25.4	Very low	29.4	Very low	179 Å²	179	153.1 Å²	153.1	84%	0.836	80%	0.801	S	S	*	*			cis	-162.8	166	14.2	-149.6	146.9	-114.1	0	0	111.3
505	V	24.6	Very low	30.4	Very low	140 Å²	140	155.1 Å²	155.1	85%	0.848	80%	0.798	S	S	*	*			trans	179.4	152.9	145.7	143.2	0	0	0	0	110.4
506	E	25.8	Very low	30.6	Very low	189 Å²	189	147.5 Å²	147.5	88%	0.883	79%	0.787	S	S	*	*			trans	-92.6	179.7	-154.8	-53	159.3	108.7	0	0	116.4
507	G	23.5	Very low	29.9	Very low	78 Å²	78	151.3 Å²	151.3	80%	0.804	80%	0.795	S	S	*	*			trans	138.2	115.7	153.2	0	0	0	0	0	115.8
508	W	21.8	Very low	29.5	Very low	239 Å²	239	154.1 Å²	154.1	91%	0.905	80%	0.799	S	S	*	*			trans	-149.5	166.3	-179.2	-155.5	22.7	0	0	0	114.1
509	I	31.2	Very low	29.6	Very low	133 Å²	133	152.7 Å²	152.7	68%	0.682	80%	0.795	S	S	*	*			trans	-24.5	136.6	172.7	-73.4	173.7	0	0	0	116.5
510	P	45.7	Very low	29.7	Very low	112 Å²	112	155.1 Å²	155.1	73%	0.727	80%	0.798	S	S	*	*				-151.8	-167.6	97.4	42.1	-23.2	0	0	0	113.8
511	P	49	Very low	29.7	Very low	111 Å²	111	149.3 Å²	149.3	72%	0.721	79%	0.79	S	S	*	*			cis	-111.3	-150.4	-8.8	23.3	2.6	0	0	0	110.8
512	E	29.6	Very low	29.8	Very low	183 Å²	183	145.6 Å²	145.6	86%	0.855	79%	0.786	S	S	*	*			cis	-139.7	-173.7	12.1	-65.3	173.2	132.2	0	0	111.2
513	E	25.7	Very low	30.1	Very low	196 Å²	196	145.7 Å²	145.7	92%	0.916	78%	0.784	S	S	*	*			trans	-133.1	-178.3	-154.9	-53.5	-174.7	108.7	0	0	115.6
514	D	28.2	Very low	30.1	Very low	154 Å²	154	148.7 Å²	148.7	82%	0.824	78%	0.784	S	S	*	*			trans	-74.6	-167.3	-179.2	-64.8	-71.6	0	0	0	114.5
515	P	44.9	Very low	30.1	Very low	126 Å²	126	148.1 Å²	148.1	82%	0.818	78%	0.781	S	S	*	*				-152	124.1	90.8	36.3	-15.7	0	0	0	118.9
516	A	29.9	Very low	30.2	Very low	83 Å²	83	146.3 Å²	146.3	69%	0.686	78%	0.781	S	S	*	*				67.4	147.2	120.2	0	0	0	0	0	125.7
517	E	31.5	Very low	30.1	Very low	185 Å²	185	143.6 Å²	143.6	86%	0.864	78%	0.777	S	S	*	*			trans	70.4	140.8	159.6	-52.4	-173.7	-174.5	0	0	120.5
518	E	30.5	Very low	30.9	Very low	171 Å²	171	144.6 Å²	144.6	80%	0.799	77%	0.77	S	S	*	*			cis	-161.8	169	-23.8	-99	-125.3	131.4	0	0	110.9
519	E	27.1	Very low	31.1	Very low	158 Å²	158	140.3 Å²	140.3	74%	0.738	77%	0.765	S	S	*	*			trans	55.1	130.7	164	-65.6	-145.3	130.3	0	0	126
520	H	26.5	Very low	30.9	Very low	166 Å²	166	140.9 Å²	140.9	77%	0.769	77%	0.769	S	S	*	*			trans	47.4	116.2	138.5	-77.5	-70.8	0	0	0	127
521	A	25	Very low	30.1	Very low	89 Å²	89	142 Å²	142	74%	0.736	77%	0.768	S	S	*	*				86.7	112.5	116.5	0	0	0	0	0	125.7
522	D	29.4	Very low	29	Very low	134 Å²	134	142.7 Å²	142.7	72%	0.717	78%	0.776	S	S	*	*				93.5	145.6	122.3	-148.7	19.2	0	0	0	124.8
523	K	30.1	Very low	28.9	Very low	153 Å²	153	137.8 Å²	137.8	67%	0.665	77%	0.774	S	S	*	*			trans	72.3	127.1	158.4	-82.4	178.7	-170.9	77.4	0	127.5
524	Q	27.1	Very low	29.2	Very low	143 Å²	143	139.4 Å²	139.4	67%	0.668	77%	0.772	S	S	*	*				99.7	114.6	126.1	-83.4	177.5	-64.6	0	0	125.9
525	E	25.8	Very low	29.3	Very low	168 Å²	168	143.3 Å²	143.3	79%	0.785	78%	0.775	S	S	*	*				77.9	154.9	129.1	-79.6	174	-133.8	0	0	126.1
526	A	25.9	Very low	28.6	Very low	101 Å²	101	144.7 Å²	144.7	84%	0.835	78%	0.775	S	S	*	*			trans	86.2	152.5	163.8	0	0	0	0	0	122.2
527	T	23.2	Very low	28.8	Very low	132 Å²	132	151 Å²	151	81%	0.81	78%	0.781	S	S	*	*			trans	-124.9	-176	176.8	57.6	0	0	0	0	108.6
528	P	40.4	Very low	28.5	Very low	100 Å²	100	150.1 Å²	150.1	65%	0.649	78%	0.777	S	S	*	*			cis	-142.4	-165.7	6	45.3	-24.8	0	0	0	117
529	D	26.3	Very low	28.4	Very low	148 Å²	148	152.8 Å²	152.8	79%	0.791	78%	0.78	S	S	*	*			trans	74	112.4	145	-63.6	-20	0	0	0	126.4
530	D	27.6	Very low	28.6	Very low	146 Å²	146	155.4 Å²	155.4	78%	0.781	78%	0.784	S	S	*	*				89.5	154.5	122.3	-143.9	14.8	0	0	0	125.2
531	L	28.3	Very low	28.7	Very low	134 Å²	134	155.8 Å²	155.8	70%	0.702	79%	0.789	S	S	*	*			trans	66.7	100.5	163.1	-57.8	-174.1	0	0	0	123.8
532	S	25.5	Very low	29.1	Very low	126 Å²	126	155.4 Å²	155.4	88%	0.881	79%	0.785	S	S	*	*				70.4	142.9	129.3	79.9	0	0	0	0	122.2
533	G	28.9	Very low	29.2	Very low	80 Å²	80	158.4 Å²	158.4	83%	0.825	80%	0.795	S	S	*	*			trans	168.9	161	170	0	0	0	0	0	115.8
534	R	30.8	Very low	29.1	Very low	230 Å²	230	154.9 Å²	154.9	87%	0.868	80%	0.802	S	S	*	*			trans	-121.2	151.5	174.1	-74.3	-168.7	179.2	-154.1	6.7	112.1
535	R	29.8	Very low	29	Very low	236 Å²	236	151.7 Å²	151.7	89%	0.891	81%	0.807	S	S	*	*			trans	71.7	125.7	170.8	-42.9	179.4	-169.2	-134.7	4.6	112.6
536	L	31.2	Very low	29	Very low	156 Å²	156	155 Å²	155	82%	0.817	81%	0.814	S	S	*	*				-177.2	162	66.3	-173	62.8	0	0	0	111.1
537	R	32.9	Very low	29.4	Very low	215 Å²	215	154.4 Å²	154.4	81%	0.811	81%	0.809	S	S	*	*			trans	26	108.6	163.3	-73.3	178.2	175.6	-173.3	-1	122
538	Q	26.8	Very low	29.6	Very low	167 Å²	167	160 Å²	160	78%	0.78	82%	0.815	S	S	*	*				36.8	109.9	126.1	-59.7	-179.7	-13.5	0	0	121.4
539	R	28.2	Very low	29.2	Very low	226 Å²	226	162.4 Å²	162.4	85%	0.853	82%	0.822	S	S	*	*				170.5	143.9	104.9	-89.8	174.1	-166.6	-168.6	5.1	114.1
540	Y	30	Very low	29.2	Very low	214 Å²	214	162.6 Å²	162.6	84%	0.839	82%	0.818	S	S	*	*			trans	20.3	141.8	153	-78.3	-99	0	0	0	125.3
541	M	29.5	Very low	29.2	Very low	174 Å²	174	164 Å²	164	86%	0.857	82%	0.822	S	S	*	*			trans	-0.4	155.1	144.1	-45.6	-64.7	-170.1	0	0	119.7
542	A	33.4	Very low	29	Very low	80 Å²	80	161.2 Å²	161.2	66%	0.661	83%	0.826	S	S	*	*			cis	-163.5	-179.9	30.2	0	0	0	0	0	115.2
543	E	32.1	Very low	29.3	Very low	198 Å²	198	162.2 Å²	162.2	93%	0.925	82%	0.82	S	S	*	*			trans	68.5	147.6	159.7	-66.3	169.7	-165.9	0	0	118.3
544	G	27.4	Very low	29.2	Very low	79 Å²	79	165.6 Å²	165.6	81%	0.814	81%	0.814	S	S	*	*			cis	-147.5	-167.6	-4.3	0	0	0	0	0	111.1
545	G	25.7	Very low	29	Very low	75 Å²	75	162.7 Å²	162.7	77%	0.773	81%	0.811	S	S	*	*			cis	-171.8	-164	4.9	0	0	0	0	0	114.2
546	Y	26.1	Very low	29	Very low	239 Å²	239	159.7 Å²	159.7	94%	0.937	81%	0.807	S	S	*	*			trans	-85.5	174.3	-176.1	-67.5	-104.6	0	0	0	112.4
547	A	32.9	Very low	29	Very low	88 Å²	88	160.4 Å²	160.4	73%	0.727	81%	0.806	S	S	*	*			cis	-176.9	155.8	-33.7	0	0	0	0	0	108
548	R	28.1	Very low	28.9	Very low	249 Å²	249	155.6 Å²	155.6	94%	0.94	79%	0.793	S	S	*	*			trans	-150.7	179.4	165.4	-127.8	169.3	179.9	159.3	-0.3	113.3
549	L	31.4	Very low	29	Very low	151 Å²	151	151.4 Å²	151.4	79%	0.791	79%	0.787	S	S	*	*			trans	-131	174	-142.5	-70	166	0	0	0	115.5
550	H	27	Very low	29	Very low	152 Å²	152	148.4 Å²	148.4	70%	0.704	78%	0.78	S	S	*	*			trans	96.1	116	156.2	-79.9	-83.9	0	0	0	121.4
551	M	27.1	Very low	28.8	Very low	175 Å²	175	143 Å²	143	86%	0.862	77%	0.774	S	S	*	*				40.4	147.3	123.6	-69.4	177.8	57.9	0	0	122.7
552	G	25.1	Very low	28.7	Very low	76 Å²	76	141 Å²	141	78%	0.784	77%	0.771	S	S	*	*			trans	174.1	142.1	151.6	0	0	0	0	0	113.5
553	L	31.3	Very low	28.4	Very low	146 Å²	146	143.2 Å²	143.2	76%	0.764	78%	0.776	S	S	*	*			trans	-106	172.5	172.5	-76.2	155.3	0	0	0	110.3
554	E	26.7	Very low	29.1	Very low	151 Å²	151	139.5 Å²	139.5	71%	0.706	77%	0.769	S	S	*	*			trans	63.3	160.3	151.4	-73.9	134.9	-139.9	0	0	118.1
555	E	26.2	Very low	30.7	Very low	170 Å²	170	140.8 Å²	140.8	79%	0.794	76%	0.763	S	S	*	*			cis	-156	166.6	-36.5	-120.3	172	-173.9	0	0	110.4
556	E	29.6	Very low	31.6	Very low	172 Å²	172	143.2 Å²	143.2	80%	0.804	77%	0.766	S	S	*	*			trans	30.4	134	162.4	-54.1	-161.5	135.6	0	0	126
557	E	31.3	Very low	31.7	Very low	172 Å²	172	136.1 Å²	136.1	80%	0.804	76%	0.756	S	S	*	*			trans	54.8	159.4	154.5	-70.4	-73.7	65.7	0	0	121.2
558	E	30.7	Very low	31.6	Very low	113 Å²	113	138.3 Å²	138.3	53%	0.528	76%	0.761	S	S	.	*			cis	-127.7	-161.7	-6.5	-144.1	-140.1	135.1	0	0	107.9	K560	E558-K560 VanDerWaalsContact OE1-CG 3.29Å; E558-K560 WeakPolarHBondContact OE1-CG 3.38Å; E558-K560 IonicContact OE1-NZ 2.65Å; E558-K560 PolarHBondContact OE1-NZ 3.21Å; E558-K560 IonicContact OE2-NZ 2.64Å; E558-K560 PolarHBondContact OE2-NZ 2.82Å
559	A	29.8	Very low	32.2	Very low	80 Å²	80	131.8 Å²	131.8	66%	0.661	75%	0.75	S	S	*	*			cis	-162.7	169.6	11.3	0	0	0	0	0	108.3
560	K	27.9	Very low	32.4	Very low	163 Å²	163	130.5 Å²	130.5	71%	0.709	75%	0.751	S	S	*	*			cis	-154.5	-128.3	-6.5	-153.9	149.6	-162.6	74.2	0	110.2	E558	E558-K560 VanDerWaalsContact OE1-CG 3.29Å; E558-K560 WeakPolarHBondContact OE1-CG 3.38Å; E558-K560 IonicContact OE1-NZ 2.65Å; E558-K560 PolarHBondContact OE1-NZ 3.21Å; E558-K560 IonicContact OE2-NZ 2.64Å; E558-K560 PolarHBondContact OE2-NZ 2.82Å
561	S	26.2	Very low	32.5	Very low	100 Å²	100	132.6 Å²	132.6	70%	0.699	76%	0.758	S	S	*	*			trans	-85.7	160.4	179.3	53.9	0	0	0	0	113.8
562	V	25.7	Very low	32.6	Very low	132 Å²	132	131.2 Å²	131.2	80%	0.8	76%	0.759	S	S	*	*			cis	-135.3	152.7	24.4	177.4	0	0	0	0	112.2
563	T	28.4	Very low	32.7	Very low	127 Å²	127	130.9 Å²	130.9	78%	0.779	76%	0.756	S	S	*	*			trans	-148.2	-168.4	-174.4	31.3	0	0	0	0	108.8
564	P	45.5	Very low	32.9	Very low	119 Å²	119	130 Å²	130	77%	0.773	76%	0.759	S	S	*	*			cis	-122.2	-92.6	0	20.4	5.4	0	0	0	121
565	P	61.6	Low	32.9	Very low	107 Å²	107	134.4 Å²	134.4	70%	0.695	77%	0.769	S	S	*	*				-135.2	-173.4	-129.5	45.6	-27.2	0	0	0	116.6
566	P	45.8	Very low	32.9	Very low	126 Å²	126	135.6 Å²	135.6	82%	0.818	77%	0.772	S	S	*	*			cis	-122.1	-159.5	0.3	44.5	-28.8	0	0	0	112.4
567	A	27.3	Very low	32.8	Very low	89 Å²	89	139.1 Å²	139.1	74%	0.736	78%	0.778	S	S	*	*			cis	-150.6	172.6	5.7	0	0	0	0	0	111.9
568	T	31.1	Very low	32.5	Very low	134 Å²	134	134.2 Å²	134.2	82%	0.822	77%	0.773	S	S	*	*			trans	-154.5	-179.5	-165.3	54	0	0	0	0	113.1
569	P	41.3	Very low	32.3	Very low	112 Å²	112	139.2 Å²	139.2	73%	0.727	79%	0.787	S	S	*	*			cis	-136.3	178.7	-41.5	33.6	-15.3	0	0	0	115.1
570	P	34.8	Very low	32.4	Very low	124 Å²	124	141 Å²	141	81%	0.805	79%	0.792	S	S	*	*			trans	-108.4	-169.5	168.9	40.5	-33.4	0	0	0	116
571	K	28.3	Very low	33.2	Very low	197 Å²	197	137.4 Å²	137.4	86%	0.857	79%	0.786	S	S	*	*			trans	-58.2	172.6	-175.7	-51.7	153.4	-176.2	163.9	0	114.4
572	V	29.6	Very low	33.1	Very low	145 Å²	145	142.8 Å²	142.8	88%	0.879	80%	0.796	S	S	*	*			cis	-164.2	146.9	36.9	-175	0	0	0	0	112.9
573	G	27.9	Very low	33.4	Very low	69 Å²	69	147.8 Å²	147.8	71%	0.711	80%	0.801	S	S	*	*			trans	118.5	127.8	131.8	0	0	0	0	0	121.9
574	P	34.2	Very low	33.9	Very low	129 Å²	129	147 Å²	147	84%	0.838	80%	0.798	S	S	*	*			trans	-121.1	150.6	170	38.9	-28.6	0	0	0	115.4
575	R	27.6	Very low	33	Very low	243 Å²	243	147.8 Å²	147.8	92%	0.917	80%	0.8	S	S	*	*			trans	-164.8	161.6	167.9	-117.6	-176.6	-176.2	-155.3	2.2	114
576	K	25.9	Very low	31.3	Very low	195 Å²	195	151.1 Å²	151.1	85%	0.848	81%	0.807	S	S	*	*			trans	77.5	153.8	-175.2	-53.8	169.2	-175.8	168.7	0	112.2
577	R	28.3	Very low	30.9	Very low	245 Å²	245	150 Å²	150	93%	0.925	80%	0.799	S	S	*	*			cis	-145.7	-160.4	-7.3	-129.5	171.1	-172.7	-173	1.6	108.6
578	G	24.1	Very low	30.8	Very low	69 Å²	69	155.1 Å²	155.1	71%	0.711	81%	0.805	S	S	*	*			trans	-167.2	178.4	173.2	0	0	0	0	0	114.5
579	R	26.2	Very low	30.5	Very low	219 Å²	219	156.7 Å²	156.7	83%	0.826	80%	0.8	S	S	*	*			trans	87.8	125.7	-177.7	-164.7	-175.6	-158.7	-124.3	4.9	116.4
580	P	33	Very low	29.6	Very low	117 Å²	117	159.7 Å²	159.7	76%	0.76	81%	0.805	S	S	*	*			trans	-119.6	169.3	138.2	38.3	-30.6	0	0	0	111.4
581	P	43.9	Very low	29.1	Very low	88 Å²	88	157.7 Å²	157.7	57%	0.571	81%	0.807	S	S	*	*			trans	-147.9	135.4	135	35.5	-20	0	0	0	114.8
582	K	24.9	Very low	28.8	Very low	212 Å²	212	157.3 Å²	157.3	92%	0.922	81%	0.808	S	S	*	*			trans	171.6	165.1	138.7	-96.5	170.9	-179.3	-172.1	0	111.5
583	R	30.8	Very low	29.4	Very low	237 Å²	237	155.4 Å²	155.4	89%	0.894	80%	0.799	S	S	*	*			trans	-124.1	177.4	169.8	-88	-173.2	172.4	-165.6	-3.5	106.3
584	P	39.1	Very low	29.2	Very low	112 Å²	112	161.3 Å²	161.3	73%	0.727	81%	0.808	S	S	*	*			cis	-147.5	-165.7	22.6	31.2	-3.6	0	0	0	117.5
585	V	26.6	Very low	29	Very low	134 Å²	134	159.6 Å²	159.6	81%	0.812	81%	0.805	S	S	*	*			trans	91.9	147.1	156.4	-156.2	0	0	0	0	118.6
586	E	26.1	Very low	29.1	Very low	178 Å²	178	154.8 Å²	154.8	83%	0.832	80%	0.802	S	S	*	*			trans	-107.8	-154.1	-173.3	-50.7	-179.9	157.1	0	0	108.6
587	P	38.1	Very low	29.3	Very low	102 Å²	102	151.5 Å²	151.5	66%	0.662	80%	0.798	S	S	*	*			cis	-145.5	-177.6	0.5	46.5	-27.4	0	0	0	118.6
588	K	25	Very low	29.4	Very low	196 Å²	196	148.1 Å²	148.1	85%	0.852	79%	0.793	S	S	*	*			trans	68.1	158.4	154.3	-77	-171.6	177.1	-170.5	0	119.3
589	F	23.8	Very low	29.9	Very low	167 Å²	167	152.5 Å²	152.5	73%	0.732	80%	0.795	S	S	*	*			cis	-171.3	162.5	-33	-149.3	-123.5	0	0	0	109.5
590	E	23.8	Very low	30.2	Very low	175 Å²	175	147 Å²	147	82%	0.818	79%	0.79	S	S	*	*			trans	60.8	152.5	164.1	-85.1	156.3	-158.9	0	0	121
591	G	23.6	Very low	30	Very low	83 Å²	83	145.9 Å²	145.9	86%	0.856	79%	0.79	S	S	*	*			trans	132.9	101	164.6	0	0	0	0	0	117.6
592	E	22.6	Very low	29.3	Very low	189 Å²	189	149.5 Å²	149.5	88%	0.883	80%	0.801	S	S	*	*			trans	-117.1	-178.4	167.8	-123.3	178.8	-151.2	0	0	108.3
593	P	40.9	Very low	29.6	Very low	104 Å²	104	145.8 Å²	145.8	68%	0.675	79%	0.792	S	S	*	*			cis	-140.5	-161.2	-9.5	27.6	-0.2	0	0	0	115
594	E	24.8	Very low	29.7	Very low	193 Å²	193	139.1 Å²	139.1	90%	0.902	78%	0.781	S	S	*	*			trans	85.9	168	154.8	-53.1	-140.9	134.8	0	0	122.2
595	A	30.5	Very low	29.4	Very low	94 Å²	94	138 Å²	138	78%	0.777	78%	0.782	S	S	*	*			trans	-155.3	-148.6	-148.4	0	0	0	0	0	114.5
596	V	28.6	Very low	29.6	Very low	142 Å²	142	137.8 Å²	137.8	86%	0.861	78%	0.781	S	S	*	*			trans	88.5	139.6	170	-178.7	0	0	0	0	116.8
597	V	31.3	Very low	30	Very low	125 Å²	125	135 Å²	135	76%	0.758	78%	0.776	S	S	*	*			cis	-167.2	-170.5	-32.2	91.3	0	0	0	0	110.8
598	E	30.2	Very low	29.6	Very low	174 Å²	174	133.5 Å²	133.5	81%	0.813	78%	0.778	S	S	*	*			trans	86.4	150.6	166.8	-66.2	-142.9	158.9	0	0	122
599	E	33.6	Very low	29.9	Very low	161 Å²	161	131.8 Å²	131.8	75%	0.752	77%	0.773	S	S	*	*			cis	-172.6	-176	-34.9	-122.9	-95.5	172.8	0	0	113.3
600	S	32.8	Very low	30.4	Very low	105 Å²	105	129.8 Å²	129.8	73%	0.734	77%	0.77	S	S	*	*			trans	76.7	137.9	168	74.7	0	0	0	0	118.9
601	A	29.6	Very low	30.4	Very low	92 Å²	92	129.5 Å²	129.5	76%	0.76	77%	0.768	S	S	*	*			cis	-157.6	-159.5	-10.6	0	0	0	0	0	108.4
602	M	29.5	Very low	31.5	Very low	164 Å²	164	130.2 Å²	130.2	81%	0.808	76%	0.758	S	S	*	*			cis	-166.4	163.2	8.6	-155.9	171.9	169.8	0	0	111.3
603	D	29.7	Very low	31.6	Very low	135 Å²	135	128.6 Å²	128.6	72%	0.722	75%	0.75	S	S	*	*			trans	26.3	148.5	156.9	-87.1	-56.4	0	0	0	125.4
604	S	32.6	Very low	30.9	Very low	96 Å²	96	132 Å²	132	67%	0.671	76%	0.757	S	S	*	*			cis	-156.9	144.5	4.1	60.3	0	0	0	0	114.4
605	A	33.5	Very low	31	Very low	89 Å²	89	126.4 Å²	126.4	74%	0.736	75%	0.745	S	S	*	*			trans	50.9	139.5	150.2	0	0	0	0	0	121.6
606	T	32.1	Very low	30.7	Very low	130 Å²	130	126.9 Å²	126.9	80%	0.798	75%	0.748	S	S	*	*			cis	-179.8	165	-6.9	31.1	0	0	0	0	105.5
607	V	34.2	Very low	30.6	Very low	120 Å²	120	124.3 Å²	124.3	73%	0.727	74%	0.742	S	S	*	*			cis	-171.6	152.9	-14.1	142.3	0	0	0	0	103.9
608	G	29.9	Very low	30.2	Very low	69 Å²	69	128.4 Å²	128.4	71%	0.711	75%	0.749	S	S	*	*			cis	-154	-136.2	2.6	0	0	0	0	0	109.6
609	E	30.7	Very low	30.2	Very low	160 Å²	160	124.8 Å²	124.8	75%	0.748	75%	0.749	S	S	*	*			cis	-165.6	174.1	-7.5	-129	-178.6	97.9	0	0	112.9
610	L	33.1	Very low	29.8	Very low	126 Å²	126	123.4 Å²	123.4	66%	0.66	75%	0.751	S	S	*	*			trans	2.5	103.3	171.9	-58.1	179.6	0	0	0	124
611	Q	25.6	Very low	29.5	Very low	168 Å²	168	127.1 Å²	127.1	79%	0.785	76%	0.757	S	S	*	*				64	164.8	106.7	-80.1	-172.7	-6.7	0	0	123.4
612	P	45.2	Very low	29.9	Very low	98 Å²	98	127.6 Å²	127.6	64%	0.636	75%	0.753	S	S	*	*			cis	-140.7	-167.5	-23.9	31.6	-7.5	0	0	0	116.6
613	E	25.9	Very low	29.7	Very low	155 Å²	155	129 Å²	129	72%	0.724	76%	0.757	S	S	*	*			trans	93.7	127.9	154.9	-56.8	-51.6	79.3	0	0	126.5
614	E	26.4	Very low	29.5	Very low	175 Å²	175	126.4 Å²	126.4	82%	0.818	76%	0.755	S	S	*	*			trans	52.9	159.1	140.3	-66.3	-156.5	126.6	0	0	124.6
615	A	25.9	Very low	29.1	Very low	77 Å²	77	131 Å²	131	64%	0.636	77%	0.765	S	S	*	*			cis	-172.1	155.7	-30.8	0	0	0	0	0	112.3
616	A	24.6	Very low	28.8	Very low	104 Å²	104	130.5 Å²	130.5	86%	0.86	76%	0.762	S	S	*	*			trans	55.2	-178.2	152.4	0	0	0	0	0	121.3
617	A	26.2	Very low	28.4	Very low	87 Å²	87	133.3 Å²	133.3	72%	0.719	76%	0.763	S	S	*	*				-161.4	152.7	-64.8	0	0	0	0	0	113.1
618	K	23.9	Very low	28.1	Very low	211 Å²	211	135.5 Å²	135.5	92%	0.917	77%	0.765	S	S	*	*			trans	58.1	162.1	158	-74.6	-176.8	177.4	178	0	120.8
619	A	29.5	Very low	27.9	Very low	98 Å²	98	139.5 Å²	139.5	81%	0.81	77%	0.765	S	S	*	*			trans	-140.7	144.2	168.4	0	0	0	0	0	110
620	V	25	Very low	27.6	Very low	132 Å²	132	139.2 Å²	139.2	80%	0.8	77%	0.769	S	S	*	*			trans	-152.8	143.7	174.5	174	0	0	0	0	109.1
621	E	27.4	Very low	27.2	Very low	184 Å²	184	137.1 Å²	137.1	86%	0.86	78%	0.778	S	S	*	*			trans	-114.9	157.9	160	-70.2	-160.8	174.5	0	0	110
622	P	36.7	Very low	27.2	Very low	102 Å²	102	133.7 Å²	133.7	66%	0.662	78%	0.778	S	S	*	*			trans	-138.6	126.3	151.6	34.3	-17.8	0	0	0	116.1
623	E	25.7	Very low	27	Very low	192 Å²	192	134 Å²	134	90%	0.897	78%	0.78	S	S	*	*				63.8	161.5	123.2	-55.7	-178.1	148.6	0	0	119.9
624	A	25.1	Very low	27.2	Very low	81 Å²	81	135.5 Å²	135.5	67%	0.669	79%	0.787	S	S	*	*			cis	-153.6	162.8	14.6	0	0	0	0	0	114.5
625	E	24.2	Very low	27.1	Very low	192 Å²	192	133.3 Å²	133.3	90%	0.897	79%	0.791	S	S	*	*			trans	58.8	157.3	149.4	-67.3	-175.1	-177.2	0	0	122.7
626	A	27.3	Very low	27.6	Very low	80 Å²	80	134.5 Å²	134.5	66%	0.661	80%	0.801	S	S	*	*			cis	-169	163.7	-30.7	0	0	0	0	0	112.7
627	K	24.2	Very low	27.9	Very low	189 Å²	189	133.2 Å²	133.2	82%	0.822	80%	0.798	S	S	*	*			trans	79.3	122.1	162.6	-62.8	178.4	-179.1	172.6	0	121.7
628	Q	26.9	Very low	28.4	Very low	165 Å²	165	133.4 Å²	133.4	77%	0.771	79%	0.794	S	S	*	*				30.6	145.5	122.8	-65.7	167	-17	0	0	120.3
629	Q	27.2	Very low	29.3	Very low	153 Å²	153	126.2 Å²	126.2	72%	0.715	78%	0.779	S	S	*	*			cis	-160.2	164.6	11.2	-131.4	170.2	-15.7	0	0	112.6
630	D	24.6	Very low	30.3	Very low	154 Å²	154	126 Å²	126	82%	0.824	76%	0.762	S	S	*	*			trans	28.7	132.7	162.1	-69.9	-62.1	0	0	0	123.5
631	G	23.1	Very low	32.3	Very low	82 Å²	82	123.5 Å²	123.5	85%	0.845	74%	0.741	S	S	*	*			trans	165.6	112.3	165.4	0	0	0	0	0	115.8
632	A	27.1	Very low	33.8	Very low	96 Å²	96	118.9 Å²	118.9	79%	0.793	73%	0.726	S	S	*	*			trans	-126.9	156.5	166.1	0	0	0	0	0	108
633	P	41	Very low	35.5	Very low	106 Å²	106	114.1 Å²	114.1	69%	0.688	70%	0.695	S	S	*	*			cis	-150.8	-175.4	31.6	46.3	-27	0	0	0	118.3
634	Q	29.9	Very low	37.3	Very low	186 Å²	186	111.1 Å²	111.1	87%	0.869	70%	0.695	S	S	*	*			trans	78.7	154.4	154.4	-71.5	-176.9	45	0	0	122
635	S	24.4	Very low	38.7	Very low	128 Å²	128	113.5 Å²	113.5	90%	0.895	69%	0.692	S	S	*	*			trans	82.9	139.8	162.4	-148.5	0	0	0	0	120.4
636	A	36.1	Very low	40.7	Very low	103 Å²	103	107.2 Å²	107.2	85%	0.851	67%	0.669	S	S	*	*			trans	-77.8	138.3	-163.5	0	0	0	0	0	114.8
637	G	29.6	Very low	42.3	Very low	77 Å²	77	106 Å²	106	79%	0.794	67%	0.665	S	S	*	*			trans	-125.4	129.1	164.2	0	0	0	0	0	111.1
638	S	36.7	Very low	44.2	Very low	91 Å²	91	100.6 Å²	100.6	64%	0.636	64%	0.643	S	S	*	*			trans	-77.7	126.2	175.7	52.7	0	0	0	0	111.1	E640	S638-E640 PolarHBondContact O-N 3.36Å
639	G	42.7	Very low	46	Very low	59 Å²	59	95.3 Å²	95.3	61%	0.608	62%	0.624	S	S	*	*			trans	-65	89.1	174.8	0	0	0	0	0	112.7
640	E	51.9	Low	48.1	Very low	95 Å²	95	90 Å²	90	44%	0.444	60%	0.599	S	S	.	*			trans	-86.3	124.1	171.5	-68.9	-137	130.6	0	0	110.5	S638 S649	S638-E640 PolarHBondContact O-N 3.36Å; E640-S649 WeakPolarHBondContact OE2-CB 3.45Å; E640-S649 PolarHBondContact OE2-OG 2.94Å
641	H	66	Low	50	Low	78 Å²	78	89.8 Å²	89.8	36%	0.361	59%	0.593	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.3	105.8	174.5	-55.5	-78.1	0	0	0	109.6	F650 R652 R653 L656	H641-F650 WeakPolarHBondContact CB-O 3.23Å; H641-F650 PolarHBondContact CD2-O 3.32Å; H641-F650 PolarHBondContact N-O 2.96Å; H641-F650 PolarHBondContact O-N 3.25Å; H641-R652 VanDerWaalsContact CD2-C 3.5Å; H641-R653 PolarHBondContact CD2-N 3.18Å; H641-R653 PolarHBondContact NE2-N 2.82Å; H641-L656 HydrophobicContact CB-CB 4.44Å; H641-L656 HydrophobicContact CB-CD2 3.86Å
642	T	60.5	Low	52	Low	87 Å²	87	94 Å²	94	53%	0.534	58%	0.583	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.5	151.7	177.2	42.6	0	0	0	0	112.6	M648 L656	T642-M648 CarbonylContact C-O 2.97Å; T642-M648 WeakPolarHBondContact CA-O 3.43Å; T642-L656 WeakPolarHBondContact O-CD2 3.33Å
643	C	71.6	Confident	53.7	Low	2 Å²	2	98 Å²	98	1%	0.014	58%	0.578	C	S	.	*			trans	-94.7	120.8	169.9	178.9	0	0	0	0	110.7	E645 C646 G647 M648 F650 L656 H659	C643-E645 PolarHBondContact O-N 3.16Å; C643-E645 VanDerWaalsContact O-N 3.15Å; C643-C646 PolarHBondContact O-N 3.07Å; C643-G647 WeakPolarHBondContact O-CA 3.45Å; C643-G647 PolarHBondContact O-N 3.46Å; C643-M648 PolarHBondContact N-O 2.98Å; C643-F650 HydrophobicContact CB-CE2 4.15Å; C643-L656 HydrophobicContact CB-CD1 3.5Å; C643-H659 PolarHBondContact SG-CD2 2.89Å; C643-H659 PolarHBondContact SG-NE2 3.15Å; C643-H659 VanDerWaalsContact SG-NE2 3.38Å
644	S	63.3	Low	54.6	Low	130 Å²	130	100.4 Å²	100.4	91%	0.909	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	-26.5	179.6	-41.3	0	0	0	0	114.1
645	E	54.3	Low	56.5	Low	130 Å²	130	94 Å²	94	61%	0.607	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	-11.3	-173.6	-60.1	173.6	130	0	0	113.7	C643 H663	C643-E645 PolarHBondContact O-N 3.16Å; C643-E645 VanDerWaalsContact O-N 3.15Å; E645-H663 IonicContact OE2-CD2 3.22Å; E645-H663 PolarHBondContact OE2-CD2 2.89Å; E645-H663 IonicContact OE2-CG 2.66Å
646	C	66.8	Low	58.9	Low	60 Å²	60	89.3 Å²	89.3	41%	0.405	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.8	5.7	179.1	81.7	0	0	0	0	116.1	C643 M648 H659	C643-C646 PolarHBondContact O-N 3.07Å; C646-M648 PolarHBondContact O-N 3.29Å; C646-H659 PolarHBondContact SG-CE1 2.87Å; C646-H659 PolarHBondContact SG-NE2 3.44Å
647	G	61.2	Low	60.6	Low	56 Å²	56	88.2 Å²	88.2	58%	0.577	49%	0.494	S	S	*	.			trans	71.9	-12.5	179.7	0	0	0	0	0	116.1	C643 S649	C643-G647 WeakPolarHBondContact O-CA 3.45Å; C643-G647 PolarHBondContact O-N 3.46Å; G647-S649 PolarHBondContact O-N 3.33Å
648	M	63.3	Low	62.4	Low	75 Å²	75	88.5 Å²	88.5	37%	0.369	48%	0.475	S	S	.	.			trans	-60.3	127.6	-176	-76.7	-167.7	154.7	0	0	112.6	T642 C643 C646 F650 S675	T642-M648 CarbonylContact C-O 2.97Å; T642-M648 WeakPolarHBondContact CA-O 3.43Å; C643-M648 PolarHBondContact N-O 2.98Å; C646-M648 PolarHBondContact O-N 3.29Å; M648-F650 HydrophobicContact CB-CE2 3.65Å; M648-F650 HydrophobicContact CB-CZ 3.68Å; M648-F650 WeakPolarHBondContact O-CD2 3.45Å; M648-F650 VanDerWaalsContact O-CE2 3.26Å; M648-F650 WeakPolarHBondContact O-CE2 3.19Å; M648-F650 HydrophobicContact SD-CZ 4.25Å; M648-S675 VanDerWaalsContact CE-OG 3.29Å; M648-S675 WeakPolarHBondContact CE-OG 3.33Å
649	S	63.9	Low	63.9	Low	53 Å²	53	85.2 Å²	85.2	37%	0.371	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	143.3	173.9	62	0	0	0	0	113.2	E640 G647	E640-S649 WeakPolarHBondContact OE2-CB 3.45Å; E640-S649 PolarHBondContact OE2-OG 2.94Å; G647-S649 PolarHBondContact O-N 3.33Å
650	F	72.1	Confident	64.9	Low	42 Å²	42	84.4 Å²	84.4	18%	0.184	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	120.8	-179	-60.6	-79	0	0	0	111.3	H641 C643 M648 R652 L656 H659	H641-F650 WeakPolarHBondContact CB-O 3.23Å; H641-F650 PolarHBondContact CD2-O 3.32Å; H641-F650 PolarHBondContact N-O 2.96Å; H641-F650 PolarHBondContact O-N 3.25Å; C643-F650 HydrophobicContact CB-CE2 4.15Å; M648-F650 HydrophobicContact CB-CE2 3.65Å; M648-F650 HydrophobicContact CB-CZ 3.68Å; M648-F650 WeakPolarHBondContact O-CD2 3.45Å; M648-F650 VanDerWaalsContact O-CE2 3.26Å; M648-F650 WeakPolarHBondContact O-CE2 3.19Å; M648-F650 HydrophobicContact SD-CZ 4.25Å; F650-R652 PolarHBondContact O-N 3.32Å; F650-L656 HydrophobicContact CB-CB 4.39Å; F650-L656 HydrophobicContact CD2-CB 4.07Å; F650-L656 HydrophobicContact CD2-CD1 4.09Å; F650-L656 HydrophobicContact CE2-CD1 4.35Å; F650-L656 HydrophobicContact CG-CB 4.49Å; F650-H659 HydrophobicContact CE1-CB 4.42Å; F650-H659 HydrophobicContact CE2-CB 4.05Å; F650-H659 AromaticContact CE2-CD2 3.58Å; F650-H659 AromaticContact CE2-CG 3.66Å; F650-H659 HydrophobicContact CZ-CB 3.83Å; F650-H659 AromaticContact CZ-CD2 3.8Å; F650-H659 AromaticContact CZ-CE1 3.95Å; F650-H659 AromaticContact CZ-CG 3.44Å; F650-H659 VanDerWaalsContact CZ-CG 3.44Å; F650-H659 AromaticContact CZ-ND1 3.55Å
651	Q	63.9	Low	65.6	Low	149 Å²	149	84 Å²	84	70%	0.696	43%	0.434	S	S	*	.	S	Bend	trans	-60.7	2.2	176.9	-68.2	-179.2	-20.1	0	0	115.9
652	R	66.6	Low	65.1	Low	170 Å²	170	86.8 Å²	86.8	64%	0.642	45%	0.445	S	S	*	.	S	Bend	trans	-151	129.4	178	-61.3	-174.2	-175.5	156.9	6.7	111.6	H641 F650 Y654 S655 L656	H641-R652 VanDerWaalsContact CD2-C 3.5Å; F650-R652 PolarHBondContact O-N 3.32Å; R652-Y654 PolarHBondContact O-N 2.84Å; R652-Y654 VanDerWaalsContact O-N 3.13Å; R652-S655 WeakPolarHBondContact O-CA 3.4Å; R652-S655 WeakPolarHBondContact O-CB 3.32Å; R652-S655 PolarHBondContact O-N 2.77Å; R652-L656 PolarHBondContact O-N 3.15Å
653	R	62.3	Low	65.1	Low	181 Å²	181	86.1 Å²	86.1	68%	0.683	44%	0.436	S	S	*	.	H	α-helix	trans	-52.1	-35.1	176.4	-165.8	177	-178	-175.6	1.5	113.9	H641 S655 L656 I657	H641-R653 PolarHBondContact CD2-N 3.18Å; H641-R653 PolarHBondContact NE2-N 2.82Å; R653-S655 VanDerWaalsContact C-N 3.35Å; R653-S655 PolarHBondContact O-N 3.07Å; R653-L656 WeakPolarHBondContact O-CB 3.27Å; R653-L656 PolarHBondContact O-N 3.43Å; R653-I657 HydrophobicContact CG-CD1 4.18Å; R653-I657 WeakPolarHBondContact O-CG1 3.23Å; R653-I657 PolarHBondContact O-N 2.93Å
654	Y	60	Low	64.2	Low	157 Å²	157	92.6 Å²	92.6	62%	0.616	47%	0.466	S	S	*	.	H	α-helix	trans	-64.3	-35	174	178.7	-98.2	0	0	0	113.3	R652 M658	R652-Y654 PolarHBondContact O-N 2.84Å; R652-Y654 VanDerWaalsContact O-N 3.13Å; Y654-M658 HydrophobicContact CD1-CG 4.11Å; Y654-M658 HydrophobicContact CD2-CG 4.3Å; Y654-M658 HydrophobicContact CE1-CG 3.63Å; Y654-M658 HydrophobicContact CE2-CG 3.83Å; Y654-M658 HydrophobicContact CE2-SD 4.22Å; Y654-M658 HydrophobicContact CG-CG 4.43Å; Y654-M658 VanDerWaalsContact CZ-CG 3.47Å; Y654-M658 VanDerWaalsContact O-CB 3.3Å; Y654-M658 WeakPolarHBondContact O-CB 3.34Å; Y654-M658 VanDerWaalsContact O-CG 3.27Å; Y654-M658 WeakPolarHBondContact O-CG 3.49Å; Y654-M658 PolarHBondContact O-N 3.38Å
655	S	70.3	Confident	63.3	Low	51 Å²	51	93.6 Å²	93.6	36%	0.357	45%	0.454	S	S	.	.	H	α-helix	trans	-69.6	-36.1	176.3	-60.2	0	0	0	0	111.7	R652 R653 M658 H659	R652-S655 WeakPolarHBondContact O-CA 3.4Å; R652-S655 WeakPolarHBondContact O-CB 3.32Å; R652-S655 PolarHBondContact O-N 2.77Å; R653-S655 VanDerWaalsContact C-N 3.35Å; R653-S655 PolarHBondContact O-N 3.07Å; S655-M658 CarbonylContact O-C 3.55Å; S655-H659 VanDerWaalsContact O-CB 3.28Å; S655-H659 WeakPolarHBondContact O-CB 3.5Å; S655-H659 PolarHBondContact O-N 3.24Å
656	L	74.4	Confident	62.9	Low	30 Å²	30	91 Å²	91	16%	0.157	45%	0.454	C	S	.	.	H	α-helix	trans	-64.6	-48.7	172.1	170.7	59.9	0	0	0	111.4	H641 T642 C643 F650 R652 R653 M658 H659 T660	H641-L656 HydrophobicContact CB-CB 4.44Å; H641-L656 HydrophobicContact CB-CD2 3.86Å; T642-L656 WeakPolarHBondContact O-CD2 3.33Å; C643-L656 HydrophobicContact CB-CD1 3.5Å; F650-L656 HydrophobicContact CB-CB 4.39Å; F650-L656 HydrophobicContact CD2-CB 4.07Å; F650-L656 HydrophobicContact CD2-CD1 4.09Å; F650-L656 HydrophobicContact CE2-CD1 4.35Å; F650-L656 HydrophobicContact CG-CB 4.49Å; R652-L656 PolarHBondContact O-N 3.15Å; R653-L656 WeakPolarHBondContact O-CB 3.27Å; R653-L656 PolarHBondContact O-N 3.43Å; L656-M658 VanDerWaalsContact C-N 3.34Å; L656-M658 PolarHBondContact O-N 3.03Å; L656-H659 CarbonylContact O-C 3.6Å; L656-H659 WeakPolarHBondContact O-CA 3.41Å; L656-H659 WeakPolarHBondContact O-CB 3.18Å; L656-H659 PolarHBondContact O-N 3.41Å; L656-T660 HydrophobicContact CD1-CG2 4.04Å; L656-T660 PolarHBondContact O-N 3.48Å
657	I	72.1	Confident	62	Low	80 Å²	80	96.7 Å²	96.7	41%	0.41	47%	0.467	S	S	.	.	H	α-helix	trans	-61	-43.8	176.5	-66.1	162.3	0	0	0	110.7	R653 H659 T660 L661	R653-I657 HydrophobicContact CG-CD1 4.18Å; R653-I657 WeakPolarHBondContact O-CG1 3.23Å; R653-I657 PolarHBondContact O-N 2.93Å; I657-H659 PolarHBondContact O-N 3.41Å; I657-T660 PolarHBondContact O-OG1 3.37Å; I657-L661 HydrophobicContact CG2-CD1 3.91Å; I657-L661 HydrophobicContact CG2-CG 4.47Å; I657-L661 WeakPolarHBondContact O-CB 3.28Å; I657-L661 WeakPolarHBondContact O-CD1 3.47Å; I657-L661 WeakPolarHBondContact O-CG 3.49Å; I657-L661 PolarHBondContact O-N 2.91Å
658	M	66.3	Low	61.6	Low	82 Å²	82	96 Å²	96	40%	0.404	46%	0.456	S	S	.	.	H	α-helix	trans	-70.9	5.6	173.1	-68.5	-61.3	-55.1	0	0	113.6	Y654 S655 L656 L661 K662	Y654-M658 HydrophobicContact CD1-CG 4.11Å; Y654-M658 HydrophobicContact CD2-CG 4.3Å; Y654-M658 HydrophobicContact CE1-CG 3.63Å; Y654-M658 HydrophobicContact CE2-CG 3.83Å; Y654-M658 HydrophobicContact CE2-SD 4.22Å; Y654-M658 HydrophobicContact CG-CG 4.43Å; Y654-M658 VanDerWaalsContact CZ-CG 3.47Å; Y654-M658 VanDerWaalsContact O-CB 3.3Å; Y654-M658 WeakPolarHBondContact O-CB 3.34Å; Y654-M658 VanDerWaalsContact O-CG 3.27Å; Y654-M658 WeakPolarHBondContact O-CG 3.49Å; Y654-M658 PolarHBondContact O-N 3.38Å; S655-M658 CarbonylContact O-C 3.55Å; L656-M658 VanDerWaalsContact C-N 3.34Å; L656-M658 PolarHBondContact O-N 3.03Å; M658-L661 HydrophobicContact SD-CD1 4.46Å; M658-K662 PolarHBondContact O-NZ 3.02Å
659	H	69.2	Low	61.3	Low	23 Å²	23	98.4 Å²	98.4	11%	0.106	46%	0.462	C	S	.	.	H	α-helix	trans	-113.8	-42.1	174.8	165.5	86.8	0	0	0	111.7	C643 C646 F650 S655 L656 I657 L661 K662 H663	C643-H659 PolarHBondContact SG-CD2 2.89Å; C643-H659 PolarHBondContact SG-NE2 3.15Å; C643-H659 VanDerWaalsContact SG-NE2 3.38Å; C646-H659 PolarHBondContact SG-CE1 2.87Å; C646-H659 PolarHBondContact SG-NE2 3.44Å; F650-H659 HydrophobicContact CE1-CB 4.42Å; F650-H659 HydrophobicContact CE2-CB 4.05Å; F650-H659 AromaticContact CE2-CD2 3.58Å; F650-H659 AromaticContact CE2-CG 3.66Å; F650-H659 HydrophobicContact CZ-CB 3.83Å; F650-H659 AromaticContact CZ-CD2 3.8Å; F650-H659 AromaticContact CZ-CE1 3.95Å; F650-H659 AromaticContact CZ-CG 3.44Å; F650-H659 VanDerWaalsContact CZ-CG 3.44Å; F650-H659 AromaticContact CZ-ND1 3.55Å; S655-H659 VanDerWaalsContact O-CB 3.28Å; S655-H659 WeakPolarHBondContact O-CB 3.5Å; S655-H659 PolarHBondContact O-N 3.24Å; L656-H659 CarbonylContact O-C 3.6Å; L656-H659 WeakPolarHBondContact O-CA 3.41Å; L656-H659 WeakPolarHBondContact O-CB 3.18Å; L656-H659 PolarHBondContact O-N 3.41Å; I657-H659 PolarHBondContact O-N 3.41Å; H659-L661 VanDerWaalsContact C-N 3.32Å; H659-L661 PolarHBondContact O-N 3.03Å; H659-K662 VanDerWaalsContact O-CB 3.31Å; H659-K662 WeakPolarHBondContact O-CB 3.47Å; H659-K662 PolarHBondContact O-N 2.85Å; H659-H663 AromaticContact CD2-NE2 3.72Å; H659-H663 AromaticContact CE1-CE1 3.83Å; H659-H663 AromaticContact CE1-NE2 3.54Å; H659-H663 AromaticContact NE2-CE1 3.75Å; H659-H663 AromaticContact NE2-NE2 3.03Å; H659-H663 PolarHBondContact NE2-NE2 3.48Å
660	T	63.3	Low	61.4	Low	42 Å²	42	101.6 Å²	101.6	26%	0.258	47%	0.469	S	S	.	.	H	α-helix	trans	-60.4	-41.9	171.3	54.5	0	0	0	0	111.4	L656 I657 K662 H663	L656-T660 HydrophobicContact CD1-CG2 4.04Å; L656-T660 PolarHBondContact O-N 3.48Å; I657-T660 PolarHBondContact O-OG1 3.37Å; T660-K662 PolarHBondContact O-N 3.05Å; T660-H663 PolarHBondContact O-N 2.82Å
661	L	66.5	Low	61.4	Low	85 Å²	85	100 Å²	100	45%	0.445	46%	0.463	S	S	.	.	H	α-helix	trans	-61.1	5.4	170.4	-65.7	173	0	0	0	115	I657 M658 H659 E664	I657-L661 HydrophobicContact CG2-CD1 3.91Å; I657-L661 HydrophobicContact CG2-CG 4.47Å; I657-L661 WeakPolarHBondContact O-CB 3.28Å; I657-L661 WeakPolarHBondContact O-CD1 3.47Å; I657-L661 WeakPolarHBondContact O-CG 3.49Å; I657-L661 PolarHBondContact O-N 2.91Å; M658-L661 HydrophobicContact SD-CD1 4.46Å; H659-L661 VanDerWaalsContact C-N 3.32Å; H659-L661 PolarHBondContact O-N 3.03Å; L661-E664 WeakPolarHBondContact CD2-OE2 3.39Å
662	K	56.1	Low	61.5	Low	137 Å²	137	98.2 Å²	98.2	60%	0.596	47%	0.466	S	S	*	.	H	α-helix	trans	-106.3	-23.6	169.2	-58.2	-165.2	-178.3	84.3	0	113.7	M658 H659 T660	M658-K662 PolarHBondContact O-NZ 3.02Å; H659-K662 VanDerWaalsContact O-CB 3.31Å; H659-K662 WeakPolarHBondContact O-CB 3.47Å; H659-K662 PolarHBondContact O-N 2.85Å; T660-K662 PolarHBondContact O-N 3.05Å
663	H	59.6	Low	61.5	Low	74 Å²	74	95.2 Å²	95.2	34%	0.343	46%	0.463	S	S	.	.	H	α-helix	trans	-71.2	-36.7	175.5	-62.4	-53.2	0	0	0	110.5	E645 H659 T660 K665	E645-H663 IonicContact OE2-CD2 3.22Å; E645-H663 PolarHBondContact OE2-CD2 2.89Å; E645-H663 IonicContact OE2-CG 2.66Å; H659-H663 AromaticContact CD2-NE2 3.72Å; H659-H663 AromaticContact CE1-CE1 3.83Å; H659-H663 AromaticContact CE1-NE2 3.54Å; H659-H663 AromaticContact NE2-CE1 3.75Å; H659-H663 AromaticContact NE2-NE2 3.03Å; H659-H663 PolarHBondContact NE2-NE2 3.48Å; T660-H663 PolarHBondContact O-N 2.82Å; H663-K665 PolarHBondContact O-N 2.84Å
664	E	53.1	Low	61.6	Low	138 Å²	138	88 Å²	88	65%	0.645	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-10.5	178.3	-62.3	176.6	164	0	0	116	L661	L661-E664 WeakPolarHBondContact CD2-OE2 3.39Å
665	K	43.2	Very low	61.5	Low	151 Å²	151	84.9 Å²	84.9	66%	0.657	44%	0.441	S	S	*	.	S	Bend	trans	-134.3	72.6	-174.8	-63.3	-166	-179.7	-170.5	0	111.9	H663	H663-K665 PolarHBondContact O-N 2.84Å
666	A	47	Very low	61.5	Low	74 Å²	74	87.7 Å²	87.7	61%	0.612	45%	0.447	S	S	*	.			trans	-61	131.8	-164	0	0	0	0	0	116.3
667	R	46.7	Very low	61.6	Low	180 Å²	180	90 Å²	90	68%	0.679	46%	0.457	S	S	*	.			trans	60.3	110.1	134.1	-68	165.8	-169.9	172.6	8.6	120	E677	R667-E677 WeakPolarHBondContact CG-OE2 3.44Å; R667-E677 IonicContact NE-OE2 3.59Å
668	A	52.8	Low	61.6	Low	41 Å²	41	88.6 Å²	88.6	34%	0.339	45%	0.448	S	S	.	.	S	Bend		-154.6	147	111.7	0	0	0	0	0	111.1	F678 Q679	A668-F678 PolarHBondContact N-O 3.01Å; A668-F678 CarbonylContact O-C 3.59Å; A668-Q679 PolarHBondContact O-N 3.06Å
669	Y	58.4	Low	61.4	Low	127 Å²	127	90.2 Å²	90.2	50%	0.498	45%	0.454	S	S	.	.			trans	70.9	100.6	-178.1	-45	-75.7	0	0	0	115.2	F678 Y680 A681	Y669-F678 PolarHBondContact O-N 3.18Å; Y669-Y680 VanDerWaalsContact CD2-C 3.42Å; Y669-A681 HydrophobicContact CD1-CB 4.04Å; Y669-A681 HydrophobicContact CD2-CB 4.3Å; Y669-A681 HydrophobicContact CE1-CB 3.83Å; Y669-A681 HydrophobicContact CE2-CB 4.1Å; Y669-A681 VanDerWaalsContact CE2-N 3.34Å; Y669-A681 HydrophobicContact CG-CB 4.28Å
670	K	64.8	Low	61.3	Low	120 Å²	120	96.5 Å²	96.5	52%	0.522	48%	0.478	S	S	.	.	B	Isolated β-bridge	trans	-93.8	148.2	172.4	-47.1	-163	-174.1	-155.6	0	111.2	E677 L684	K670-E677 HydrophobicContact CB-CG 4.46Å; K670-E677 HydrophobicContact CD-CG 4.05Å; K670-E677 WeakPolarHBondContact CD-OE1 3.48Å; K670-E677 WeakPolarHBondContact CE-OE1 3.44Å; K670-E677 HydrophobicContact CG-CG 3.91Å; K670-E677 IonicContact NZ-OE1 2.31Å; K670-E677 PolarHBondContact NZ-OE1 3.33Å; K670-E677 IonicContact NZ-OE2 2.81Å; K670-L684 WeakPolarHBondContact O-CD2 3.32Å
671	C	73.2	Confident	61.2	Low	9 Å²	9	96.5 Å²	96.5	6%	0.061	48%	0.482	C	S	.	.			trans	-85.3	138.3	169.1	-179.3	0	0	0	0	111.1	L673 C674 K676 F678 L684 H687 L688	C671-L673 PolarHBondContact SG-N 3.3Å; C671-L673 VanDerWaalsContact SG-N 3.41Å; C671-C674 CarbonylContact C-O 3.23Å; C671-C674 WeakPolarHBondContact CB-O 3.42Å; C671-K676 PolarHBondContact N-O 2.69Å; C671-F678 HydrophobicContact CB-CE2 4.22Å; C671-L684 HydrophobicContact CB-CD1 3.54Å; C671-H687 VanDerWaalsContact SG-CD2 3.52Å; C671-H687 PolarHBondContact SG-NE2 3.43Å; C671-H687 VanDerWaalsContact SG-NE2 3.38Å; C671-L688 VanDerWaalsContact SG-CD2 3.56Å
672	S	65.4	Low	61.2	Low	110 Å²	110	95.9 Å²	95.9	77%	0.769	49%	0.489	S	S	*	.	S	Bend	trans	-84.7	-19.7	175.7	51.4	0	0	0	0	113.5
673	L	66.8	Low	61.9	Low	108 Å²	108	91.9 Å²	91.9	57%	0.565	48%	0.479	S	S	*	.	S	Bend	trans	-95.5	-8.5	-177.7	-58	-179.3	0	0	0	113.7	C671 L688 H691	C671-L673 PolarHBondContact SG-N 3.3Å; C671-L673 VanDerWaalsContact SG-N 3.41Å; L673-L688 HydrophobicContact CD1-CD2 4.03Å; L673-L688 HydrophobicContact CG-CD2 4.22Å; L673-H691 HydrophobicContact CB-CB 4.41Å; L673-H691 HydrophobicContact CD1-CB 3.8Å; L673-H691 PolarHBondContact O-CE1 3.45Å; L673-H691 VanDerWaalsContact O-CE1 3.25Å
674	C	65	Low	62.8	Low	30 Å²	30	89.5 Å²	89.5	20%	0.203	47%	0.469	C	S	.	.	S	Bend	trans	-162.6	154.1	154.2	63.9	0	0	0	0	108.5	C671 K676 H687 H691	C671-C674 CarbonylContact C-O 3.23Å; C671-C674 WeakPolarHBondContact CB-O 3.42Å; C674-K676 PolarHBondContact O-N 2.85Å; C674-K676 PolarHBondContact SG-NZ 2.79Å; C674-H687 PolarHBondContact SG-NE2 2.93Å; C674-H687 VanDerWaalsContact SG-NE2 3.41Å; C674-H691 PolarHBondContact SG-NE2 2.89Å
675	S	57.6	Low	63.5	Low	91 Å²	91	89.7 Å²	89.7	64%	0.636	47%	0.469	S	S	*	.	S	Bend	trans	-69.9	37.3	-174.3	46.8	0	0	0	0	115.8	M648	M648-S675 VanDerWaalsContact CE-OG 3.29Å; M648-S675 WeakPolarHBondContact CE-OG 3.33Å
676	K	69.3	Low	65	Low	109 Å²	109	85.5 Å²	85.5	47%	0.474	46%	0.463	S	S	.	.			trans	-88.2	122	174.1	-65.1	-177	-173.3	74.5	0	109.8	C671 C674 F678	C671-K676 PolarHBondContact N-O 2.69Å; C674-K676 PolarHBondContact O-N 2.85Å; C674-K676 PolarHBondContact SG-NZ 2.79Å; K676-F678 HydrophobicContact CB-CE2 3.87Å; K676-F678 HydrophobicContact CB-CZ 4.1Å; K676-F678 WeakPolarHBondContact O-CE2 3.35Å
677	E	76.9	Confident	66.4	Low	80 Å²	80	83.2 Å²	83.2	37%	0.374	44%	0.44	S	S	.	.	B	Isolated β-bridge	trans	-90.8	146.3	171.9	-46.9	-162.8	179.2	0	0	110.1	R667 K670	R667-E677 WeakPolarHBondContact CG-OE2 3.44Å; R667-E677 IonicContact NE-OE2 3.59Å; K670-E677 HydrophobicContact CB-CG 4.46Å; K670-E677 HydrophobicContact CD-CG 4.05Å; K670-E677 WeakPolarHBondContact CD-OE1 3.48Å; K670-E677 WeakPolarHBondContact CE-OE1 3.44Å; K670-E677 HydrophobicContact CG-CG 3.91Å; K670-E677 IonicContact NZ-OE1 2.31Å; K670-E677 PolarHBondContact NZ-OE1 3.33Å; K670-E677 IonicContact NZ-OE2 2.81Å
678	F	72.6	Confident	67.7	Low	50 Å²	50	77.3 Å²	77.3	22%	0.219	42%	0.421	C	S	.	.			trans	-116.7	-165.7	177.7	-66	-88.8	0	0	0	109.3	A668 Y669 C671 K676 L684 H687	A668-F678 PolarHBondContact N-O 3.01Å; A668-F678 CarbonylContact O-C 3.59Å; Y669-F678 PolarHBondContact O-N 3.18Å; C671-F678 HydrophobicContact CB-CE2 4.22Å; K676-F678 HydrophobicContact CB-CE2 3.87Å; K676-F678 HydrophobicContact CB-CZ 4.1Å; K676-F678 WeakPolarHBondContact O-CE2 3.35Å; F678-L684 HydrophobicContact CD2-CB 4.18Å; F678-L684 HydrophobicContact CD2-CD1 4.04Å; F678-L684 HydrophobicContact CE2-CD1 4.19Å; F678-L684 HydrophobicContact CG-CB 4.43Å; F678-H687 HydrophobicContact CE1-CB 3.98Å; F678-H687 HydrophobicContact CE2-CB 4.09Å; F678-H687 AromaticContact CE2-CD2 3.27Å; F678-H687 WeakPolarHBondContact CE2-CD2 3.49Å; F678-H687 AromaticContact CE2-CG 3.8Å; F678-H687 AromaticContact CE2-NE2 4Å; F678-H687 HydrophobicContact CZ-CB 3.53Å; F678-H687 AromaticContact CZ-CD2 3.27Å; F678-H687 WeakPolarHBondContact CZ-CD2 3.49Å; F678-H687 AromaticContact CZ-CG 3.31Å; F678-H687 AromaticContact CZ-NE2 3.95Å
679	Q	61.6	Low	68.7	Low	115 Å²	115	77.4 Å²	77.4	54%	0.537	42%	0.422	S	S	.	.	S	Bend	trans	-126.4	-12.1	173.2	-69.8	173.8	-27.3	0	0	112.3	A668	A668-Q679 PolarHBondContact O-N 3.06Å
680	Y	67.1	Low	69.2	Low	156 Å²	156	79.7 Å²	79.7	61%	0.612	43%	0.43	S	S	*	.	S	Bend	trans	-145.5	138.5	-176.1	-55.8	-73.3	0	0	0	110.8	Y669 A682 S683 L684	Y669-Y680 VanDerWaalsContact CD2-C 3.42Å; Y680-A682 VanDerWaalsContact C-N 3.29Å; Y680-A682 PolarHBondContact O-N 2.76Å; Y680-S683 WeakPolarHBondContact O-CB 3.33Å; Y680-S683 PolarHBondContact O-N 3.33Å; Y680-L684 PolarHBondContact O-N 2.87Å
681	A	60.9	Low	69.7	Low	42 Å²	42	75.7 Å²	75.7	35%	0.347	41%	0.413	S	S	.	.	H	α-helix	trans	-57.4	-38.4	-178.1	0	0	0	0	0	113.2	Y669 S683 L684 Q685	Y669-A681 HydrophobicContact CD1-CB 4.04Å; Y669-A681 HydrophobicContact CD2-CB 4.3Å; Y669-A681 HydrophobicContact CE1-CB 3.83Å; Y669-A681 HydrophobicContact CE2-CB 4.1Å; Y669-A681 VanDerWaalsContact CE2-N 3.34Å; Y669-A681 HydrophobicContact CG-CB 4.28Å; A681-S683 VanDerWaalsContact C-N 3.27Å; A681-S683 PolarHBondContact O-N 2.88Å; A681-L684 WeakPolarHBondContact O-CB 3.37Å; A681-L684 PolarHBondContact O-N 3.29Å; A681-L684 VanDerWaalsContact O-N 3.13Å; A681-Q685 PolarHBondContact O-N 3.44Å
682	A	67.1	Low	69.5	Low	71 Å²	71	83.6 Å²	83.6	59%	0.587	45%	0.446	S	S	*	.	H	α-helix	trans	-61.6	-33.5	176.1	0	0	0	0	0	112.9	Y680 A686	Y680-A682 VanDerWaalsContact C-N 3.29Å; Y680-A682 PolarHBondContact O-N 2.76Å; A682-A686 VanDerWaalsContact O-CB 3.3Å; A682-A686 WeakPolarHBondContact O-CB 3.31Å; A682-A686 PolarHBondContact O-N 2.85Å
683	S	71.1	Confident	69.3	Low	54 Å²	54	83.6 Å²	83.6	38%	0.378	43%	0.434	S	S	.	.	H	α-helix	trans	-71.2	-37.9	174.6	-62.1	0	0	0	0	111.7	Y680 A681 H687	Y680-S683 WeakPolarHBondContact O-CB 3.33Å; Y680-S683 PolarHBondContact O-N 3.33Å; A681-S683 VanDerWaalsContact C-N 3.27Å; A681-S683 PolarHBondContact O-N 2.88Å; S683-H687 WeakPolarHBondContact O-CB 3.48Å; S683-H687 PolarHBondContact O-N 3.04Å
684	L	78.1	Confident	68.7	Low	24 Å²	24	84.2 Å²	84.2	13%	0.126	43%	0.434	C	S	.	.	H	α-helix	trans	-64.8	-46.7	172.6	172.8	59.7	0	0	0	111.4	K670 C671 F678 Y680 A681 A686 H687 L688	K670-L684 WeakPolarHBondContact O-CD2 3.32Å; C671-L684 HydrophobicContact CB-CD1 3.54Å; F678-L684 HydrophobicContact CD2-CB 4.18Å; F678-L684 HydrophobicContact CD2-CD1 4.04Å; F678-L684 HydrophobicContact CE2-CD1 4.19Å; F678-L684 HydrophobicContact CG-CB 4.43Å; Y680-L684 PolarHBondContact O-N 2.87Å; A681-L684 WeakPolarHBondContact O-CB 3.37Å; A681-L684 PolarHBondContact O-N 3.29Å; A681-L684 VanDerWaalsContact O-N 3.13Å; L684-A686 PolarHBondContact O-N 3.04Å; L684-H687 CarbonylContact O-C 3.3Å; L684-H687 WeakPolarHBondContact O-CA 3.33Å; L684-H687 WeakPolarHBondContact O-CB 3.44Å; L684-H687 PolarHBondContact O-N 3.27Å; L684-H687 VanDerWaalsContact O-N 3.07Å; L684-L688 HydrophobicContact CD1-CD1 3.94Å; L684-L688 HydrophobicContact CD1-CG 3.91Å; L684-L688 HydrophobicContact CG-CD1 3.91Å; L684-L688 HydrophobicContact CG-CG 4.35Å; L684-L688 WeakPolarHBondContact O-CG 3.29Å; L684-L688 PolarHBondContact O-N 2.96Å
685	Q	68.1	Low	68	Low	142 Å²	142	92.7 Å²	92.7	66%	0.664	46%	0.462	S	S	*	.	H	α-helix	trans	-60.4	-44.8	176.4	-74.8	-176.6	-20.9	0	0	112	A681 H687 L688 A689	A681-Q685 PolarHBondContact O-N 3.44Å; Q685-H687 PolarHBondContact O-N 2.8Å; Q685-L688 PolarHBondContact O-N 2.84Å; Q685-A689 WeakPolarHBondContact O-CB 3.22Å; Q685-A689 PolarHBondContact O-N 3.44Å
686	A	74.9	Confident	67.6	Low	63 Å²	63	92.1 Å²	92.1	52%	0.521	46%	0.458	S	S	.	.	H	α-helix	trans	-62.2	-28.4	174.7	0	0	0	0	0	112.9	A682 L684 R690	A682-A686 VanDerWaalsContact O-CB 3.3Å; A682-A686 WeakPolarHBondContact O-CB 3.31Å; A682-A686 PolarHBondContact O-N 2.85Å; L684-A686 PolarHBondContact O-N 3.04Å; A686-R690 WeakPolarHBondContact O-CG 3.04Å
687	H	77.1	Confident	66.6	Low	26 Å²	26	93 Å²	93	12%	0.12	46%	0.464	C	S	.	.	H	α-helix	trans	-79	-43.7	174.3	170.1	55.3	0	0	0	113.1	C671 C674 F678 S683 L684 Q685 A689 R690 H691	C671-H687 VanDerWaalsContact SG-CD2 3.52Å; C671-H687 PolarHBondContact SG-NE2 3.43Å; C671-H687 VanDerWaalsContact SG-NE2 3.38Å; C674-H687 PolarHBondContact SG-NE2 2.93Å; C674-H687 VanDerWaalsContact SG-NE2 3.41Å; F678-H687 HydrophobicContact CE1-CB 3.98Å; F678-H687 HydrophobicContact CE2-CB 4.09Å; F678-H687 AromaticContact CE2-CD2 3.27Å; F678-H687 WeakPolarHBondContact CE2-CD2 3.49Å; F678-H687 AromaticContact CE2-CG 3.8Å; F678-H687 AromaticContact CE2-NE2 4Å; F678-H687 HydrophobicContact CZ-CB 3.53Å; F678-H687 AromaticContact CZ-CD2 3.27Å; F678-H687 WeakPolarHBondContact CZ-CD2 3.49Å; F678-H687 AromaticContact CZ-CG 3.31Å; F678-H687 AromaticContact CZ-NE2 3.95Å; S683-H687 WeakPolarHBondContact O-CB 3.48Å; S683-H687 PolarHBondContact O-N 3.04Å; L684-H687 CarbonylContact O-C 3.3Å; L684-H687 WeakPolarHBondContact O-CA 3.33Å; L684-H687 WeakPolarHBondContact O-CB 3.44Å; L684-H687 PolarHBondContact O-N 3.27Å; L684-H687 VanDerWaalsContact O-N 3.07Å; Q685-H687 PolarHBondContact O-N 2.8Å; H687-A689 VanDerWaalsContact C-N 3.28Å; H687-A689 PolarHBondContact O-N 3.09Å; H687-R690 WeakPolarHBondContact O-CA 3.44Å; H687-R690 WeakPolarHBondContact O-CB 3.37Å; H687-R690 PolarHBondContact O-N 3.11Å; H687-H691 AromaticContact CE1-CD2 3.32Å; H687-H691 PolarHBondContact CE1-CD2 3.27Å; H687-H691 AromaticContact CE1-NE2 3.15Å; H687-H691 PolarHBondContact CE1-NE2 3.33Å; H687-H691 AromaticContact ND1-CD2 3.93Å; H687-H691 AromaticContact NE2-CD2 3.58Å; H687-H691 AromaticContact NE2-NE2 3.37Å; H687-H691 PolarHBondContact NE2-NE2 3.13Å; H687-H691 PolarHBondContact O-N 3.03Å
688	L	72.1	Confident	64.7	Low	55 Å²	55	99.2 Å²	99.2	29%	0.288	48%	0.484	S	S	.	.	H	α-helix	trans	-60.4	-37.5	174.8	-73.2	168.6	0	0	0	111.6	C671 L673 L684 Q685 R690 H691 K692	C671-L688 VanDerWaalsContact SG-CD2 3.56Å; L673-L688 HydrophobicContact CD1-CD2 4.03Å; L673-L688 HydrophobicContact CG-CD2 4.22Å; L684-L688 HydrophobicContact CD1-CD1 3.94Å; L684-L688 HydrophobicContact CD1-CG 3.91Å; L684-L688 HydrophobicContact CG-CD1 3.91Å; L684-L688 HydrophobicContact CG-CG 4.35Å; L684-L688 WeakPolarHBondContact O-CG 3.29Å; L684-L688 PolarHBondContact O-N 2.96Å; Q685-L688 PolarHBondContact O-N 2.84Å; L688-R690 PolarHBondContact O-N 3.34Å; L688-H691 WeakPolarHBondContact O-CB 3.31Å; L688-H691 PolarHBondContact O-N 3.26Å; L688-K692 PolarHBondContact O-N 3.01Å
689	A	74.4	Confident	62.9	Low	44 Å²	44	100.9 Å²	100.9	36%	0.364	51%	0.507	S	S	.	.	H	α-helix	trans	-57.7	-32.3	171.7	0	0	0	0	0	112.9	Q685 H687 Q693	Q685-A689 WeakPolarHBondContact O-CB 3.22Å; Q685-A689 PolarHBondContact O-N 3.44Å; H687-A689 VanDerWaalsContact C-N 3.28Å; H687-A689 PolarHBondContact O-N 3.09Å; A689-Q693 PolarHBondContact O-N 3.4Å; A689-Q693 VanDerWaalsContact O-N 3.11Å
690	R	69.7	Low	62	Low	174 Å²	174	100.6 Å²	100.6	66%	0.657	52%	0.517	S	S	*	.	H	α-helix	trans	-77.1	-31.4	175.4	-62.8	177.5	73	-170	2.4	112.4	A686 H687 L688 Q693 Q694	A686-R690 WeakPolarHBondContact O-CG 3.04Å; H687-R690 WeakPolarHBondContact O-CA 3.44Å; H687-R690 WeakPolarHBondContact O-CB 3.37Å; H687-R690 PolarHBondContact O-N 3.11Å; L688-R690 PolarHBondContact O-N 3.34Å; R690-Q693 PolarHBondContact O-N 3.31Å; R690-Q694 WeakPolarHBondContact O-CG 2.99Å; R690-Q694 PolarHBondContact O-N 3.42Å
691	H	75.1	Confident	60.5	Low	37 Å²	37	97.2 Å²	97.2	17%	0.171	52%	0.517	C	S	.	.	H	α-helix	trans	-63.6	-42.6	168.1	-85.7	-94	0	0	0	111.6	L673 C674 H687 L688 Q693 Q694 R695	L673-H691 HydrophobicContact CB-CB 4.41Å; L673-H691 HydrophobicContact CD1-CB 3.8Å; L673-H691 PolarHBondContact O-CE1 3.45Å; L673-H691 VanDerWaalsContact O-CE1 3.25Å; C674-H691 PolarHBondContact SG-NE2 2.89Å; H687-H691 AromaticContact CE1-CD2 3.32Å; H687-H691 PolarHBondContact CE1-CD2 3.27Å; H687-H691 AromaticContact CE1-NE2 3.15Å; H687-H691 PolarHBondContact CE1-NE2 3.33Å; H687-H691 AromaticContact ND1-CD2 3.93Å; H687-H691 AromaticContact NE2-CD2 3.58Å; H687-H691 AromaticContact NE2-NE2 3.37Å; H687-H691 PolarHBondContact NE2-NE2 3.13Å; H687-H691 PolarHBondContact O-N 3.03Å; L688-H691 WeakPolarHBondContact O-CB 3.31Å; L688-H691 PolarHBondContact O-N 3.26Å; H691-Q693 VanDerWaalsContact C-N 3.31Å; H691-Q693 PolarHBondContact O-N 2.81Å; H691-Q694 PolarHBondContact O-N 3.04Å; H691-R695 PolarHBondContact O-N 2.86Å
692	K	69.6	Low	59.1	Low	174 Å²	174	101.1 Å²	101.1	76%	0.757	54%	0.536	S	S	*	.	H	α-helix	trans	-58.7	-42.6	174.1	-167.4	169.8	-178	174.3	0	111.4	L688 R695 S696	L688-K692 PolarHBondContact O-N 3.01Å; K692-R695 PolarHBondContact O-N 3.48Å; K692-S696 PolarHBondContact O-N 3.27Å
693	Q	60.7	Low	57.8	Low	111 Å²	111	103.8 Å²	103.8	52%	0.519	55%	0.547	S	S	.	.	H	α-helix	trans	-67.2	-40.3	176.4	-163.4	171.2	21.9	0	0	113.3	A689 R690 H691 S696 Q697	A689-Q693 PolarHBondContact O-N 3.4Å; A689-Q693 VanDerWaalsContact O-N 3.11Å; R690-Q693 PolarHBondContact O-N 3.31Å; H691-Q693 VanDerWaalsContact C-N 3.31Å; H691-Q693 PolarHBondContact O-N 2.81Å; Q693-S696 PolarHBondContact O-N 3.46Å; Q693-Q697 WeakPolarHBondContact O-CG 3.34Å; Q693-Q697 PolarHBondContact O-N 3.45Å
694	Q	54.9	Low	55.8	Low	121 Å²	121	110.8 Å²	110.8	57%	0.565	57%	0.571	S	S	*	*	H	α-helix	trans	-69.7	-32.7	176.2	-74.5	-171.9	-59.2	0	0	113.3	R690 H691 Q697 R698	R690-Q694 WeakPolarHBondContact O-CG 2.99Å; R690-Q694 PolarHBondContact O-N 3.42Å; H691-Q694 PolarHBondContact O-N 3.04Å; Q694-Q697 PolarHBondContact O-N 3.06Å; Q694-R698 PolarHBondContact O-N 2.7Å
695	R	49.5	Very low	53.3	Low	207 Å²	207	114 Å²	114	78%	0.781	60%	0.601	S	S	*	*	H	α-helix	trans	-67.5	-40.3	174.7	-164.7	173.7	-178.4	-178.5	-0.4	111.3	H691 K692 R698 A699	H691-R695 PolarHBondContact O-N 2.86Å; K692-R695 PolarHBondContact O-N 3.48Å; R695-R698 PolarHBondContact O-N 2.76Å; R695-A699 PolarHBondContact O-N 2.96Å; R695-A699 VanDerWaalsContact O-N 3.11Å
696	S	49.6	Very low	51.5	Low	80 Å²	80	115.2 Å²	115.2	56%	0.559	61%	0.611	S	S	*	*	H	α-helix	trans	-59.7	-45	170.2	163.1	0	0	0	0	112.2	K692 Q693 R698 A699 S700	K692-S696 PolarHBondContact O-N 3.27Å; Q693-S696 PolarHBondContact O-N 3.46Å; S696-R698 VanDerWaalsContact C-N 3.33Å; S696-R698 PolarHBondContact O-N 2.82Å; S696-A699 PolarHBondContact O-N 3.17Å; S696-A699 VanDerWaalsContact O-N 3.16Å; S696-S700 PolarHBondContact O-N 2.58Å
697	Q	47.1	Very low	49.4	Very low	126 Å²	126	116.2 Å²	116.2	59%	0.589	62%	0.619	S	S	*	*	H	α-helix	trans	-66.9	-29.3	178.7	-73.8	177.9	-18.9	0	0	113.8	Q693 Q694	Q693-Q697 WeakPolarHBondContact O-CG 3.34Å; Q693-Q697 PolarHBondContact O-N 3.45Å; Q694-Q697 PolarHBondContact O-N 3.06Å
698	R	37.5	Very low	47	Very low	211 Å²	211	123.2 Å²	123.2	80%	0.796	65%	0.652	S	S	*	*	H	α-helix	trans	-76.2	-26.2	171.3	-86.2	-173.7	167.9	-175.5	-5.3	114	Q694 R695 S696 S700	Q694-R698 PolarHBondContact O-N 2.7Å; R695-R698 PolarHBondContact O-N 2.76Å; S696-R698 VanDerWaalsContact C-N 3.33Å; S696-R698 PolarHBondContact O-N 2.82Å; R698-S700 PolarHBondContact O-N 3.17Å
699	A	35.9	Very low	45.1	Very low	86 Å²	86	128.8 Å²	128.8	71%	0.711	68%	0.681	S	S	*	*	H	α-helix	trans	-73.2	-17	176.4	0	0	0	0	0	113.1	R695 S696	R695-A699 PolarHBondContact O-N 2.96Å; R695-A699 VanDerWaalsContact O-N 3.11Å; S696-A699 PolarHBondContact O-N 3.17Å; S696-A699 VanDerWaalsContact O-N 3.16Å
700	S	41.3	Very low	42.9	Very low	108 Å²	108	129.9 Å²	129.9	76%	0.755	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	9.8	-178.9	-170.1	0	0	0	0	114.2	S696 R698	S696-S700 PolarHBondContact O-N 2.58Å; R698-S700 PolarHBondContact O-N 3.17Å
701	S	37	Very low	41.4	Very low	86 Å²	86	127.7 Å²	127.7	60%	0.601	71%	0.705	S	S	*	*			trans	-145.2	71.2	-172	67.6	0	0	0	0	113.6
702	V	31.2	Very low	39.7	Very low	124 Å²	124	131.5 Å²	131.5	75%	0.752	73%	0.733	S	S	*	*			trans	-136.5	131	163.5	-176	0	0	0	0	107.8
703	P	39.2	Very low	37.6	Very low	126 Å²	126	129.6 Å²	129.6	82%	0.818	73%	0.727	S	S	*	*			trans	-73.7	153.2	175.8	-11.7	28	0	0	0	111.8
704	K	28.1	Very low	36	Very low	202 Å²	202	133.5 Å²	133.5	88%	0.878	74%	0.737	S	S	*	*			trans	-116.4	116.2	173.1	-172.6	-178.8	-178.5	-175.2	0	110.6
705	A	26.8	Very low	34.9	Very low	91 Å²	91	132.5 Å²	132.5	75%	0.752	75%	0.75	S	S	*	*			trans	-156.1	93.3	166.9	0	0	0	0	0	110
706	L	30.8	Very low	34	Very low	168 Å²	168	131.5 Å²	131.5	88%	0.88	75%	0.754	S	S	*	*			trans	-176.7	155.7	140.6	-121.1	80.1	0	0	0	108.5
707	A	29.9	Very low	33	Very low	84 Å²	84	135.1 Å²	135.1	69%	0.694	77%	0.767	S	S	*	*			trans	-105.9	-178.9	166.6	0	0	0	0	0	108.3
708	E	27.7	Very low	32.4	Very low	173 Å²	173	136.7 Å²	136.7	81%	0.808	77%	0.774	S	S	*	*			cis	-146.3	-165.7	20.8	-73.6	-164.2	109.2	0	0	112.4
709	L	32.1	Very low	32.5	Very low	171 Å²	171	133.4 Å²	133.4	90%	0.895	77%	0.771	S	S	*	*			trans	91.3	148.9	162.5	-50.8	-177.3	0	0	0	116.8
710	G	26.8	Very low	32.5	Very low	68 Å²	68	136.1 Å²	136.1	70%	0.701	77%	0.774	S	S	*	*			trans	-123.4	-169.1	-144.2	0	0	0	0	0	118.3
711	P	39.3	Very low	32.4	Very low	127 Å²	127	138 Å²	138	83%	0.825	78%	0.776	S	S	*	*			trans	-79.7	174.5	-173.1	37	-38.3	0	0	0	112.3
712	P	39.2	Very low	32.4	Very low	117 Å²	117	143.4 Å²	143.4	76%	0.76	79%	0.788	S	S	*	*			cis	-131.6	-163.6	28.1	37.1	-12.7	0	0	0	113.1
713	E	25.4	Very low	32.4	Very low	134 Å²	134	142.1 Å²	142.1	63%	0.626	79%	0.791	S	S	*	*			cis	-142.5	-174.3	24.9	-87.6	-147.6	149.2	0	0	114.8
714	R	27.7	Very low	31.9	Very low	194 Å²	194	140.7 Å²	140.7	73%	0.732	79%	0.79	S	S	*	*			trans	0.6	129.5	152.9	-59.9	169.3	177.3	114	7.9	116.8
715	A	31.2	Very low	32.2	Very low	100 Å²	100	136.3 Å²	136.3	83%	0.826	79%	0.791	S	S	*	*			cis	79.7	84.9	39.8	0	0	0	0	0	115
716	E	30.5	Very low	32.7	Very low	186 Å²	186	136.6 Å²	136.6	87%	0.869	79%	0.793	S	S	*	*			trans	-145.4	154.6	152.8	46.5	-164	111.1	0	0	112.1
717	N	28.6	Very low	32.9	Very low	156 Å²	156	132.9 Å²	132.9	83%	0.834	79%	0.787	S	S	*	*			trans	-82.9	178.5	-173.5	-46.6	-58.4	0	0	0	109.5
718	E	33.6	Very low	33.5	Very low	158 Å²	158	139.5 Å²	139.5	74%	0.738	80%	0.795	S	S	*	*			cis	-159.3	168.8	32.9	-94.9	-150.9	132.9	0	0	111.4
719	L	40.8	Very low	34	Very low	142 Å²	142	135.7 Å²	135.7	74%	0.743	78%	0.784	S	S	*	*			trans	48.9	131.4	149.2	-61	165.5	0	0	0	118.9
720	D	34.9	Very low	34.6	Very low	144 Å²	144	137.8 Å²	137.8	77%	0.77	78%	0.78	S	S	*	*				-165.1	135	70.2	-152.3	-9.5	0	0	0	112.9	K722	D720-K722 PolarHBondContact O-N 3.09Å
721	D	39.2	Very low	35.5	Very low	148 Å²	148	143.6 Å²	143.6	79%	0.791	78%	0.781	S	S	*	*			trans	-102	82.5	-166.8	-135	-32.8	0	0	0	112.1
722	K	37.3	Very low	36.4	Very low	198 Å²	198	143.2 Å²	143.2	86%	0.861	77%	0.768	S	S	*	*			trans	-156.5	31.4	-178.2	-114.8	143.2	-166	164.7	0	119.2	D720	D720-K722 PolarHBondContact O-N 3.09Å
723	A	30.3	Very low	37.9	Very low	98 Å²	98	140.1 Å²	140.1	81%	0.81	74%	0.743	S	S	*	*			trans	-129.3	-1.8	-178.5	0	0	0	0	0	117.2	A725	A723-A725 PolarHBondContact O-N 3.48Å
724	A	30.2	Very low	40	Very low	96 Å²	96	137 Å²	137	79%	0.793	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	-0.9	-162.8	0	0	0	0	0	117.4
725	A	34.3	Very low	42.3	Very low	109 Å²	109	127.7 Å²	127.7	90%	0.901	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	-1.7	-163.7	0	0	0	0	0	117.3	A723	A723-A725 PolarHBondContact O-N 3.48Å
726	A	37.4	Very low	44.1	Very low	97 Å²	97	129.1 Å²	129.1	80%	0.802	69%	0.692	S	S	*	*			trans	-116.1	9.1	-166.9	0	0	0	0	0	116.2	Y728	A726-Y728 PolarHBondContact O-N 2.92Å; A726-Y728 VanDerWaalsContact O-N 3.12Å
727	A	34.3	Very low	45.8	Very low	90 Å²	90	125.1 Å²	125.1	74%	0.744	68%	0.675	S	S	*	*			trans	-87.2	67.3	-176.3	0	0	0	0	0	113.4	T729	A727-T729 PolarHBondContact O-N 2.99Å
728	Y	41.8	Very low	47.5	Very low	223 Å²	223	120.2 Å²	120.2	88%	0.875	65%	0.652	S	S	*	*			trans	-58.5	113.6	-179.5	-161.7	-81.9	0	0	0	111.8	A726 R730	A726-Y728 PolarHBondContact O-N 2.92Å; A726-Y728 VanDerWaalsContact O-N 3.12Å; Y728-R730 PolarHBondContact O-N 3.34Å
729	T	38.9	Very low	49.4	Very low	94 Å²	94	115.5 Å²	115.5	58%	0.577	65%	0.646	S	S	*	*			trans	-65.3	124.8	-172.5	48.2	0	0	0	0	111.7	A727 R731	A727-T729 PolarHBondContact O-N 2.99Å; T729-R731 VanDerWaalsContact C-N 3.26Å; T729-R731 PolarHBondContact O-N 3.27Å
730	R	44.6	Very low	50.8	Low	215 Å²	215	113.8 Å²	113.8	81%	0.811	63%	0.633	S	S	*	*			trans	-73.6	84.8	167	-81.2	-169.5	175.3	-179.9	1.2	109.2	Y728 E732	Y728-R730 PolarHBondContact O-N 3.34Å; R730-E732 PolarHBondContact O-N 3.38Å
731	R	46.3	Very low	52.6	Low	189 Å²	189	110.8 Å²	110.8	71%	0.713	62%	0.62	S	S	*	*			trans	-56.3	108.3	167.7	-65.3	-178.5	179.7	-179.4	-2.5	108.7	T729 F733	T729-R731 VanDerWaalsContact C-N 3.26Å; T729-R731 PolarHBondContact O-N 3.27Å; R731-F733 HydrophobicContact CB-CE1 4.15Å; R731-F733 HydrophobicContact CB-CE2 3.89Å; R731-F733 HydrophobicContact CB-CZ 3.54Å; R731-F733 VanDerWaalsContact O-CD2 3.28Å; R731-F733 WeakPolarHBondContact O-CD2 3.27Å; R731-F733 WeakPolarHBondContact O-CE2 3.35Å
732	E	58	Low	54.6	Low	120 Å²	120	105.6 Å²	105.6	56%	0.561	59%	0.592	S	S	*	*			trans	-85.8	127.8	170.1	-60.3	-154.4	156.8	0	0	108.5	R730 V734 T741	R730-E732 PolarHBondContact O-N 3.38Å; E732-V734 PolarHBondContact O-N 3.46Å; E732-T741 HydrophobicContact CB-CG2 4.35Å
733	F	69.8	Low	56.4	Low	51 Å²	51	101 Å²	101	22%	0.224	58%	0.582	C	S	.	*	B	Isolated β-bridge	trans	-97	100.2	-172.4	-65.3	-77.8	0	0	0	109.3	R731 L742 L745 L748	R731-F733 HydrophobicContact CB-CE1 4.15Å; R731-F733 HydrophobicContact CB-CE2 3.89Å; R731-F733 HydrophobicContact CB-CZ 3.54Å; R731-F733 VanDerWaalsContact O-CD2 3.28Å; R731-F733 WeakPolarHBondContact O-CD2 3.27Å; R731-F733 WeakPolarHBondContact O-CE2 3.35Å; F733-L742 WeakPolarHBondContact CB-O 3.43Å; F733-L742 PolarHBondContact N-O 3.12Å; F733-L742 PolarHBondContact O-N 3.17Å; F733-L745 HydrophobicContact CD1-CD1 4.49Å; F733-L745 HydrophobicContact CD1-CD2 3.53Å; F733-L745 HydrophobicContact CD1-CG 3.65Å; F733-L745 HydrophobicContact CD2-CG 4.04Å; F733-L745 HydrophobicContact CE1-CD1 3.82Å; F733-L745 HydrophobicContact CE1-CD2 3.65Å; F733-L745 HydrophobicContact CE1-CG 3.45Å; F733-L745 VanDerWaalsContact CE1-CG 3.45Å; F733-L745 HydrophobicContact CE2-CD1 4.36Å; F733-L745 HydrophobicContact CE2-CG 3.85Å; F733-L745 HydrophobicContact CG-CD2 4.1Å; F733-L745 HydrophobicContact CG-CG 3.94Å; F733-L745 HydrophobicContact CZ-CD1 3.75Å; F733-L745 HydrophobicContact CZ-CD2 4.28Å; F733-L745 HydrophobicContact CZ-CG 3.56Å; F733-L748 HydrophobicContact CB-CB 4.08Å; F733-L748 HydrophobicContact CB-CD2 3.84Å
734	V	70.4	Confident	58.7	Low	68 Å²	68	103 Å²	103	41%	0.412	57%	0.573	S	S	.	*			trans	-66.3	150.2	175.6	-173.8	0	0	0	0	109.7	E732 K740 T741 L748	E732-V734 PolarHBondContact O-N 3.46Å; V734-K740 CarbonylContact C-O 3.53Å; V734-T741 HydrophobicContact CG2-CG2 3.95Å; V734-L748 WeakPolarHBondContact O-CD1 3.38Å; V734-L748 VanDerWaalsContact O-CD2 3.25Å; V734-L748 WeakPolarHBondContact O-CD2 3.45Å
735	C	76.1	Confident	60.8	Low	0 Å²	0	102.9 Å²	102.9	0%	0	56%	0.558	C	S	.	*			trans	-107.9	107.7	170.5	177.8	0	0	0	0	109.4	I737 C738 G739 K740 L748 M752 H755	C735-I737 PolarHBondContact O-N 3.11Å; C735-C738 CarbonylContact O-C 3.45Å; C735-C738 PolarHBondContact O-N 3.23Å; C735-G739 WeakPolarHBondContact O-CA 3.46Å; C735-G739 PolarHBondContact O-N 2.84Å; C735-K740 HydrophobicContact CB-CB 4.37Å; C735-K740 PolarHBondContact N-O 2.95Å; C735-L748 HydrophobicContact CB-CD1 3.49Å; C735-L748 VanDerWaalsContact CB-CD1 3.49Å; C735-M752 PolarHBondContact SG-SD 3.43Å; C735-H755 PolarHBondContact SG-CD2 2.92Å; C735-H755 PolarHBondContact SG-NE2 3.27Å
736	D	67.8	Low	62.8	Low	130 Å²	130	105.7 Å²	105.7	70%	0.695	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-34.3	-166.5	-34	-65.6	0	0	0	111.8	C738	D736-C738 VanDerWaalsContact C-N 3.29Å; D736-C738 PolarHBondContact O-N 3.26Å
737	I	67.3	Low	64.7	Low	102 Å²	102	103.1 Å²	103.1	52%	0.523	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-18.1	179.5	-57.3	173.2	0	0	0	112.8	C735 M752 H755	C735-I737 PolarHBondContact O-N 3.11Å; I737-M752 HydrophobicContact CD1-CE 3.66Å; I737-M752 HydrophobicContact CD1-SD 4.38Å; I737-M752 HydrophobicContact CG1-CE 4.21Å; I737-H755 HydrophobicContact CD1-CB 3.73Å; I737-H755 HydrophobicContact CG2-CB 4.09Å
738	C	64.9	Low	66.8	Low	52 Å²	52	100 Å²	100	35%	0.351	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-155.9	28.2	175.8	75	0	0	0	0	117.2	C735 D736 K740 H751 H755	C735-C738 CarbonylContact O-C 3.45Å; C735-C738 PolarHBondContact O-N 3.23Å; D736-C738 VanDerWaalsContact C-N 3.29Å; D736-C738 PolarHBondContact O-N 3.26Å; C738-K740 VanDerWaalsContact C-N 3.26Å; C738-K740 PolarHBondContact O-N 3Å; C738-K740 VanDerWaalsContact O-N 3.08Å; C738-K740 PolarHBondContact SG-NZ 2.99Å; C738-H751 PolarHBondContact SG-NE2 3.49Å; C738-H755 PolarHBondContact SG-CE1 3.41Å; C738-H755 PolarHBondContact SG-NE2 3.45Å; C738-H755 VanDerWaalsContact SG-NE2 3.38Å
739	G	72.3	Confident	68.4	Low	60 Å²	60	97.8 Å²	97.8	62%	0.619	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	19.4	171.8	0	0	0	0	0	117	C735	C735-G739 WeakPolarHBondContact O-CA 3.46Å; C735-G739 PolarHBondContact O-N 2.84Å
740	K	71.7	Confident	70	Confident	105 Å²	105	95 Å²	95	46%	0.457	47%	0.465	S	S	.	.			trans	-89.6	111.2	-176.7	-66.9	-161.6	-155.8	93.7	0	112	V734 C735 C738 L742 H751	V734-K740 CarbonylContact C-O 3.53Å; C735-K740 HydrophobicContact CB-CB 4.37Å; C735-K740 PolarHBondContact N-O 2.95Å; C738-K740 VanDerWaalsContact C-N 3.26Å; C738-K740 PolarHBondContact O-N 3Å; C738-K740 VanDerWaalsContact O-N 3.08Å; C738-K740 PolarHBondContact SG-NZ 2.99Å; K740-L742 PolarHBondContact O-N 2.91Å; K740-H751 PolarHBondContact NZ-CE1 3.11Å; K740-H751 VanDerWaalsContact NZ-CE1 3.26Å; K740-H751 PolarHBondContact NZ-NE2 3.39Å
741	T	71.4	Confident	71.5	Confident	82 Å²	82	85.8 Å²	85.8	50%	0.503	43%	0.431	S	S	.	.			trans	-62.3	129.8	163.8	44.6	0	0	0	0	110.7	E732 V734	E732-T741 HydrophobicContact CB-CG2 4.35Å; V734-T741 HydrophobicContact CG2-CG2 3.95Å
742	L	81.7	Confident	72.8	Confident	38 Å²	38	79.2 Å²	79.2	20%	0.199	41%	0.409	C	S	.	.	B	Isolated β-bridge	trans	-130.4	132.1	177.1	-71.3	171	0	0	0	109.8	F733 K740 K744 L748 H751	F733-L742 WeakPolarHBondContact CB-O 3.43Å; F733-L742 PolarHBondContact N-O 3.12Å; F733-L742 PolarHBondContact O-N 3.17Å; K740-L742 PolarHBondContact O-N 2.91Å; L742-K744 PolarHBondContact O-N 3.42Å; L742-L748 HydrophobicContact CD1-CB 4.4Å; L742-L748 HydrophobicContact CD1-CD1 4.44Å; L742-H751 HydrophobicContact CD1-CB 3.56Å
743	P	75.3	Confident	73.7	Confident	101 Å²	101	75.3 Å²	75.3	66%	0.656	39%	0.392	S	S	*	.	S	Bend	trans	-76.7	7.9	-167.8	31	-37.9	0	0	0	114.8
744	K	79.2	Confident	73.5	Confident	140 Å²	140	77 Å²	77	61%	0.609	41%	0.406	S	S	*	.	S	Bend	trans	-155	136.7	-179.8	-63.2	-167.5	177.3	-167.2	0	111.4	L742 Y746 S747 L748	L742-K744 PolarHBondContact O-N 3.42Å; K744-Y746 VanDerWaalsContact C-N 3.26Å; K744-Y746 PolarHBondContact O-N 3.16Å; K744-S747 WeakPolarHBondContact O-CA 3.19Å; K744-S747 WeakPolarHBondContact O-CB 3.45Å; K744-S747 PolarHBondContact O-N 3.48Å; K744-L748 PolarHBondContact O-N 2.75Å
745	L	72.5	Confident	73.3	Confident	95 Å²	95	76.6 Å²	76.6	50%	0.497	40%	0.4	S	S	.	.	H	α-helix	trans	-50.4	-41.2	171.3	-87.1	163	0	0	0	113.7	F733 S747 L748 R749	F733-L745 HydrophobicContact CD1-CD1 4.49Å; F733-L745 HydrophobicContact CD1-CD2 3.53Å; F733-L745 HydrophobicContact CD1-CG 3.65Å; F733-L745 HydrophobicContact CD2-CG 4.04Å; F733-L745 HydrophobicContact CE1-CD1 3.82Å; F733-L745 HydrophobicContact CE1-CD2 3.65Å; F733-L745 HydrophobicContact CE1-CG 3.45Å; F733-L745 VanDerWaalsContact CE1-CG 3.45Å; F733-L745 HydrophobicContact CE2-CD1 4.36Å; F733-L745 HydrophobicContact CE2-CG 3.85Å; F733-L745 HydrophobicContact CG-CD2 4.1Å; F733-L745 HydrophobicContact CG-CG 3.94Å; F733-L745 HydrophobicContact CZ-CD1 3.75Å; F733-L745 HydrophobicContact CZ-CD2 4.28Å; F733-L745 HydrophobicContact CZ-CG 3.56Å; L745-S747 VanDerWaalsContact C-N 3.29Å; L745-S747 PolarHBondContact O-N 3.32Å; L745-L748 PolarHBondContact O-N 2.76Å; L745-R749 WeakPolarHBondContact O-CB 3.45Å; L745-R749 PolarHBondContact O-N 3.07Å
746	Y	76.4	Confident	72.6	Confident	168 Å²	168	80.7 Å²	80.7	66%	0.659	43%	0.425	S	S	*	.	H	α-helix	trans	-62.2	-37.2	177.2	-179.9	-111	0	0	0	112.4	K744 I750	K744-Y746 VanDerWaalsContact C-N 3.26Å; K744-Y746 PolarHBondContact O-N 3.16Å; Y746-I750 HydrophobicContact CD1-CD1 3.97Å; Y746-I750 HydrophobicContact CD2-CD1 4.5Å; Y746-I750 HydrophobicContact CE1-CD1 3.44Å; Y746-I750 VanDerWaalsContact CE1-CD1 3.44Å; Y746-I750 HydrophobicContact CE2-CD1 4.03Å; Y746-I750 HydrophobicContact CG-CD1 4.48Å; Y746-I750 VanDerWaalsContact CZ-CD1 3.48Å; Y746-I750 WeakPolarHBondContact O-CB 3.45Å; Y746-I750 WeakPolarHBondContact O-CG1 3.39Å; Y746-I750 PolarHBondContact O-N 3.13Å
747	S	78.3	Confident	72.3	Confident	42 Å²	42	76.8 Å²	76.8	29%	0.294	42%	0.415	S	S	.	.	H	α-helix	trans	-69.6	-39.2	174.4	-58.6	0	0	0	0	111.6	K744 L745 H751	K744-S747 WeakPolarHBondContact O-CA 3.19Å; K744-S747 WeakPolarHBondContact O-CB 3.45Å; K744-S747 PolarHBondContact O-N 3.48Å; L745-S747 VanDerWaalsContact C-N 3.29Å; L745-S747 PolarHBondContact O-N 3.32Å; S747-H751 WeakPolarHBondContact O-CB 3.38Å; S747-H751 PolarHBondContact O-N 3.24Å
748	L	77.6	Confident	71.9	Confident	24 Å²	24	75.9 Å²	75.9	13%	0.126	41%	0.414	C	S	.	.	H	α-helix	trans	-62.9	-51.3	173.2	174.9	60.8	0	0	0	111.2	F733 V734 C735 L742 K744 L745 I750 H751 M752	F733-L748 HydrophobicContact CB-CB 4.08Å; F733-L748 HydrophobicContact CB-CD2 3.84Å; V734-L748 WeakPolarHBondContact O-CD1 3.38Å; V734-L748 VanDerWaalsContact O-CD2 3.25Å; V734-L748 WeakPolarHBondContact O-CD2 3.45Å; C735-L748 HydrophobicContact CB-CD1 3.49Å; C735-L748 VanDerWaalsContact CB-CD1 3.49Å; L742-L748 HydrophobicContact CD1-CB 4.4Å; L742-L748 HydrophobicContact CD1-CD1 4.44Å; K744-L748 PolarHBondContact O-N 2.75Å; L745-L748 PolarHBondContact O-N 2.76Å; L748-I750 VanDerWaalsContact C-N 3.26Å; L748-I750 PolarHBondContact O-N 2.96Å; L748-H751 CarbonylContact O-C 3.54Å; L748-H751 WeakPolarHBondContact O-CA 3.4Å; L748-H751 WeakPolarHBondContact O-CB 3.44Å; L748-H751 PolarHBondContact O-N 2.86Å; L748-M752 HydrophobicContact CD1-CG 4.11Å; L748-M752 HydrophobicContact CD1-SD 4.17Å; L748-M752 HydrophobicContact CG-CG 4.35Å; L748-M752 WeakPolarHBondContact O-CG 3.44Å; L748-M752 PolarHBondContact O-N 2.98Å
749	R	75.2	Confident	72.3	Confident	177 Å²	177	78.8 Å²	78.8	67%	0.668	42%	0.418	S	S	*	.	H	α-helix	trans	-55.3	-42.2	177.6	-169.8	179.1	-66.6	165.9	-1.7	111.7	L745 M752 L753	L745-R749 WeakPolarHBondContact O-CB 3.45Å; L745-R749 PolarHBondContact O-N 3.07Å; R749-M752 PolarHBondContact O-N 3.07Å; R749-L753 PolarHBondContact O-N 3.29Å
750	I	73.6	Confident	72.4	Confident	35 Å²	35	79.4 Å²	79.4	18%	0.179	41%	0.411	C	S	.	.	H	α-helix	trans	-62.9	-37.9	171.4	-85.5	175.3	0	0	0	112.8	Y746 L748 L753 H772	Y746-I750 HydrophobicContact CD1-CD1 3.97Å; Y746-I750 HydrophobicContact CD2-CD1 4.5Å; Y746-I750 HydrophobicContact CE1-CD1 3.44Å; Y746-I750 VanDerWaalsContact CE1-CD1 3.44Å; Y746-I750 HydrophobicContact CE2-CD1 4.03Å; Y746-I750 HydrophobicContact CG-CD1 4.48Å; Y746-I750 VanDerWaalsContact CZ-CD1 3.48Å; Y746-I750 WeakPolarHBondContact O-CB 3.45Å; Y746-I750 WeakPolarHBondContact O-CG1 3.39Å; Y746-I750 PolarHBondContact O-N 3.13Å; L748-I750 VanDerWaalsContact C-N 3.26Å; L748-I750 PolarHBondContact O-N 2.96Å; I750-L753 WeakPolarHBondContact O-CB 3.39Å; I750-H772 WeakPolarHBondContact CG2-CE1 3.5Å
751	H	76.3	Confident	72.6	Confident	23 Å²	23	77.3 Å²	77.3	11%	0.106	40%	0.402	C	S	.	.	H	α-helix	trans	-70.1	-37.1	176.2	-173.7	12.1	0	0	0	111.7	C738 K740 L742 S747 L748 L753 T754 H755	C738-H751 PolarHBondContact SG-NE2 3.49Å; K740-H751 PolarHBondContact NZ-CE1 3.11Å; K740-H751 VanDerWaalsContact NZ-CE1 3.26Å; K740-H751 PolarHBondContact NZ-NE2 3.39Å; L742-H751 HydrophobicContact CD1-CB 3.56Å; S747-H751 WeakPolarHBondContact O-CB 3.38Å; S747-H751 PolarHBondContact O-N 3.24Å; L748-H751 CarbonylContact O-C 3.54Å; L748-H751 WeakPolarHBondContact O-CA 3.4Å; L748-H751 WeakPolarHBondContact O-CB 3.44Å; L748-H751 PolarHBondContact O-N 2.86Å; H751-L753 VanDerWaalsContact C-N 3.27Å; H751-L753 PolarHBondContact O-N 2.91Å; H751-T754 PolarHBondContact CE1-OG1 3.41Å; H751-T754 PolarHBondContact ND1-OG1 3.43Å; H751-T754 WeakPolarHBondContact O-CA 3.26Å; H751-T754 WeakPolarHBondContact O-CB 3.22Å; H751-T754 PolarHBondContact O-N 2.89Å; H751-T754 PolarHBondContact O-OG1 3.19Å; H751-H755 AromaticContact CE1-CD2 3.98Å; H751-H755 AromaticContact CE1-CE1 3.69Å; H751-H755 AromaticContact CE1-NE2 3.27Å; H751-H755 PolarHBondContact CE1-NE2 3.46Å; H751-H755 VanDerWaalsContact CE1-NE2 3.27Å; H751-H755 AromaticContact ND1-NE2 3.95Å; H751-H755 AromaticContact NE2-NE2 3.6Å
752	M	72.6	Confident	72.8	Confident	50 Å²	50	77.3 Å²	77.3	25%	0.246	40%	0.402	C	S	.	.	H	α-helix	trans	-61	-34.8	176	-63.7	-56.4	-86.1	0	0	112	C735 I737 L748 R749 T754 H755 T756	C735-M752 PolarHBondContact SG-SD 3.43Å; I737-M752 HydrophobicContact CD1-CE 3.66Å; I737-M752 HydrophobicContact CD1-SD 4.38Å; I737-M752 HydrophobicContact CG1-CE 4.21Å; L748-M752 HydrophobicContact CD1-CG 4.11Å; L748-M752 HydrophobicContact CD1-SD 4.17Å; L748-M752 HydrophobicContact CG-CG 4.35Å; L748-M752 WeakPolarHBondContact O-CG 3.44Å; L748-M752 PolarHBondContact O-N 2.98Å; R749-M752 PolarHBondContact O-N 3.07Å; M752-T754 PolarHBondContact O-N 3.38Å; M752-T754 VanDerWaalsContact O-N 3.08Å; M752-H755 PolarHBondContact O-N 3.25Å; M752-T756 PolarHBondContact O-N 3.26Å; M752-T756 PolarHBondContact O-OG1 3.44Å
753	L	76.9	Confident	72.9	Confident	38 Å²	38	75.7 Å²	75.7	20%	0.199	39%	0.394	C	S	.	.	H	α-helix	trans	-59.1	-18.5	170.1	-62.4	174.5	0	0	0	114	R749 I750 H751 V758 P760 A771	R749-L753 PolarHBondContact O-N 3.29Å; I750-L753 WeakPolarHBondContact O-CB 3.39Å; H751-L753 VanDerWaalsContact C-N 3.27Å; H751-L753 PolarHBondContact O-N 2.91Å; L753-V758 HydrophobicContact CD2-CB 4.22Å; L753-V758 HydrophobicContact CD2-CG1 4.36Å; L753-P760 HydrophobicContact CD1-CG 4.39Å; L753-P760 HydrophobicContact CD2-CG 4.22Å; L753-A771 HydrophobicContact CB-CB 4.33Å
754	T	66.4	Low	72.8	Confident	86 Å²	86	80.8 Å²	80.8	53%	0.528	41%	0.406	S	S	.	.	H	α-helix	trans	-86	-15.6	173.7	71.2	0	0	0	0	113.7	H751 M752	H751-T754 PolarHBondContact CE1-OG1 3.41Å; H751-T754 PolarHBondContact ND1-OG1 3.43Å; H751-T754 WeakPolarHBondContact O-CA 3.26Å; H751-T754 WeakPolarHBondContact O-CB 3.22Å; H751-T754 PolarHBondContact O-N 2.89Å; H751-T754 PolarHBondContact O-OG1 3.19Å; M752-T754 PolarHBondContact O-N 3.38Å; M752-T754 VanDerWaalsContact O-N 3.08Å
755	H	66.1	Low	72.6	Confident	61 Å²	61	78.8 Å²	78.8	28%	0.282	41%	0.405	S	S	.	.	H	α-helix	trans	-96.8	-47.2	175.3	-64.4	-53.7	0	0	0	111.7	C735 I737 C738 H751 M752 G757	C735-H755 PolarHBondContact SG-CD2 2.92Å; C735-H755 PolarHBondContact SG-NE2 3.27Å; I737-H755 HydrophobicContact CD1-CB 3.73Å; I737-H755 HydrophobicContact CG2-CB 4.09Å; C738-H755 PolarHBondContact SG-CE1 3.41Å; C738-H755 PolarHBondContact SG-NE2 3.45Å; C738-H755 VanDerWaalsContact SG-NE2 3.38Å; H751-H755 AromaticContact CE1-CD2 3.98Å; H751-H755 AromaticContact CE1-CE1 3.69Å; H751-H755 AromaticContact CE1-NE2 3.27Å; H751-H755 PolarHBondContact CE1-NE2 3.46Å; H751-H755 VanDerWaalsContact CE1-NE2 3.27Å; H751-H755 AromaticContact ND1-NE2 3.95Å; H751-H755 AromaticContact NE2-NE2 3.6Å; M752-H755 PolarHBondContact O-N 3.25Å; H755-G757 PolarHBondContact O-N 3.48Å
756	T	60.4	Low	72.7	Confident	85 Å²	85	76.7 Å²	76.7	52%	0.521	40%	0.398	S	S	.	.	S	Bend	trans	-70	-13.2	177.2	63.5	0	0	0	0	113.2	M752 V758	M752-T756 PolarHBondContact O-N 3.26Å; M752-T756 PolarHBondContact O-OG1 3.44Å; T756-V758 PolarHBondContact O-N 2.91Å
757	G	61.7	Low	72.6	Confident	48 Å²	48	71.3 Å²	71.3	50%	0.495	39%	0.394	S	S	.	.			trans	70.9	-8.6	-177.6	0	0	0	0	0	114.8	H755 R759	H755-G757 PolarHBondContact O-N 3.48Å; G757-R759 WeakPolarHBondContact O-CG 3.43Å; G757-R759 PolarHBondContact O-N 3.19Å
758	V	59.8	Low	72.5	Confident	83 Å²	83	75.3 Å²	75.3	50%	0.503	41%	0.406	S	S	.	.			trans	-63.8	126	178	-179	0	0	0	0	109.5	L753 T756 P760	L753-V758 HydrophobicContact CD2-CB 4.22Å; L753-V758 HydrophobicContact CD2-CG1 4.36Å; T756-V758 PolarHBondContact O-N 2.91Å; V758-P760 HydrophobicContact CG1-CG 4.31Å
759	R	73.4	Confident	72.4	Confident	114 Å²	114	76.9 Å²	76.9	43%	0.43	42%	0.417	S	S	.	.			trans	-129.9	80.9	-173	-74.8	165.1	74.2	101.6	1.3	109.3	G757 H761 T769 F770	G757-R759 WeakPolarHBondContact O-CG 3.43Å; G757-R759 PolarHBondContact O-N 3.19Å; R759-H761 PolarHBondContact O-N 2.91Å; R759-T769 WeakPolarHBondContact CB-OG1 3.48Å; R759-T769 WeakPolarHBondContact CD-OG1 3.42Å; R759-T769 VanDerWaalsContact CZ-O 3.22Å; R759-T769 PolarHBondContact NE-O 3.15Å; R759-T769 PolarHBondContact NE-OG1 3.42Å; R759-T769 PolarHBondContact NH2-O 3.25Å; R759-T769 WeakPolarHBondContact O-CB 3.28Å; R759-F770 CarbonylContact C-O 3.58Å; R759-F770 VanDerWaalsContact C-O 3.23Å
760	P	74.6	Confident	72.7	Confident	72 Å²	72	70.1 Å²	70.1	47%	0.468	39%	0.392	S	S	.	.	B	Isolated β-bridge	trans	-61.1	-21.2	-163.5	-26	35.1	0	0	0	115.6	L753 V758 T762	L753-P760 HydrophobicContact CD1-CG 4.39Å; L753-P760 HydrophobicContact CD2-CG 4.22Å; V758-P760 HydrophobicContact CG1-CG 4.31Å; P760-T762 PolarHBondContact O-N 2.73Å
761	H	75.9	Confident	72.8	Confident	61 Å²	61	69.1 Å²	69.1	28%	0.282	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	88.7	-172.2	-58.7	-57	0	0	0	111	R759 T769 F770 K773 L776	R759-H761 PolarHBondContact O-N 2.91Å; H761-T769 CarbonylContact O-C 3.6Å; H761-F770 HydrophobicContact CB-CB 4.36Å; H761-F770 WeakPolarHBondContact CB-O 3.25Å; H761-F770 PolarHBondContact N-O 3.46Å; H761-F770 PolarHBondContact O-N 3.03Å; H761-K773 PolarHBondContact CD2-N 3.07Å; H761-K773 PolarHBondContact NE2-N 3.27Å; H761-L776 HydrophobicContact CB-CB 3.87Å; H761-L776 HydrophobicContact CB-CD2 3.76Å; H761-L776 HydrophobicContact CB-CG 4.38Å
762	T	75.8	Confident	72.9	Confident	82 Å²	82	71.7 Å²	71.7	50%	0.503	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	145	178.7	70.5	0	0	0	0	112.2	P760 T769 L776	P760-T762 PolarHBondContact O-N 2.73Å; T762-T769 HydrophobicContact CG2-CG2 3.96Å; T762-L776 WeakPolarHBondContact O-CD2 3.23Å
763	C	82.8	Confident	73.1	Confident	4 Å²	4	77 Å²	77	3%	0.027	42%	0.423	C	S	.	.			trans	-90.5	113.3	171.9	-173	0	0	0	0	110.8	V765 C766 G767 K768 L776 H779 H783	C763-V765 PolarHBondContact O-N 3.44Å; C763-V765 VanDerWaalsContact O-N 3.09Å; C763-C766 PolarHBondContact O-N 2.85Å; C763-G767 WeakPolarHBondContact O-CA 3.29Å; C763-G767 PolarHBondContact O-N 3.14Å; C763-K768 WeakPolarHBondContact CB-O 3.38Å; C763-K768 PolarHBondContact N-O 3.02Å; C763-L776 HydrophobicContact CB-CD1 3.82Å; C763-H779 PolarHBondContact SG-CD2 3.01Å; C763-H779 PolarHBondContact SG-NE2 3.46Å; C763-H779 VanDerWaalsContact SG-NE2 3.43Å; C763-H783 PolarHBondContact SG-NE2 3.19Å; C763-H783 VanDerWaalsContact SG-NE2 3.39Å
764	K	73.6	Confident	73.1	Confident	208 Å²	208	81.3 Å²	81.3	90%	0.904	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-23.3	176.7	-65.7	-166.1	174.4	-167.5	0	114.2
765	V	73.9	Confident	73.7	Confident	98 Å²	98	79.2 Å²	79.2	59%	0.594	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-28.8	-175	-172.1	0	0	0	0	113.4	C763 H783	C763-V765 PolarHBondContact O-N 3.44Å; C763-V765 VanDerWaalsContact O-N 3.09Å; V765-H783 HydrophobicContact CB-CB 4.39Å; V765-H783 HydrophobicContact CG1-CB 4.06Å; V765-H783 HydrophobicContact CG2-CB 4.36Å
766	C	74.4	Confident	74.4	Confident	51 Å²	51	77.4 Å²	77.4	35%	0.345	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.8	24	-178.8	79.6	0	0	0	0	115.2	C763 K768 H779 H783	C763-C766 PolarHBondContact O-N 2.85Å; C766-K768 PolarHBondContact O-N 3.27Å; C766-H779 PolarHBondContact SG-NE2 3Å; C766-H783 PolarHBondContact SG-CE1 3.25Å
767	G	75.4	Confident	75.3	Confident	56 Å²	56	80.1 Å²	80.1	58%	0.577	43%	0.427	S	S	*	.			trans	67.9	-17.1	174.8	0	0	0	0	0	116.7	C763 T769	C763-G767 WeakPolarHBondContact O-CA 3.29Å; C763-G767 PolarHBondContact O-N 3.14Å; G767-T769 PolarHBondContact O-N 3.24Å
768	K	75.3	Confident	75.9	Confident	126 Å²	126	82 Å²	82	55%	0.548	43%	0.425	S	S	.	.			trans	-59.1	125.1	-174.4	-71.2	173.3	-169.3	159.5	0	111.2	C763 C766 F770	C763-K768 WeakPolarHBondContact CB-O 3.38Å; C763-K768 PolarHBondContact N-O 3.02Å; C766-K768 PolarHBondContact O-N 3.27Å; K768-F770 HydrophobicContact CB-CE2 3.74Å; K768-F770 HydrophobicContact CB-CZ 4.01Å; K768-F770 WeakPolarHBondContact O-CD2 3.48Å; K768-F770 VanDerWaalsContact O-CE2 3.23Å; K768-F770 WeakPolarHBondContact O-CE2 3.07Å
769	T	77.1	Confident	76.8	Confident	57 Å²	57	78.8 Å²	78.8	35%	0.35	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	149.9	-177.9	66.2	0	0	0	0	110.9	R759 H761 T762 G767	R759-T769 WeakPolarHBondContact CB-OG1 3.48Å; R759-T769 WeakPolarHBondContact CD-OG1 3.42Å; R759-T769 VanDerWaalsContact CZ-O 3.22Å; R759-T769 PolarHBondContact NE-O 3.15Å; R759-T769 PolarHBondContact NE-OG1 3.42Å; R759-T769 PolarHBondContact NH2-O 3.25Å; R759-T769 WeakPolarHBondContact O-CB 3.28Å; H761-T769 CarbonylContact O-C 3.6Å; T762-T769 HydrophobicContact CG2-CG2 3.96Å; G767-T769 PolarHBondContact O-N 3.24Å
770	F	79.6	Confident	76.9	Confident	35 Å²	35	80.1 Å²	80.1	15%	0.154	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	146.7	-179.6	-63.6	-89.3	0	0	0	112.4	R759 H761 K768 H772 L776 H779	R759-F770 CarbonylContact C-O 3.58Å; R759-F770 VanDerWaalsContact C-O 3.23Å; H761-F770 HydrophobicContact CB-CB 4.36Å; H761-F770 WeakPolarHBondContact CB-O 3.25Å; H761-F770 PolarHBondContact N-O 3.46Å; H761-F770 PolarHBondContact O-N 3.03Å; K768-F770 HydrophobicContact CB-CE2 3.74Å; K768-F770 HydrophobicContact CB-CZ 4.01Å; K768-F770 WeakPolarHBondContact O-CD2 3.48Å; K768-F770 VanDerWaalsContact O-CE2 3.23Å; K768-F770 WeakPolarHBondContact O-CE2 3.07Å; F770-H772 VanDerWaalsContact C-N 3.35Å; F770-L776 HydrophobicContact CB-CB 4.38Å; F770-L776 HydrophobicContact CD2-CB 4.37Å; F770-L776 HydrophobicContact CD2-CD1 4Å; F770-L776 HydrophobicContact CE2-CD1 4.42Å; F770-H779 HydrophobicContact CD2-CB 4.46Å; F770-H779 HydrophobicContact CE1-CB 4.08Å; F770-H779 HydrophobicContact CE2-CB 3.78Å; F770-H779 AromaticContact CE2-CD2 3.24Å; F770-H779 WeakPolarHBondContact CE2-CD2 3.38Å; F770-H779 AromaticContact CE2-CG 3.39Å; F770-H779 AromaticContact CE2-NE2 3.89Å; F770-H779 HydrophobicContact CZ-CB 3.57Å; F770-H779 AromaticContact CZ-CD2 3.57Å; F770-H779 AromaticContact CZ-CG 3.23Å; F770-H779 AromaticContact CZ-ND1 3.6Å
771	A	77.5	Confident	76.8	Confident	14 Å²	14	78.8 Å²	78.8	12%	0.116	40%	0.399	C	S	.	.	S	Bend	trans	-78.5	-13.9	177	0	0	0	0	0	113.9	L753	L753-A771 HydrophobicContact CB-CB 4.33Å
772	H	78.3	Confident	76.3	Confident	76 Å²	76	79.4 Å²	79.4	35%	0.352	40%	0.404	S	S	.	.			trans	-131.8	138.7	179.7	-43.8	-90.3	0	0	0	112.4	I750 F770 H774 S775 L776	I750-H772 WeakPolarHBondContact CG2-CE1 3.5Å; F770-H772 VanDerWaalsContact C-N 3.35Å; H772-H774 PolarHBondContact O-N 3.13Å; H772-S775 PolarHBondContact CD2-OG 3.44Å; H772-S775 PolarHBondContact O-N 2.91Å; H772-S775 VanDerWaalsContact O-N 3.09Å; H772-L776 PolarHBondContact O-N 3.49Å
773	K	76.1	Confident	76	Confident	163 Å²	163	78.2 Å²	78.2	71%	0.709	39%	0.393	S	S	*	.	H	α-helix	trans	-58.2	-34.7	172.6	-165.6	173.7	-177.6	176.9	0	112.2	H761 L776 K777	H761-K773 PolarHBondContact CD2-N 3.07Å; H761-K773 PolarHBondContact NE2-N 3.27Å; K773-L776 PolarHBondContact O-N 2.88Å; K773-K777 PolarHBondContact O-N 3.12Å
774	H	76.8	Confident	75.3	Confident	128 Å²	128	81.9 Å²	81.9	59%	0.593	41%	0.412	S	S	*	.	H	α-helix	trans	-66.4	-44.4	173.1	176.5	75.8	0	0	0	112.4	H772 L776 K777 M778	H772-H774 PolarHBondContact O-N 3.13Å; H774-L776 VanDerWaalsContact C-N 3.32Å; H774-L776 PolarHBondContact O-N 3.49Å; H774-K777 PolarHBondContact O-N 3.1Å; H774-K777 VanDerWaalsContact O-N 3.09Å; H774-M778 WeakPolarHBondContact O-CG 3.34Å; H774-M778 PolarHBondContact O-N 3Å
775	S	78.8	Confident	74.6	Confident	41 Å²	41	77.4 Å²	77.4	29%	0.287	40%	0.402	S	S	.	.	H	α-helix	trans	-63.7	-36.9	175.3	-56.5	0	0	0	0	112	H772 H779	H772-S775 PolarHBondContact CD2-OG 3.44Å; H772-S775 PolarHBondContact O-N 2.91Å; H772-S775 VanDerWaalsContact O-N 3.09Å; S775-H779 WeakPolarHBondContact O-CB 3.15Å; S775-H779 PolarHBondContact O-N 3.25Å
776	L	81.1	Confident	73.6	Confident	23 Å²	23	78.8 Å²	78.8	12%	0.12	41%	0.411	C	S	.	.	H	α-helix	trans	-63.7	-42.4	169.8	177.4	62.8	0	0	0	111.6	H761 T762 C763 F770 H772 K773 H774 H779 R780	H761-L776 HydrophobicContact CB-CB 3.87Å; H761-L776 HydrophobicContact CB-CD2 3.76Å; H761-L776 HydrophobicContact CB-CG 4.38Å; T762-L776 WeakPolarHBondContact O-CD2 3.23Å; C763-L776 HydrophobicContact CB-CD1 3.82Å; F770-L776 HydrophobicContact CB-CB 4.38Å; F770-L776 HydrophobicContact CD2-CB 4.37Å; F770-L776 HydrophobicContact CD2-CD1 4Å; F770-L776 HydrophobicContact CE2-CD1 4.42Å; H772-L776 PolarHBondContact O-N 3.49Å; K773-L776 PolarHBondContact O-N 2.88Å; H774-L776 VanDerWaalsContact C-N 3.32Å; H774-L776 PolarHBondContact O-N 3.49Å; L776-H779 CarbonylContact O-C 3.57Å; L776-H779 PolarHBondContact O-N 3.18Å; L776-R780 HydrophobicContact CD1-CG 4.17Å; L776-R780 HydrophobicContact CG-CG 4.43Å; L776-R780 WeakPolarHBondContact O-CG 3.44Å; L776-R780 PolarHBondContact O-N 2.97Å
777	K	79.5	Confident	72.7	Confident	143 Å²	143	84.3 Å²	84.3	62%	0.622	43%	0.429	S	S	*	.	H	α-helix	trans	-60.8	-47.6	176.8	-170	173.6	-177.6	177.1	0	111.5	K773 H774 H779 R780 V781	K773-K777 PolarHBondContact O-N 3.12Å; H774-K777 PolarHBondContact O-N 3.1Å; H774-K777 VanDerWaalsContact O-N 3.09Å; K777-H779 VanDerWaalsContact C-N 3.26Å; K777-H779 PolarHBondContact O-N 3.41Å; K777-R780 PolarHBondContact O-N 2.67Å; K777-R780 VanDerWaalsContact O-N 3.15Å; K777-V781 WeakPolarHBondContact O-CG2 3.45Å; K777-V781 PolarHBondContact O-N 2.9Å
778	M	75.1	Confident	72.2	Confident	88 Å²	88	84.6 Å²	84.6	43%	0.433	42%	0.415	S	S	.	.	H	α-helix	trans	-66	-27	175.3	-63.8	-66.7	91.9	0	0	113.1	H774 V781	H774-M778 WeakPolarHBondContact O-CG 3.34Å; H774-M778 PolarHBondContact O-N 3Å; M778-V781 HydrophobicContact CE-CG2 4.4Å
779	H	77.2	Confident	71.9	Confident	14 Å²	14	82.6 Å²	82.6	7%	0.065	41%	0.407	C	S	.	.	H	α-helix	trans	-76.7	-32.1	171.2	176.5	63.2	0	0	0	113.1	C763 C766 F770 S775 L776 K777 V781 L782 H783	C763-H779 PolarHBondContact SG-CD2 3.01Å; C763-H779 PolarHBondContact SG-NE2 3.46Å; C763-H779 VanDerWaalsContact SG-NE2 3.43Å; C766-H779 PolarHBondContact SG-NE2 3Å; F770-H779 HydrophobicContact CD2-CB 4.46Å; F770-H779 HydrophobicContact CE1-CB 4.08Å; F770-H779 HydrophobicContact CE2-CB 3.78Å; F770-H779 AromaticContact CE2-CD2 3.24Å; F770-H779 WeakPolarHBondContact CE2-CD2 3.38Å; F770-H779 AromaticContact CE2-CG 3.39Å; F770-H779 AromaticContact CE2-NE2 3.89Å; F770-H779 HydrophobicContact CZ-CB 3.57Å; F770-H779 AromaticContact CZ-CD2 3.57Å; F770-H779 AromaticContact CZ-CG 3.23Å; F770-H779 AromaticContact CZ-ND1 3.6Å; S775-H779 WeakPolarHBondContact O-CB 3.15Å; S775-H779 PolarHBondContact O-N 3.25Å; L776-H779 CarbonylContact O-C 3.57Å; L776-H779 PolarHBondContact O-N 3.18Å; K777-H779 VanDerWaalsContact C-N 3.26Å; K777-H779 PolarHBondContact O-N 3.41Å; H779-V781 VanDerWaalsContact C-N 3.32Å; H779-L782 VanDerWaalsContact ND1-CD1 3.26Å; H779-L782 WeakPolarHBondContact ND1-CD1 3.46Å; H779-L782 VanDerWaalsContact O-CB 3.22Å; H779-L782 WeakPolarHBondContact O-CB 3.14Å; H779-L782 VanDerWaalsContact O-CG 3.29Å; H779-L782 WeakPolarHBondContact O-CG 3.42Å; H779-L782 PolarHBondContact O-N 3.39Å; H779-L782 VanDerWaalsContact O-N 3.09Å; H779-H783 AromaticContact CD2-NE2 3.89Å; H779-H783 AromaticContact CE1-NE2 3.47Å; H779-H783 PolarHBondContact CE1-NE2 3.41Å; H779-H783 AromaticContact NE2-NE2 3.12Å; H779-H783 PolarHBondContact NE2-NE2 2.84Å; H779-H783 VanDerWaalsContact NE2-NE2 3.12Å
780	R	75.3	Confident	71.8	Confident	143 Å²	143	84.8 Å²	84.8	54%	0.54	41%	0.413	S	S	.	.	H	α-helix	trans	-66	-35.6	174.7	-75.4	-177.3	67.8	172.7	-0.1	112.1	L776 K777 L782 H783 D784	L776-R780 HydrophobicContact CD1-CG 4.17Å; L776-R780 HydrophobicContact CG-CG 4.43Å; L776-R780 WeakPolarHBondContact O-CG 3.44Å; L776-R780 PolarHBondContact O-N 2.97Å; K777-R780 PolarHBondContact O-N 2.67Å; K777-R780 VanDerWaalsContact O-N 3.15Å; R780-L782 PolarHBondContact O-N 2.96Å; R780-H783 WeakPolarHBondContact O-CB 3.43Å; R780-H783 PolarHBondContact O-N 2.83Å; R780-D784 PolarHBondContact O-N 2.94Å; R780-D784 VanDerWaalsContact O-N 3.16Å
781	V	73	Confident	71.7	Confident	43 Å²	43	83.1 Å²	83.1	26%	0.261	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-8.8	170.6	179.3	0	0	0	0	113.5	K777 M778 H779 V799	K777-V781 WeakPolarHBondContact O-CG2 3.45Å; K777-V781 PolarHBondContact O-N 2.9Å; M778-V781 HydrophobicContact CE-CG2 4.4Å; H779-V781 VanDerWaalsContact C-N 3.32Å; V781-V799 HydrophobicContact CB-CG1 4.32Å; V781-V799 HydrophobicContact CG1-CG1 3.93Å
782	L	66.5	Low	71.5	Confident	75 Å²	75	89.6 Å²	89.6	39%	0.393	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-31	166.5	-55	-175.3	0	0	0	113.2	H779 R780 Q788 V799	H779-L782 VanDerWaalsContact ND1-CD1 3.26Å; H779-L782 WeakPolarHBondContact ND1-CD1 3.46Å; H779-L782 VanDerWaalsContact O-CB 3.22Å; H779-L782 WeakPolarHBondContact O-CB 3.14Å; H779-L782 VanDerWaalsContact O-CG 3.29Å; H779-L782 WeakPolarHBondContact O-CG 3.42Å; H779-L782 PolarHBondContact O-N 3.39Å; H779-L782 VanDerWaalsContact O-N 3.09Å; R780-L782 PolarHBondContact O-N 2.96Å; L782-Q788 PolarHBondContact O-NE2 3.25Å; L782-Q788 VanDerWaalsContact O-NE2 3.12Å; L782-V799 HydrophobicContact CD2-CB 4.03Å; L782-V799 HydrophobicContact CD2-CG1 3.61Å; L782-V799 HydrophobicContact CD2-CG2 3.25Å
783	H	69.4	Low	71.3	Confident	56 Å²	56	92.7 Å²	92.7	26%	0.259	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-25.8	-177.9	-55.8	-66.3	0	0	0	111.5	C763 V765 C766 H779 R780 V785	C763-H783 PolarHBondContact SG-NE2 3.19Å; C763-H783 VanDerWaalsContact SG-NE2 3.39Å; V765-H783 HydrophobicContact CB-CB 4.39Å; V765-H783 HydrophobicContact CG1-CB 4.06Å; V765-H783 HydrophobicContact CG2-CB 4.36Å; C766-H783 PolarHBondContact SG-CE1 3.25Å; H779-H783 AromaticContact CD2-NE2 3.89Å; H779-H783 AromaticContact CE1-NE2 3.47Å; H779-H783 PolarHBondContact CE1-NE2 3.41Å; H779-H783 AromaticContact NE2-NE2 3.12Å; H779-H783 PolarHBondContact NE2-NE2 2.84Å; H779-H783 VanDerWaalsContact NE2-NE2 3.12Å; R780-H783 WeakPolarHBondContact O-CB 3.43Å; R780-H783 PolarHBondContact O-N 2.83Å; H783-V785 VanDerWaalsContact C-N 3.32Å; H783-V785 WeakPolarHBondContact O-CG2 3.45Å; H783-V785 PolarHBondContact O-N 3.47Å
784	D	66.8	Low	71.4	Confident	82 Å²	82	86.9 Å²	86.9	44%	0.439	42%	0.423	S	S	.	.			trans	-71	85.6	170.8	-53.7	-40.4	0	0	0	109.3	R780 T786	R780-D784 PolarHBondContact O-N 2.94Å; R780-D784 VanDerWaalsContact O-N 3.16Å; D784-T786 PolarHBondContact O-N 3.24Å
785	V	59.3	Low	71.2	Confident	114 Å²	114	88.5 Å²	88.5	69%	0.691	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-57	-22.9	-172.9	-173.5	0	0	0	0	113.4	H783 K787	H783-V785 VanDerWaalsContact C-N 3.32Å; H783-V785 WeakPolarHBondContact O-CG2 3.45Å; H783-V785 PolarHBondContact O-N 3.47Å; V785-K787 VanDerWaalsContact C-N 3.34Å; V785-K787 PolarHBondContact O-N 2.84Å
786	T	53.5	Low	70.9	Confident	127 Å²	127	91.9 Å²	91.9	78%	0.779	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-72.5	-11.4	-167	55.4	0	0	0	0	116.2	D784	D784-T786 PolarHBondContact O-N 3.24Å
787	K	55.7	Low	70.6	Confident	167 Å²	167	94.1 Å²	94.1	73%	0.726	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-138.3	51.3	-180	-66.5	-168	177.2	-177.4	0	113.9	V785	V785-K787 VanDerWaalsContact C-N 3.34Å; V785-K787 PolarHBondContact O-N 2.84Å
788	Q	64.9	Low	70.3	Confident	61 Å²	61	89.4 Å²	89.4	29%	0.285	43%	0.432	S	S	.	.			trans	-98.3	123.5	174.1	-51.2	-171.3	5.1	0	0	111.8	L782 Q790 T797	L782-Q788 PolarHBondContact O-NE2 3.25Å; L782-Q788 VanDerWaalsContact O-NE2 3.12Å; Q788-Q790 PolarHBondContact O-N 2.89Å; Q788-T797 HydrophobicContact CB-CG2 4.25Å; Q788-T797 PolarHBondContact OE1-OG1 2.84Å
789	F	68	Low	70.2	Confident	84 Å²	84	88.1 Å²	88.1	37%	0.368	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	106	177.4	-63.3	-90.8	0	0	0	109.5	F798 S800 K801 M804	F789-F798 PolarHBondContact N-O 3.38Å; F789-F798 WeakPolarHBondContact O-CB 3.45Å; F789-F798 PolarHBondContact O-N 3.22Å; F789-S800 VanDerWaalsContact CD2-C 3.49Å; F789-K801 HydrophobicContact CD1-CB 3.96Å; F789-K801 HydrophobicContact CD1-CG 3.99Å; F789-K801 VanDerWaalsContact CD2-N 3.3Å; F789-K801 HydrophobicContact CE1-CB 3.72Å; F789-K801 HydrophobicContact CE1-CG 3.91Å; F789-K801 HydrophobicContact CE2-CB 4.3Å; F789-K801 HydrophobicContact CG-CB 4.35Å; F789-K801 HydrophobicContact CZ-CB 3.91Å; F789-M804 HydrophobicContact CB-CB 3.76Å; F789-M804 HydrophobicContact CB-CG 3.93Å
790	Q	74.9	Confident	70	Confident	104 Å²	104	90.1 Å²	90.1	49%	0.486	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	138.8	177.3	-166.6	168.8	51	0	0	111	Q788 K795 K796 T797	Q788-Q790 PolarHBondContact O-N 2.89Å; Q790-K795 PolarHBondContact NE2-O 2.75Å; Q790-K796 WeakPolarHBondContact CA-O 3.33Å; Q790-T797 HydrophobicContact CB-CG2 4.32Å; Q790-T797 HydrophobicContact CG-CG2 4.28Å
791	C	78.6	Confident	70	Confident	0 Å²	0	88.9 Å²	88.9	0%	0	44%	0.443	C	S	.	.			trans	-83.6	114	169.5	171.5	0	0	0	0	109.7	Y793 C794 K795 K796 F798 M804 T808	C791-Y793 VanDerWaalsContact C-N 3.33Å; C791-Y793 PolarHBondContact O-N 3.28Å; C791-C794 PolarHBondContact O-N 2.85Å; C791-K795 WeakPolarHBondContact O-CA 3.44Å; C791-K795 PolarHBondContact O-N 3.43Å; C791-K796 PolarHBondContact N-O 3.39Å; C791-F798 HydrophobicContact CB-CD2 4.37Å; C791-F798 HydrophobicContact CB-CE2 3.89Å; C791-M804 HydrophobicContact CB-CG 4.46Å; C791-T808 HydrophobicContact CB-CG2 4.4Å
792	E	73.8	Confident	70.1	Confident	150 Å²	150	96.2 Å²	96.2	70%	0.701	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.7	-51.3	-179.7	-66.4	142.4	-174.8	0	0	112.2	C794	E792-C794 VanDerWaalsContact C-N 3.29Å; E792-C794 PolarHBondContact O-N 3.45Å
793	Y	73.9	Confident	70.5	Confident	140 Å²	140	94.8 Å²	94.8	55%	0.549	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-17.5	-174.9	-58.9	-75.4	0	0	0	116.1	C791 T808 H811 T812	C791-Y793 VanDerWaalsContact C-N 3.33Å; C791-Y793 PolarHBondContact O-N 3.28Å; Y793-T808 HydrophobicContact CD2-CG2 4.31Å; Y793-H811 HydrophobicContact CD2-CB 3.94Å; Y793-H811 HydrophobicContact CG-CB 3.87Å; Y793-T812 HydrophobicContact CE2-CG2 4.02Å
794	C	77.8	Confident	71.1	Confident	42 Å²	42	93.3 Å²	93.3	28%	0.284	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.4	14.3	-179.1	74.7	0	0	0	0	116.4	C791 E792 K796 H807 H811	C791-C794 PolarHBondContact O-N 2.85Å; E792-C794 VanDerWaalsContact C-N 3.29Å; E792-C794 PolarHBondContact O-N 3.45Å; C794-K796 PolarHBondContact O-N 3.16Å; C794-H807 PolarHBondContact SG-NE2 2.84Å; C794-H811 VanDerWaalsContact SG-CE1 3.59Å; C794-H811 PolarHBondContact SG-NE2 3.28Å
795	K	72.9	Confident	71.4	Confident	162 Å²	162	93 Å²	93	70%	0.704	45%	0.451	S	S	*	.			trans	57	7.8	175.6	-58.8	-171.8	178	-173.1	0	116.5	Q790 C791	Q790-K795 PolarHBondContact NE2-O 2.75Å; C791-K795 WeakPolarHBondContact O-CA 3.44Å; C791-K795 PolarHBondContact O-N 3.43Å
796	K	72.3	Confident	72.3	Confident	111 Å²	111	90.3 Å²	90.3	48%	0.483	43%	0.431	S	S	.	.			trans	-69.5	135.1	173.5	-69.3	175.5	-163.6	142.3	0	110.7	Q790 C791 C794 F798	Q790-K796 WeakPolarHBondContact CA-O 3.33Å; C791-K796 PolarHBondContact N-O 3.39Å; C794-K796 PolarHBondContact O-N 3.16Å; K796-F798 HydrophobicContact CB-CE2 3.65Å; K796-F798 HydrophobicContact CB-CZ 3.96Å; K796-F798 WeakPolarHBondContact O-CD2 3.04Å; K796-F798 WeakPolarHBondContact O-CE2 3.15Å
797	T	73.3	Confident	73.5	Confident	71 Å²	71	85.5 Å²	85.5	44%	0.436	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	145.5	178.7	55.7	0	0	0	0	112.1	Q788 Q790	Q788-T797 HydrophobicContact CB-CG2 4.25Å; Q788-T797 PolarHBondContact OE1-OG1 2.84Å; Q790-T797 HydrophobicContact CB-CG2 4.32Å; Q790-T797 HydrophobicContact CG-CG2 4.28Å
798	F	75.1	Confident	74.5	Confident	43 Å²	43	78.7 Å²	78.7	19%	0.189	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	143.6	-175.9	-65.6	-87.4	0	0	0	112.1	F789 C791 K796 S800 M804 H807	F789-F798 PolarHBondContact N-O 3.38Å; F789-F798 WeakPolarHBondContact O-CB 3.45Å; F789-F798 PolarHBondContact O-N 3.22Å; C791-F798 HydrophobicContact CB-CD2 4.37Å; C791-F798 HydrophobicContact CB-CE2 3.89Å; K796-F798 HydrophobicContact CB-CE2 3.65Å; K796-F798 HydrophobicContact CB-CZ 3.96Å; K796-F798 WeakPolarHBondContact O-CD2 3.04Å; K796-F798 WeakPolarHBondContact O-CE2 3.15Å; F798-S800 PolarHBondContact O-N 2.88Å; F798-M804 HydrophobicContact CB-CB 3.99Å; F798-M804 HydrophobicContact CD2-CB 4.16Å; F798-M804 HydrophobicContact CD2-CG 4.11Å; F798-M804 HydrophobicContact CG-CB 4.24Å; F798-H807 HydrophobicContact CE1-CB 3.96Å; F798-H807 HydrophobicContact CE2-CB 3.93Å; F798-H807 AromaticContact CE2-CD2 3.4Å; F798-H807 WeakPolarHBondContact CE2-CD2 3.32Å; F798-H807 AromaticContact CE2-CG 3.78Å; F798-H807 HydrophobicContact CZ-CB 3.55Å; F798-H807 AromaticContact CZ-CD2 3.27Å; F798-H807 WeakPolarHBondContact CZ-CD2 3.46Å; F798-H807 AromaticContact CZ-CG 3.29Å
799	V	71.1	Confident	74.9	Confident	61 Å²	61	76.2 Å²	76.2	37%	0.37	36%	0.362	S	S	.	.	S	Bend	trans	-66	-19.7	-177.6	-146	0	0	0	0	114.4	V781 L782	V781-V799 HydrophobicContact CB-CG1 4.32Å; V781-V799 HydrophobicContact CG1-CG1 3.93Å; L782-V799 HydrophobicContact CD2-CB 4.03Å; L782-V799 HydrophobicContact CD2-CG1 3.61Å; L782-V799 HydrophobicContact CD2-CG2 3.25Å
800	S	73.8	Confident	75.1	Confident	56 Å²	56	76.9 Å²	76.9	39%	0.392	37%	0.369	S	S	.	.	S	Bend	trans	-151.8	138	-167.2	-178.4	0	0	0	0	109.8	F789 F798 R802 S803 M804	F789-S800 VanDerWaalsContact CD2-C 3.49Å; F798-S800 PolarHBondContact O-N 2.88Å; S800-R802 PolarHBondContact O-N 3.03Å; S800-R802 VanDerWaalsContact O-N 3.16Å; S800-S803 PolarHBondContact O-N 2.89Å; S800-S803 PolarHBondContact O-OG 2.87Å; S800-M804 PolarHBondContact O-N 2.87Å
801	K	75.2	Confident	74.9	Confident	117 Å²	117	75.7 Å²	75.7	51%	0.509	36%	0.363	S	S	.	.	H	α-helix	trans	-50.5	-41.8	175.9	-158.5	-169.7	175.6	-174.5	0	111.5	F789 S803 M804 E805	F789-K801 HydrophobicContact CD1-CB 3.96Å; F789-K801 HydrophobicContact CD1-CG 3.99Å; F789-K801 VanDerWaalsContact CD2-N 3.3Å; F789-K801 HydrophobicContact CE1-CB 3.72Å; F789-K801 HydrophobicContact CE1-CG 3.91Å; F789-K801 HydrophobicContact CE2-CB 4.3Å; F789-K801 HydrophobicContact CG-CB 4.35Å; F789-K801 HydrophobicContact CZ-CB 3.91Å; K801-S803 PolarHBondContact O-N 3.16Å; K801-M804 CarbonylContact O-C 3.55Å; K801-M804 WeakPolarHBondContact O-CB 3.32Å; K801-M804 PolarHBondContact O-N 3.19Å; K801-E805 VanDerWaalsContact CD-OE1 3.25Å; K801-E805 WeakPolarHBondContact CD-OE1 3.3Å; K801-E805 WeakPolarHBondContact CE-OE1 3.26Å; K801-E805 HydrophobicContact CG-CG 4.42Å; K801-E805 VanDerWaalsContact CG-OE1 3.32Å; K801-E805 WeakPolarHBondContact CG-OE1 3.23Å; K801-E805 IonicContact NZ-OE1 3.76Å; K801-E805 WeakPolarHBondContact O-CB 3.49Å; K801-E805 VanDerWaalsContact O-CG 3.27Å; K801-E805 WeakPolarHBondContact O-CG 3.38Å; K801-E805 PolarHBondContact O-N 3.09Å
802	R	74.6	Confident	74.4	Confident	198 Å²	198	78.5 Å²	78.5	75%	0.747	38%	0.38	S	S	*	.	H	α-helix	trans	-61.8	-35.9	178.1	-176.2	177.4	178.8	170.9	4.4	114.1	S800 E806	S800-R802 PolarHBondContact O-N 3.03Å; S800-R802 VanDerWaalsContact O-N 3.16Å; R802-E806 WeakPolarHBondContact O-CB 3.45Å; R802-E806 PolarHBondContact O-N 3.08Å
803	S	75.4	Confident	73.9	Confident	44 Å²	44	73.7 Å²	73.7	31%	0.308	37%	0.371	S	S	.	.	H	α-helix	trans	-82.9	-23.6	176.9	54.1	0	0	0	0	112.7	S800 K801 H807	S800-S803 PolarHBondContact O-N 2.89Å; S800-S803 PolarHBondContact O-OG 2.87Å; K801-S803 PolarHBondContact O-N 3.16Å; S803-H807 WeakPolarHBondContact O-CB 3.42Å; S803-H807 PolarHBondContact O-N 3.44Å
804	M	81.4	Confident	73.3	Confident	25 Å²	25	73.1 Å²	73.1	12%	0.123	37%	0.373	C	S	.	.	H	α-helix	trans	-68.1	-50	166.1	-167.7	-82.2	-71.1	0	0	111	F789 C791 F798 S800 K801 E806 H807 T808	F789-M804 HydrophobicContact CB-CB 3.76Å; F789-M804 HydrophobicContact CB-CG 3.93Å; C791-M804 HydrophobicContact CB-CG 4.46Å; F798-M804 HydrophobicContact CB-CB 3.99Å; F798-M804 HydrophobicContact CD2-CB 4.16Å; F798-M804 HydrophobicContact CD2-CG 4.11Å; F798-M804 HydrophobicContact CG-CB 4.24Å; S800-M804 PolarHBondContact O-N 2.87Å; K801-M804 CarbonylContact O-C 3.55Å; K801-M804 WeakPolarHBondContact O-CB 3.32Å; K801-M804 PolarHBondContact O-N 3.19Å; M804-E806 PolarHBondContact O-N 3.32Å; M804-H807 CarbonylContact O-C 3.55Å; M804-H807 WeakPolarHBondContact O-CA 3.43Å; M804-H807 WeakPolarHBondContact O-CB 3.46Å; M804-H807 PolarHBondContact O-N 3.06Å; M804-T808 PolarHBondContact O-N 2.99Å; M804-T808 PolarHBondContact O-OG1 2.97Å; M804-T808 HydrophobicContact SD-CG2 3.48Å; M804-T808 WeakPolarHBondContact SD-CG2 3.35Å
805	E	74.1	Confident	72.6	Confident	75 Å²	75	72 Å²	72	35%	0.35	37%	0.366	S	S	.	.	H	α-helix	trans	-58.5	-41.1	176	-73.2	166	-168	0	0	112.9	K801 H807 T808 S809	K801-E805 VanDerWaalsContact CD-OE1 3.25Å; K801-E805 WeakPolarHBondContact CD-OE1 3.3Å; K801-E805 WeakPolarHBondContact CE-OE1 3.26Å; K801-E805 HydrophobicContact CG-CG 4.42Å; K801-E805 VanDerWaalsContact CG-OE1 3.32Å; K801-E805 WeakPolarHBondContact CG-OE1 3.23Å; K801-E805 IonicContact NZ-OE1 3.76Å; K801-E805 WeakPolarHBondContact O-CB 3.49Å; K801-E805 VanDerWaalsContact O-CG 3.27Å; K801-E805 WeakPolarHBondContact O-CG 3.38Å; K801-E805 PolarHBondContact O-N 3.09Å; E805-H807 PolarHBondContact O-N 3.01Å; E805-T808 WeakPolarHBondContact CA-OG1 3.46Å; E805-T808 PolarHBondContact O-OG1 3.45Å; E805-T808 VanDerWaalsContact O-OG1 3.12Å; E805-S809 PolarHBondContact O-N 3.41Å
806	E	77.1	Confident	72.4	Confident	58 Å²	58	71.5 Å²	71.5	27%	0.271	36%	0.364	S	S	.	.	H	α-helix	trans	-65.1	-33	173.5	-160.2	-157.9	88.8	0	0	111.1	R802 M804 S809 R828	R802-E806 WeakPolarHBondContact O-CB 3.45Å; R802-E806 PolarHBondContact O-N 3.08Å; M804-E806 PolarHBondContact O-N 3.32Å; E806-S809 PolarHBondContact O-OG 2.98Å; E806-R828 HydrophobicContact CG-CG 4.3Å; E806-R828 IonicContact OE1-CZ 2.74Å; E806-R828 IonicContact OE1-NE 3.86Å; E806-R828 PolarHBondContact OE1-NE 2.74Å; E806-R828 IonicContact OE1-NH2 3.14Å; E806-R828 PolarHBondContact OE1-NH2 3.31Å; E806-R828 WeakPolarHBondContact OE2-CD 3.37Å; E806-R828 VanDerWaalsContact OE2-CG 3.29Å; E806-R828 WeakPolarHBondContact OE2-CG 3.46Å; E806-R828 IonicContact OE2-CZ 3.69Å; E806-R828 IonicContact OE2-NE 3.82Å; E806-R828 PolarHBondContact OE2-NE 3.22Å; E806-R828 IonicContact OE2-NH2 2.69Å
807	H	79.5	Confident	72.3	Confident	26 Å²	26	70.5 Å²	70.5	12%	0.12	36%	0.358	C	S	.	.	H	α-helix	trans	-78.1	-39.6	177.1	-171.7	55.8	0	0	0	113.9	C794 F798 S803 M804 E805 S809 L810 H811	C794-H807 PolarHBondContact SG-NE2 2.84Å; F798-H807 HydrophobicContact CE1-CB 3.96Å; F798-H807 HydrophobicContact CE2-CB 3.93Å; F798-H807 AromaticContact CE2-CD2 3.4Å; F798-H807 WeakPolarHBondContact CE2-CD2 3.32Å; F798-H807 AromaticContact CE2-CG 3.78Å; F798-H807 HydrophobicContact CZ-CB 3.55Å; F798-H807 AromaticContact CZ-CD2 3.27Å; F798-H807 WeakPolarHBondContact CZ-CD2 3.46Å; F798-H807 AromaticContact CZ-CG 3.29Å; S803-H807 WeakPolarHBondContact O-CB 3.42Å; S803-H807 PolarHBondContact O-N 3.44Å; M804-H807 CarbonylContact O-C 3.55Å; M804-H807 WeakPolarHBondContact O-CA 3.43Å; M804-H807 WeakPolarHBondContact O-CB 3.46Å; M804-H807 PolarHBondContact O-N 3.06Å; E805-H807 PolarHBondContact O-N 3.01Å; H807-S809 VanDerWaalsContact C-N 3.25Å; H807-S809 PolarHBondContact O-N 3.05Å; H807-L810 VanDerWaalsContact O-CB 3.31Å; H807-L810 WeakPolarHBondContact O-CB 3.24Å; H807-L810 PolarHBondContact O-N 3.38Å; H807-H811 AromaticContact CD2-NE2 3.66Å; H807-H811 AromaticContact CE1-NE2 3.55Å; H807-H811 AromaticContact NE2-CD2 3.91Å; H807-H811 AromaticContact NE2-NE2 3.03Å; H807-H811 PolarHBondContact NE2-NE2 2.74Å; H807-H811 PolarHBondContact O-CD2 3.09Å
808	T	77.8	Confident	72.5	Confident	24 Å²	24	72 Å²	72	15%	0.147	36%	0.362	C	S	.	.	H	α-helix	trans	-62.7	-34.5	175.1	48	0	0	0	0	111.4	C791 Y793 M804 E805 L810 H811 T812	C791-T808 HydrophobicContact CB-CG2 4.4Å; Y793-T808 HydrophobicContact CD2-CG2 4.31Å; M804-T808 PolarHBondContact O-N 2.99Å; M804-T808 PolarHBondContact O-OG1 2.97Å; M804-T808 HydrophobicContact SD-CG2 3.48Å; M804-T808 WeakPolarHBondContact SD-CG2 3.35Å; E805-T808 WeakPolarHBondContact CA-OG1 3.46Å; E805-T808 PolarHBondContact O-OG1 3.45Å; E805-T808 VanDerWaalsContact O-OG1 3.12Å; T808-L810 PolarHBondContact O-N 3.05Å; T808-L810 VanDerWaalsContact O-N 3.08Å; T808-H811 WeakPolarHBondContact O-CA 3.48Å; T808-H811 PolarHBondContact O-N 3.37Å; T808-T812 PolarHBondContact O-N 3.04Å
809	S	73.2	Confident	72.9	Confident	9 Å²	9	70 Å²	70	6%	0.063	35%	0.353	C	S	.	.	H	α-helix	trans	-60.9	-18.3	173.4	80.2	0	0	0	0	114.4	E805 E806 H807 G813 H827	E805-S809 PolarHBondContact O-N 3.41Å; E806-S809 PolarHBondContact O-OG 2.98Å; H807-S809 VanDerWaalsContact C-N 3.25Å; H807-S809 PolarHBondContact O-N 3.05Å; S809-G813 WeakPolarHBondContact O-CA 3.46Å; S809-G813 PolarHBondContact O-N 3.38Å; S809-G813 VanDerWaalsContact O-N 3.12Å; S809-H827 PolarHBondContact O-CE1 3.48Å; S809-H827 PolarHBondContact O-ND1 3.17Å; S809-H827 PolarHBondContact OG-ND1 2.93Å
810	L	70.8	Confident	73	Confident	99 Å²	99	74.7 Å²	74.7	52%	0.518	38%	0.377	S	S	.	.	H	α-helix	trans	-80.5	-14.9	172	-62.8	166.4	0	0	0	113.2	H807 T808 H827	H807-L810 VanDerWaalsContact O-CB 3.31Å; H807-L810 WeakPolarHBondContact O-CB 3.24Å; H807-L810 PolarHBondContact O-N 3.38Å; T808-L810 PolarHBondContact O-N 3.05Å; T808-L810 VanDerWaalsContact O-N 3.08Å; L810-H827 VanDerWaalsContact CD2-CD2 3.43Å; L810-H827 WeakPolarHBondContact CD2-CD2 3.22Å
811	H	71.1	Confident	72.9	Confident	79 Å²	79	76.5 Å²	76.5	37%	0.366	39%	0.385	S	S	.	.	H	α-helix	trans	-98.8	-42.9	175	-61.2	-80.3	0	0	0	111.5	Y793 C794 H807 T808 G813	Y793-H811 HydrophobicContact CD2-CB 3.94Å; Y793-H811 HydrophobicContact CG-CB 3.87Å; C794-H811 VanDerWaalsContact SG-CE1 3.59Å; C794-H811 PolarHBondContact SG-NE2 3.28Å; H807-H811 AromaticContact CD2-NE2 3.66Å; H807-H811 AromaticContact CE1-NE2 3.55Å; H807-H811 AromaticContact NE2-CD2 3.91Å; H807-H811 AromaticContact NE2-NE2 3.03Å; H807-H811 PolarHBondContact NE2-NE2 2.74Å; H807-H811 PolarHBondContact O-CD2 3.09Å; T808-H811 WeakPolarHBondContact O-CA 3.48Å; T808-H811 PolarHBondContact O-N 3.37Å; H811-G813 VanDerWaalsContact C-N 3.28Å; H811-G813 PolarHBondContact O-N 2.95Å
812	T	67.4	Low	73	Confident	58 Å²	58	74.1 Å²	74.1	36%	0.356	38%	0.383	S	S	.	.	H	α-helix	trans	-74	-19.4	175.2	65.3	0	0	0	0	112.8	Y793 T808 E814	Y793-T812 HydrophobicContact CE2-CG2 4.02Å; T808-T812 PolarHBondContact O-N 3.04Å; T812-E814 VanDerWaalsContact CB-OE2 3.28Å; T812-E814 WeakPolarHBondContact CB-OE2 3.32Å; T812-E814 PolarHBondContact O-N 3.08Å; T812-E814 WeakPolarHBondContact OG1-CG 3.44Å; T812-E814 PolarHBondContact OG1-OE2 3.04Å
813	G	64.5	Low	73.1	Confident	49 Å²	49	67.5 Å²	67.5	51%	0.505	38%	0.377	S	S	.	.			trans	78.1	-2.5	-177.5	0	0	0	0	0	114.3	S809 H811 S815	S809-G813 WeakPolarHBondContact O-CA 3.46Å; S809-G813 PolarHBondContact O-N 3.38Å; S809-G813 VanDerWaalsContact O-N 3.12Å; H811-G813 VanDerWaalsContact C-N 3.28Å; H811-G813 PolarHBondContact O-N 2.95Å; G813-S815 VanDerWaalsContact C-N 3.34Å; G813-S815 PolarHBondContact O-N 2.89Å
814	E	62	Low	73.1	Confident	128 Å²	128	66.7 Å²	66.7	60%	0.598	37%	0.373	S	S	*	.			trans	-71	80.4	-175.3	-62.9	170.1	122.6	0	0	112.2	T812 K816	T812-E814 VanDerWaalsContact CB-OE2 3.28Å; T812-E814 WeakPolarHBondContact CB-OE2 3.32Å; T812-E814 PolarHBondContact O-N 3.08Å; T812-E814 WeakPolarHBondContact OG1-CG 3.44Å; T812-E814 PolarHBondContact OG1-OE2 3.04Å; E814-K816 PolarHBondContact O-N 2.93Å; E814-K816 VanDerWaalsContact O-N 3.13Å
815	S	62.2	Low	72.9	Confident	18 Å²	18	69.4 Å²	69.4	13%	0.126	39%	0.391	C	S	.	.			trans	-73.7	105.4	176.2	68.7	0	0	0	0	111.2	G813 Y817 L818 T825 F826	G813-S815 VanDerWaalsContact C-N 3.34Å; G813-S815 PolarHBondContact O-N 2.89Å; S815-Y817 PolarHBondContact O-N 2.89Å; S815-L818 WeakPolarHBondContact OG-CD2 3.35Å; S815-T825 WeakPolarHBondContact OG-CB 3.27Å; S815-T825 VanDerWaalsContact OG-CG2 3.26Å; S815-T825 WeakPolarHBondContact OG-CG2 3.32Å; S815-F826 WeakPolarHBondContact CB-O 3.22Å
816	K	68.9	Low	73.1	Confident	152 Å²	152	67.7 Å²	67.7	66%	0.661	38%	0.382	S	S	*	.	S	Bend	trans	-63.9	-3.9	177.4	-59.7	-174.6	-179.6	-177.7	0	114.4	E814	E814-K816 PolarHBondContact O-N 2.93Å; E814-K816 VanDerWaalsContact O-N 3.13Å
817	Y	70.5	Confident	73	Confident	91 Å²	91	67.4 Å²	67.4	36%	0.357	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	105.5	-179.6	-53.3	-74.4	0	0	0	111.5	S815 F826 R828 A829	S815-Y817 PolarHBondContact O-N 2.89Å; Y817-F826 WeakPolarHBondContact CB-O 3.48Å; Y817-F826 PolarHBondContact N-O 3.29Å; Y817-F826 VanDerWaalsContact N-O 3.14Å; Y817-F826 WeakPolarHBondContact O-CA 3.49Å; Y817-F826 WeakPolarHBondContact O-CB 3.47Å; Y817-F826 PolarHBondContact O-N 3.25Å; Y817-R828 VanDerWaalsContact CD2-C 3.42Å; Y817-A829 HydrophobicContact CD1-CB 4Å; Y817-A829 HydrophobicContact CD2-CB 4.41Å; Y817-A829 HydrophobicContact CE1-CB 3.73Å; Y817-A829 HydrophobicContact CE2-CB 4.14Å; Y817-A829 VanDerWaalsContact CE2-N 3.33Å; Y817-A829 HydrophobicContact CG-CB 4.33Å
818	L	77.4	Confident	72.9	Confident	101 Å²	101	72.2 Å²	72.2	53%	0.529	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	149.9	176.4	-60.3	175.3	0	0	0	111.4	S815 T825 L832	S815-L818 WeakPolarHBondContact OG-CD2 3.35Å; L818-T825 HydrophobicContact CD2-CG2 3.8Å; L818-L832 VanDerWaalsContact O-CD2 3.31Å; L818-L832 WeakPolarHBondContact O-CD2 3.32Å
819	C	82.3	Confident	72.8	Confident	1 Å²	1	73.4 Å²	73.4	1%	0.007	41%	0.41	C	S	.	.			trans	-100.7	99.9	169	-176.9	0	0	0	0	111.2	T821 C822 G823 A824 F826 L832 H835 H839	C819-T821 PolarHBondContact O-N 3.3Å; C819-C822 PolarHBondContact O-N 3.05Å; C819-G823 PolarHBondContact O-N 2.96Å; C819-A824 HydrophobicContact CB-CB 4.28Å; C819-A824 WeakPolarHBondContact CB-O 3.46Å; C819-A824 PolarHBondContact N-O 3.35Å; C819-F826 HydrophobicContact CB-CE2 4.1Å; C819-L832 HydrophobicContact CB-CD1 3.6Å; C819-H835 PolarHBondContact SG-CD2 2.93Å; C819-H835 PolarHBondContact SG-NE2 3.28Å; C819-H835 VanDerWaalsContact SG-NE2 3.44Å; C819-H839 PolarHBondContact SG-CD2 2.89Å; C819-H839 PolarHBondContact SG-NE2 3.14Å
820	N	74	Confident	73.1	Confident	161 Å²	161	76.7 Å²	76.7	86%	0.861	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-28.9	180	-60.2	41.3	0	0	0	113.5	C822	N820-C822 PolarHBondContact O-N 3.43Å
821	T	71.6	Confident	73.4	Confident	93 Å²	93	73.6 Å²	73.6	57%	0.571	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-16.7	-178.9	-36.7	0	0	0	0	114.6	C819 H839	C819-T821 PolarHBondContact O-N 3.3Å; T821-H839 HydrophobicContact CG2-CB 4.05Å
822	C	76.7	Confident	73.8	Confident	67 Å²	67	71 Å²	71	45%	0.453	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-156.5	15.3	-178.4	77.4	0	0	0	0	115.7	C819 N820 A824 H835 H839	C819-C822 PolarHBondContact O-N 3.05Å; N820-C822 PolarHBondContact O-N 3.43Å; C822-A824 PolarHBondContact O-N 3.29Å; C822-A824 VanDerWaalsContact SG-CB 3.5Å; C822-H835 PolarHBondContact SG-NE2 3.41Å; C822-H839 VanDerWaalsContact SG-CE1 3.55Å; C822-H839 PolarHBondContact SG-NE2 3.15Å
823	G	76.9	Confident	74.4	Confident	60 Å²	60	71.3 Å²	71.3	62%	0.619	42%	0.415	S	S	*	.			trans	66.8	0	-178.8	0	0	0	0	0	116.1	C819 T825	C819-G823 PolarHBondContact O-N 2.96Å; G823-T825 PolarHBondContact O-N 3.15Å
824	A	76.3	Confident	75.2	Confident	27 Å²	27	77.1 Å²	77.1	22%	0.223	43%	0.426	C	S	.	.			trans	-68.1	131	-173.2	0	0	0	0	0	112.2	C819 C822 F826	C819-A824 HydrophobicContact CB-CB 4.28Å; C819-A824 WeakPolarHBondContact CB-O 3.46Å; C819-A824 PolarHBondContact N-O 3.35Å; C822-A824 PolarHBondContact O-N 3.29Å; C822-A824 VanDerWaalsContact SG-CB 3.5Å; A824-F826 HydrophobicContact CB-CE2 3.58Å; A824-F826 HydrophobicContact CB-CZ 3.85Å; A824-F826 WeakPolarHBondContact O-CD2 3.41Å; A824-F826 WeakPolarHBondContact O-CE2 3.2Å
825	T	76.4	Confident	76.1	Confident	82 Å²	82	72.8 Å²	72.8	50%	0.503	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	131.3	-173.8	45.7	0	0	0	0	111.5	S815 L818 G823	S815-T825 WeakPolarHBondContact OG-CB 3.27Å; S815-T825 VanDerWaalsContact OG-CG2 3.26Å; S815-T825 WeakPolarHBondContact OG-CG2 3.32Å; L818-T825 HydrophobicContact CD2-CG2 3.8Å; G823-T825 PolarHBondContact O-N 3.15Å
826	F	78.3	Confident	76.8	Confident	39 Å²	39	74.6 Å²	74.6	17%	0.171	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	135.8	179.2	-60.4	-82.4	0	0	0	113.7	S815 Y817 C819 A824 R828 A831 L832 H835	S815-F826 WeakPolarHBondContact CB-O 3.22Å; Y817-F826 WeakPolarHBondContact CB-O 3.48Å; Y817-F826 PolarHBondContact N-O 3.29Å; Y817-F826 VanDerWaalsContact N-O 3.14Å; Y817-F826 WeakPolarHBondContact O-CA 3.49Å; Y817-F826 WeakPolarHBondContact O-CB 3.47Å; Y817-F826 PolarHBondContact O-N 3.25Å; C819-F826 HydrophobicContact CB-CE2 4.1Å; A824-F826 HydrophobicContact CB-CE2 3.58Å; A824-F826 HydrophobicContact CB-CZ 3.85Å; A824-F826 WeakPolarHBondContact O-CD2 3.41Å; A824-F826 WeakPolarHBondContact O-CE2 3.2Å; F826-R828 VanDerWaalsContact C-N 3.33Å; F826-A831 HydrophobicContact CB-CB 4.46Å; F826-A831 HydrophobicContact CD1-CB 3.92Å; F826-A831 HydrophobicContact CG-CB 4.49Å; F826-L832 HydrophobicContact CB-CB 4.21Å; F826-L832 HydrophobicContact CD2-CB 4.15Å; F826-L832 HydrophobicContact CD2-CD1 3.84Å; F826-L832 HydrophobicContact CE2-CD1 4.19Å; F826-L832 HydrophobicContact CG-CB 4.29Å; F826-H835 HydrophobicContact CE1-CB 4.13Å; F826-H835 HydrophobicContact CE2-CB 4.01Å; F826-H835 AromaticContact CE2-CD2 3.31Å; F826-H835 WeakPolarHBondContact CE2-CD2 3.38Å; F826-H835 AromaticContact CE2-CG 3.59Å; F826-H835 AromaticContact CE2-NE2 3.71Å; F826-H835 HydrophobicContact CZ-CB 3.64Å; F826-H835 AromaticContact CZ-CD2 3.49Å; F826-H835 VanDerWaalsContact CZ-CD2 3.49Å; F826-H835 WeakPolarHBondContact CZ-CD2 3.23Å; F826-H835 AromaticContact CZ-CE1 3.79Å; F826-H835 AromaticContact CZ-CG 3.27Å; F826-H835 AromaticContact CZ-ND1 3.49Å; F826-H835 WeakPolarHBondContact CZ-ND1 3.25Å; F826-H835 AromaticContact CZ-NE2 3.79Å
827	H	74.6	Confident	77.2	Confident	52 Å²	52	74.5 Å²	74.5	24%	0.241	41%	0.414	C	S	.	.	S	Bend	trans	-85.4	-5.7	178	-52.2	-84.2	0	0	0	113	S809 L810	S809-H827 PolarHBondContact O-CE1 3.48Å; S809-H827 PolarHBondContact O-ND1 3.17Å; S809-H827 PolarHBondContact OG-ND1 2.93Å; L810-H827 VanDerWaalsContact CD2-CD2 3.43Å; L810-H827 WeakPolarHBondContact CD2-CD2 3.22Å
828	R	77.9	Confident	77	Confident	127 Å²	127	78.3 Å²	78.3	48%	0.479	43%	0.432	S	S	.	.			trans	-135	132.5	177.6	-59.3	-175.2	-169.9	118.9	8.6	112.3	E806 Y817 F826 S830 A831 L832	E806-R828 HydrophobicContact CG-CG 4.3Å; E806-R828 IonicContact OE1-CZ 2.74Å; E806-R828 IonicContact OE1-NE 3.86Å; E806-R828 PolarHBondContact OE1-NE 2.74Å; E806-R828 IonicContact OE1-NH2 3.14Å; E806-R828 PolarHBondContact OE1-NH2 3.31Å; E806-R828 WeakPolarHBondContact OE2-CD 3.37Å; E806-R828 VanDerWaalsContact OE2-CG 3.29Å; E806-R828 WeakPolarHBondContact OE2-CG 3.46Å; E806-R828 IonicContact OE2-CZ 3.69Å; E806-R828 IonicContact OE2-NE 3.82Å; E806-R828 PolarHBondContact OE2-NE 3.22Å; E806-R828 IonicContact OE2-NH2 2.69Å; Y817-R828 VanDerWaalsContact CD2-C 3.42Å; F826-R828 VanDerWaalsContact C-N 3.33Å; R828-S830 PolarHBondContact O-N 3.26Å; R828-A831 HydrophobicContact CB-CB 4.05Å; R828-A831 WeakPolarHBondContact O-CB 3.34Å; R828-A831 PolarHBondContact O-N 3.34Å; R828-L832 PolarHBondContact O-N 3.02Å
829	A	76.1	Confident	76.7	Confident	49 Å²	49	76.6 Å²	76.6	41%	0.405	42%	0.421	S	S	.	.	H	α-helix	trans	-55.3	-34.2	170.3	0	0	0	0	0	113.1	Y817 L832 S833	Y817-A829 HydrophobicContact CD1-CB 4Å; Y817-A829 HydrophobicContact CD2-CB 4.41Å; Y817-A829 HydrophobicContact CE1-CB 3.73Å; Y817-A829 HydrophobicContact CE2-CB 4.14Å; Y817-A829 VanDerWaalsContact CE2-N 3.33Å; Y817-A829 HydrophobicContact CG-CB 4.33Å; A829-L832 PolarHBondContact O-N 2.84Å; A829-S833 WeakPolarHBondContact O-CB 3.47Å; A829-S833 PolarHBondContact O-N 2.99Å
830	S	78.8	Confident	75.9	Confident	77 Å²	77	82.4 Å²	82.4	54%	0.538	45%	0.448	S	S	.	.	H	α-helix	trans	-73.2	-24.6	176.6	58.1	0	0	0	0	113.6	R828 K834	R828-S830 PolarHBondContact O-N 3.26Å; S830-K834 WeakPolarHBondContact O-CG 3.15Å; S830-K834 PolarHBondContact O-N 3.35Å
831	A	77.3	Confident	75.1	Confident	35 Å²	35	80.6 Å²	80.6	29%	0.289	45%	0.445	S	S	.	.	H	α-helix	trans	-76.8	-46	170.5	0	0	0	0	0	110.4	F826 R828 S833 K834 H835	F826-A831 HydrophobicContact CB-CB 4.46Å; F826-A831 HydrophobicContact CD1-CB 3.92Å; F826-A831 HydrophobicContact CG-CB 4.49Å; R828-A831 HydrophobicContact CB-CB 4.05Å; R828-A831 WeakPolarHBondContact O-CB 3.34Å; R828-A831 PolarHBondContact O-N 3.34Å; A831-S833 VanDerWaalsContact C-N 3.34Å; A831-S833 PolarHBondContact O-N 3.48Å; A831-K834 PolarHBondContact O-N 3.22Å; A831-H835 WeakPolarHBondContact O-CB 3.39Å; A831-H835 PolarHBondContact O-N 3.28Å
832	L	80.8	Confident	74.3	Confident	24 Å²	24	83.5 Å²	83.5	13%	0.126	45%	0.45	C	S	.	.	H	α-helix	trans	-57.1	-45.8	172.8	176.2	62	0	0	0	111.3	L818 C819 F826 R828 A829 K834 H835 L836	L818-L832 VanDerWaalsContact O-CD2 3.31Å; L818-L832 WeakPolarHBondContact O-CD2 3.32Å; C819-L832 HydrophobicContact CB-CD1 3.6Å; F826-L832 HydrophobicContact CB-CB 4.21Å; F826-L832 HydrophobicContact CD2-CB 4.15Å; F826-L832 HydrophobicContact CD2-CD1 3.84Å; F826-L832 HydrophobicContact CE2-CD1 4.19Å; F826-L832 HydrophobicContact CG-CB 4.29Å; R828-L832 PolarHBondContact O-N 3.02Å; A829-L832 PolarHBondContact O-N 2.84Å; L832-K834 PolarHBondContact O-N 3.02Å; L832-H835 CarbonylContact O-C 3.52Å; L832-H835 WeakPolarHBondContact O-CA 3.3Å; L832-H835 WeakPolarHBondContact O-CB 3.2Å; L832-H835 PolarHBondContact O-N 3.49Å; L832-H835 VanDerWaalsContact O-N 3.07Å; L832-L836 HydrophobicContact CD1-CD1 4.03Å; L832-L836 HydrophobicContact CD1-CD2 4.33Å; L832-L836 HydrophobicContact CD1-CG 3.87Å; L832-L836 HydrophobicContact CD2-CD1 4.35Å; L832-L836 HydrophobicContact CG-CD1 3.83Å; L832-L836 HydrophobicContact CG-CG 4.15Å; L832-L836 WeakPolarHBondContact O-CG 3.28Å; L832-L836 PolarHBondContact O-N 3.28Å
833	S	79.4	Confident	73.3	Confident	65 Å²	65	84.2 Å²	84.2	46%	0.455	45%	0.454	S	S	.	.	H	α-helix	trans	-59.9	-44.4	178.4	176.4	0	0	0	0	112.7	A829 A831 H835 L836 K837	A829-S833 WeakPolarHBondContact O-CB 3.47Å; A829-S833 PolarHBondContact O-N 2.99Å; A831-S833 VanDerWaalsContact C-N 3.34Å; A831-S833 PolarHBondContact O-N 3.48Å; S833-H835 VanDerWaalsContact C-N 3.27Å; S833-H835 PolarHBondContact O-N 3.22Å; S833-L836 PolarHBondContact O-N 2.89Å; S833-K837 PolarHBondContact O-N 2.8Å
834	K	80.1	Confident	72.4	Confident	170 Å²	170	90.4 Å²	90.4	74%	0.739	47%	0.467	S	S	*	.	H	α-helix	trans	-65.4	-30.2	173.9	-74.4	-178.2	177.9	-170.6	0	113	S830 A831 L832	S830-K834 WeakPolarHBondContact O-CG 3.15Å; S830-K834 PolarHBondContact O-N 3.35Å; A831-K834 PolarHBondContact O-N 3.22Å; L832-K834 PolarHBondContact O-N 3.02Å
835	H	81.1	Confident	71.5	Confident	38 Å²	38	94.4 Å²	94.4	18%	0.176	49%	0.488	C	S	.	.	H	α-helix	trans	-77	-39.3	176.6	175	79.8	0	0	0	112.5	C819 C822 F826 A831 L832 S833 K837 K838 H839	C819-H835 PolarHBondContact SG-CD2 2.93Å; C819-H835 PolarHBondContact SG-NE2 3.28Å; C819-H835 VanDerWaalsContact SG-NE2 3.44Å; C822-H835 PolarHBondContact SG-NE2 3.41Å; F826-H835 HydrophobicContact CE1-CB 4.13Å; F826-H835 HydrophobicContact CE2-CB 4.01Å; F826-H835 AromaticContact CE2-CD2 3.31Å; F826-H835 WeakPolarHBondContact CE2-CD2 3.38Å; F826-H835 AromaticContact CE2-CG 3.59Å; F826-H835 AromaticContact CE2-NE2 3.71Å; F826-H835 HydrophobicContact CZ-CB 3.64Å; F826-H835 AromaticContact CZ-CD2 3.49Å; F826-H835 VanDerWaalsContact CZ-CD2 3.49Å; F826-H835 WeakPolarHBondContact CZ-CD2 3.23Å; F826-H835 AromaticContact CZ-CE1 3.79Å; F826-H835 AromaticContact CZ-CG 3.27Å; F826-H835 AromaticContact CZ-ND1 3.49Å; F826-H835 WeakPolarHBondContact CZ-ND1 3.25Å; F826-H835 AromaticContact CZ-NE2 3.79Å; A831-H835 WeakPolarHBondContact O-CB 3.39Å; A831-H835 PolarHBondContact O-N 3.28Å; L832-H835 CarbonylContact O-C 3.52Å; L832-H835 WeakPolarHBondContact O-CA 3.3Å; L832-H835 WeakPolarHBondContact O-CB 3.2Å; L832-H835 PolarHBondContact O-N 3.49Å; L832-H835 VanDerWaalsContact O-N 3.07Å; S833-H835 VanDerWaalsContact C-N 3.27Å; S833-H835 PolarHBondContact O-N 3.22Å; H835-K837 VanDerWaalsContact C-N 3.28Å; H835-K837 PolarHBondContact O-N 3.32Å; H835-K838 WeakPolarHBondContact O-CA 3.32Å; H835-K838 WeakPolarHBondContact O-CB 3.5Å; H835-K838 PolarHBondContact O-N 2.89Å; H835-H839 AromaticContact CD2-CD2 3.84Å; H835-H839 AromaticContact CD2-NE2 3.58Å; H835-H839 AromaticContact CE1-NE2 3.41Å; H835-H839 PolarHBondContact CE1-NE2 2.88Å; H835-H839 AromaticContact NE2-CD2 3.66Å; H835-H839 AromaticContact NE2-CE1 3.97Å; H835-H839 AromaticContact NE2-NE2 2.92Å; H835-H839 PolarHBondContact NE2-NE2 3.29Å
836	L	77.6	Confident	71.1	Confident	56 Å²	56	95.9 Å²	95.9	29%	0.293	48%	0.484	S	S	.	.	H	α-helix	trans	-62.2	-34.3	173.6	-71.7	169.7	0	0	0	111.8	L832 S833 K838 H839 Q840	L832-L836 HydrophobicContact CD1-CD1 4.03Å; L832-L836 HydrophobicContact CD1-CD2 4.33Å; L832-L836 HydrophobicContact CD1-CG 3.87Å; L832-L836 HydrophobicContact CD2-CD1 4.35Å; L832-L836 HydrophobicContact CG-CD1 3.83Å; L832-L836 HydrophobicContact CG-CG 4.15Å; L832-L836 WeakPolarHBondContact O-CG 3.28Å; L832-L836 PolarHBondContact O-N 3.28Å; S833-L836 PolarHBondContact O-N 2.89Å; L836-K838 PolarHBondContact O-N 2.6Å; L836-K838 VanDerWaalsContact O-N 3.08Å; L836-H839 PolarHBondContact O-N 2.83Å; L836-Q840 PolarHBondContact O-N 3.38Å
837	K	76.3	Confident	70.7	Confident	150 Å²	150	98 Å²	98	65%	0.652	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-11.1	168.7	-72.9	-164.4	173	-155.1	0	114.8	S833 H835	S833-K837 PolarHBondContact O-N 2.8Å; H835-K837 VanDerWaalsContact C-N 3.28Å; H835-K837 PolarHBondContact O-N 3.32Å
838	K	68.3	Low	70.6	Confident	171 Å²	171	99 Å²	99	74%	0.743	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-14.6	172.4	-157.7	-147.4	169.4	-159.4	0	112.7	H835 L836	H835-K838 WeakPolarHBondContact O-CA 3.32Å; H835-K838 WeakPolarHBondContact O-CB 3.5Å; H835-K838 PolarHBondContact O-N 2.89Å; L836-K838 PolarHBondContact O-N 2.6Å; L836-K838 VanDerWaalsContact O-N 3.08Å
839	H	69.7	Low	70.5	Confident	64 Å²	64	97 Å²	97	30%	0.296	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-22.2	176.6	-64.6	-57.1	0	0	0	113	C819 T821 C822 H835 L836	C819-H839 PolarHBondContact SG-CD2 2.89Å; C819-H839 PolarHBondContact SG-NE2 3.14Å; T821-H839 HydrophobicContact CG2-CB 4.05Å; C822-H839 VanDerWaalsContact SG-CE1 3.55Å; C822-H839 PolarHBondContact SG-NE2 3.15Å; H835-H839 AromaticContact CD2-CD2 3.84Å; H835-H839 AromaticContact CD2-NE2 3.58Å; H835-H839 AromaticContact CE1-NE2 3.41Å; H835-H839 PolarHBondContact CE1-NE2 2.88Å; H835-H839 AromaticContact NE2-CD2 3.66Å; H835-H839 AromaticContact NE2-CE1 3.97Å; H835-H839 AromaticContact NE2-NE2 2.92Å; H835-H839 PolarHBondContact NE2-NE2 3.29Å; L836-H839 PolarHBondContact O-N 2.83Å
840	Q	66.7	Low	70.8	Confident	124 Å²	124	95.3 Å²	95.3	58%	0.579	50%	0.496	S	S	*	.	S	Bend	trans	-56.7	133.8	162.2	-71.2	-178.6	-46.5	0	0	108.6	L836 K842	L836-Q840 PolarHBondContact O-N 3.38Å; Q840-K842 PolarHBondContact O-N 3.13Å
841	P	57.3	Low	70.5	Confident	122 Å²	122	96 Å²	96	79%	0.792	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-57.3	135.3	171.1	25.8	-33.3	0	0	0	108.1
842	K	53.7	Low	70.2	Confident	154 Å²	154	100 Å²	100	67%	0.67	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-66.9	139.4	172	-63.6	175.6	-175.1	173.1	0	107.3	Q840 E844 Y858	Q840-K842 PolarHBondContact O-N 3.13Å; K842-E844 PolarHBondContact O-N 3.24Å; K842-Y858 HydrophobicContact CB-CE1 4.26Å; K842-Y858 HydrophobicContact CD-CE2 4.27Å
843	P	56.4	Low	70.2	Confident	83 Å²	83	100.5 Å²	100.5	54%	0.539	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-57.1	139.4	166.9	26.9	-33.5	0	0	0	108.6	V845 Y858	P843-V845 VanDerWaalsContact C-N 3.31Å; P843-Y858 HydrophobicContact CG-CD1 4.41Å; P843-Y858 HydrophobicContact CG-CE1 4.21Å; P843-Y858 VanDerWaalsContact O-CE1 3.32Å; P843-Y858 WeakPolarHBondContact O-CE1 3.41Å; P843-Y858 PolarHBondContact O-OH 2.92Å
844	E	57.5	Low	70	Confident	190 Å²	190	106.6 Å²	106.6	89%	0.888	54%	0.54	S	S	*	.	S	Bend	trans	-71.7	-35.8	175.7	-60.9	-170.8	130.1	0	0	109.9	K842 R846	K842-E844 PolarHBondContact O-N 3.24Å; E844-R846 PolarHBondContact O-N 3.25Å; E844-R846 VanDerWaalsContact O-N 3.11Å
845	V	56.8	Low	69.6	Low	110 Å²	110	104 Å²	104	67%	0.667	53%	0.529	S	S	*	.			trans	-59.9	111.5	164.3	-173.9	0	0	0	0	110	P843 P847	P843-V845 VanDerWaalsContact C-N 3.31Å; V845-P847 HydrophobicContact CG1-CG 4.46Å; V845-P847 WeakPolarHBondContact O-CD 3.16Å
846	R	68.7	Low	69.4	Low	113 Å²	113	104 Å²	104	43%	0.426	53%	0.533	S	S	.	.			trans	-98.8	101	167	-71.9	165.8	-175.6	173.5	14	107.4	E844 F848 S856 F857 Y858	E844-R846 PolarHBondContact O-N 3.25Å; E844-R846 VanDerWaalsContact O-N 3.11Å; R846-F848 PolarHBondContact O-N 3.24Å; R846-S856 WeakPolarHBondContact CD-O 3.38Å; R846-S856 WeakPolarHBondContact CD-OG 3.37Å; R846-S856 PolarHBondContact NH1-OG 3.17Å; R846-F857 CarbonylContact C-O 3.28Å; R846-Y858 HydrophobicContact CG-CD1 4Å; R846-Y858 HydrophobicContact CG-CD2 4.38Å; R846-Y858 HydrophobicContact CG-CE1 3.48Å; R846-Y858 VanDerWaalsContact CG-CE1 3.48Å; R846-Y858 HydrophobicContact CG-CE2 3.91Å; R846-Y858 HydrophobicContact CG-CG 4.42Å; R846-Y858 VanDerWaalsContact CG-CZ 3.42Å; R846-Y858 PolarHBondContact NE-OH 2.95Å
847	P	70.6	Confident	69.5	Low	83 Å²	83	103.5 Å²	103.5	54%	0.539	53%	0.528	S	S	.	.	S	Bend	trans	-68.5	-9.6	-165	-21.4	34	0	0	0	115.3	V845	V845-P847 HydrophobicContact CG1-CG 4.46Å; V845-P847 WeakPolarHBondContact O-CD 3.16Å
848	F	71.1	Confident	69.4	Low	73 Å²	73	100.7 Å²	100.7	32%	0.32	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	79.6	-171.9	-55.9	-70.7	0	0	0	110	R846 F857 A860 L863	R846-F848 PolarHBondContact O-N 3.24Å; F848-F857 HydrophobicContact CB-CB 4.3Å; F848-F857 PolarHBondContact N-O 2.79Å; F848-F857 PolarHBondContact O-N 3.23Å; F848-A860 HydrophobicContact CD1-CB 3.85Å; F848-A860 HydrophobicContact CE1-CB 3.73Å; F848-A860 HydrophobicContact CE2-CB 4.49Å; F848-A860 HydrophobicContact CG-CB 4.29Å; F848-A860 HydrophobicContact CZ-CB 4.07Å; F848-L863 HydrophobicContact CB-CB 3.96Å; F848-L863 HydrophobicContact CB-CD2 3.78Å; F848-L863 HydrophobicContact CB-CG 4.48Å
849	S	75.5	Confident	69.9	Low	86 Å²	86	97.8 Å²	97.8	60%	0.601	50%	0.503	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.7	156	171.4	45.4	0	0	0	0	112	L863	S849-L863 VanDerWaalsContact O-CD1 3.22Å; S849-L863 WeakPolarHBondContact O-CD1 3.45Å; S849-L863 WeakPolarHBondContact O-CD2 3.36Å
850	C	82.4	Confident	70.1	Confident	14 Å²	14	97.1 Å²	97.1	10%	0.095	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	133.6	172.8	168.3	0	0	0	0	109.6	H852 C853 K855 L863 H866 M867	C850-H852 VanDerWaalsContact C-N 3.26Å; C850-H852 PolarHBondContact O-N 3.04Å; C850-H852 PolarHBondContact SG-N 3.01Å; C850-H852 VanDerWaalsContact SG-N 3.37Å; C850-C853 WeakPolarHBondContact CB-O 3.38Å; C850-C853 PolarHBondContact SG-N 3.47Å; C850-K855 WeakPolarHBondContact CB-O 3.47Å; C850-K855 PolarHBondContact N-O 2.25Å; C850-L863 HydrophobicContact CB-CD1 3.95Å; C850-H866 PolarHBondContact SG-NE2 3.02Å; C850-M867 HydrophobicContact CB-CE 3.96Å; C850-M867 WeakPolarHBondContact SG-CE 3.28Å
851	S	73.4	Confident	70.6	Confident	91 Å²	91	98.2 Å²	98.2	64%	0.636	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-21.9	176.9	47.4	0	0	0	0	113.6
852	H	71	Confident	71.6	Confident	119 Å²	119	95.9 Å²	95.9	55%	0.551	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.5	4.7	-171.5	-56.3	-66.2	0	0	0	113.9	C850 H870	C850-H852 VanDerWaalsContact C-N 3.26Å; C850-H852 PolarHBondContact O-N 3.04Å; C850-H852 PolarHBondContact SG-N 3.01Å; C850-H852 VanDerWaalsContact SG-N 3.37Å; H852-H870 HydrophobicContact CB-CB 4.22Å; H852-H870 VanDerWaalsContact CB-ND1 3.3Å; H852-H870 WeakPolarHBondContact CB-ND1 3.49Å; H852-H870 PolarHBondContact O-CE1 3.35Å
853	C	81.2	Confident	72.9	Confident	34 Å²	34	90 Å²	90	23%	0.23	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.4	165.2	159.7	65	0	0	0	0	111.1	C850 K855 H866 H870	C850-C853 WeakPolarHBondContact CB-O 3.38Å; C850-C853 PolarHBondContact SG-N 3.47Å; C853-K855 PolarHBondContact O-N 3.07Å; C853-K855 PolarHBondContact SG-NZ 3.28Å; C853-H866 PolarHBondContact SG-NE2 3.12Å; C853-H866 VanDerWaalsContact SG-NE2 3.42Å; C853-H870 PolarHBondContact SG-NE2 2.84Å
854	E	73.8	Confident	73.8	Confident	193 Å²	193	92.4 Å²	92.4	90%	0.902	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.3	4.7	-179	-60.6	156.2	-155.9	0	0	117.2	S856	E854-S856 PolarHBondContact O-N 3.02Å
855	K	72.1	Confident	74.7	Confident	116 Å²	116	86.7 Å²	86.7	50%	0.504	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	109	-175.3	-65.6	176	-164.4	64.9	0	110.3	C850 C853 F857	C850-K855 WeakPolarHBondContact CB-O 3.47Å; C850-K855 PolarHBondContact N-O 2.25Å; C853-K855 PolarHBondContact O-N 3.07Å; C853-K855 PolarHBondContact SG-NZ 3.28Å; K855-F857 HydrophobicContact CB-CE2 3.73Å; K855-F857 HydrophobicContact CB-CZ 4.01Å; K855-F857 WeakPolarHBondContact O-CD2 3.12Å; K855-F857 WeakPolarHBondContact O-CE2 3.16Å
856	S	77	Confident	75.8	Confident	37 Å²	37	82.4 Å²	82.4	26%	0.259	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	146.6	175.4	50.9	0	0	0	0	112.6	R846 E854	R846-S856 WeakPolarHBondContact CD-O 3.38Å; R846-S856 WeakPolarHBondContact CD-OG 3.37Å; R846-S856 PolarHBondContact NH1-OG 3.17Å; E854-S856 PolarHBondContact O-N 3.02Å
857	F	81.1	Confident	76	Confident	47 Å²	47	78.5 Å²	78.5	21%	0.206	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	160.3	-170	-63.1	-92.3	0	0	0	112.8	R846 F848 K855 D862 L863 H866	R846-F857 CarbonylContact C-O 3.28Å; F848-F857 HydrophobicContact CB-CB 4.3Å; F848-F857 PolarHBondContact N-O 2.79Å; F848-F857 PolarHBondContact O-N 3.23Å; K855-F857 HydrophobicContact CB-CE2 3.73Å; K855-F857 HydrophobicContact CB-CZ 4.01Å; K855-F857 WeakPolarHBondContact O-CD2 3.12Å; K855-F857 WeakPolarHBondContact O-CE2 3.16Å; F857-D862 HydrophobicContact CB-CB 4.19Å; F857-D862 HydrophobicContact CD1-CB 3.63Å; F857-D862 HydrophobicContact CE1-CB 4.42Å; F857-D862 HydrophobicContact CG-CB 4.18Å; F857-L863 HydrophobicContact CB-CB 4.36Å; F857-L863 HydrophobicContact CD2-CB 4.23Å; F857-L863 HydrophobicContact CD2-CD1 4.24Å; F857-L863 HydrophobicContact CG-CB 4.46Å; F857-H866 HydrophobicContact CE1-CB 4.38Å; F857-H866 HydrophobicContact CE2-CB 3.99Å; F857-H866 AromaticContact CE2-CD2 3.19Å; F857-H866 WeakPolarHBondContact CE2-CD2 3.11Å; F857-H866 AromaticContact CE2-CG 3.77Å; F857-H866 AromaticContact CE2-NE2 3.99Å; F857-H866 HydrophobicContact CZ-CB 3.71Å; F857-H866 AromaticContact CZ-CD2 3.49Å; F857-H866 VanDerWaalsContact CZ-CD2 3.49Å; F857-H866 WeakPolarHBondContact CZ-CD2 3.5Å; F857-H866 AromaticContact CZ-CG 3.61Å
858	Y	74.2	Confident	76.5	Confident	91 Å²	91	76.2 Å²	76.2	36%	0.357	39%	0.388	S	S	.	.	S	Bend	trans	-93.8	-21.6	-178.4	-68.2	-74.4	0	0	0	114.1	K842 P843 R846	K842-Y858 HydrophobicContact CB-CE1 4.26Å; K842-Y858 HydrophobicContact CD-CE2 4.27Å; P843-Y858 HydrophobicContact CG-CD1 4.41Å; P843-Y858 HydrophobicContact CG-CE1 4.21Å; P843-Y858 VanDerWaalsContact O-CE1 3.32Å; P843-Y858 WeakPolarHBondContact O-CE1 3.41Å; P843-Y858 PolarHBondContact O-OH 2.92Å; R846-Y858 HydrophobicContact CG-CD1 4Å; R846-Y858 HydrophobicContact CG-CD2 4.38Å; R846-Y858 HydrophobicContact CG-CE1 3.48Å; R846-Y858 VanDerWaalsContact CG-CE1 3.48Å; R846-Y858 HydrophobicContact CG-CE2 3.91Å; R846-Y858 HydrophobicContact CG-CG 4.42Å; R846-Y858 VanDerWaalsContact CG-CZ 3.42Å; R846-Y858 PolarHBondContact NE-OH 2.95Å
859	E	78.1	Confident	76.5	Confident	110 Å²	110	78.4 Å²	78.4	51%	0.514	40%	0.398	S	S	.	.	S	Bend	trans	-128.4	137.5	174.3	-67.6	-168.4	-155.4	0	0	109.9	K861 D862 L863	E859-K861 PolarHBondContact O-N 2.94Å; E859-D862 PolarHBondContact O-N 3.04Å; E859-L863 PolarHBondContact O-N 3.36Å
860	A	73.9	Confident	76.4	Confident	49 Å²	49	78 Å²	78	41%	0.405	39%	0.386	S	S	.	.	H	α-helix	trans	-54.1	-27.2	176	0	0	0	0	0	113.5	F848 L863 Q864	F848-A860 HydrophobicContact CD1-CB 3.85Å; F848-A860 HydrophobicContact CE1-CB 3.73Å; F848-A860 HydrophobicContact CE2-CB 4.49Å; F848-A860 HydrophobicContact CG-CB 4.29Å; F848-A860 HydrophobicContact CZ-CB 4.07Å; A860-L863 PolarHBondContact O-N 3.47Å; A860-Q864 WeakPolarHBondContact O-CB 3.43Å; A860-Q864 PolarHBondContact O-N 3.3Å
861	K	76.7	Confident	75.8	Confident	148 Å²	148	83.1 Å²	83.1	64%	0.643	41%	0.41	S	S	*	.	H	α-helix	trans	-69.1	-34.7	176.5	-69	171.1	-175.4	159.5	0	113.1	E859 Q865	E859-K861 PolarHBondContact O-N 2.94Å; K861-Q865 WeakPolarHBondContact O-CB 3.44Å; K861-Q865 PolarHBondContact O-N 3.06Å
862	D	78.7	Confident	75.6	Confident	73 Å²	73	80.8 Å²	80.8	39%	0.39	40%	0.4	S	S	.	.	H	α-helix	trans	-73.5	-37.7	176.3	-68.6	-18.3	0	0	0	110	F857 E859 H866	F857-D862 HydrophobicContact CB-CB 4.19Å; F857-D862 HydrophobicContact CD1-CB 3.63Å; F857-D862 HydrophobicContact CE1-CB 4.42Å; F857-D862 HydrophobicContact CG-CB 4.18Å; E859-D862 PolarHBondContact O-N 3.04Å; D862-H866 WeakPolarHBondContact O-CB 3.33Å; D862-H866 PolarHBondContact O-N 3.16Å
863	L	80.9	Confident	75.3	Confident	30 Å²	30	79.5 Å²	79.5	16%	0.157	40%	0.397	C	S	.	.	H	α-helix	trans	-61.2	-51.9	170.2	172.3	61	0	0	0	111.5	F848 S849 C850 F857 E859 A860 Q865 H866 M867	F848-L863 HydrophobicContact CB-CB 3.96Å; F848-L863 HydrophobicContact CB-CD2 3.78Å; F848-L863 HydrophobicContact CB-CG 4.48Å; S849-L863 VanDerWaalsContact O-CD1 3.22Å; S849-L863 WeakPolarHBondContact O-CD1 3.45Å; S849-L863 WeakPolarHBondContact O-CD2 3.36Å; C850-L863 HydrophobicContact CB-CD1 3.95Å; F857-L863 HydrophobicContact CB-CB 4.36Å; F857-L863 HydrophobicContact CD2-CB 4.23Å; F857-L863 HydrophobicContact CD2-CD1 4.24Å; F857-L863 HydrophobicContact CG-CB 4.46Å; E859-L863 PolarHBondContact O-N 3.36Å; A860-L863 PolarHBondContact O-N 3.47Å; L863-Q865 VanDerWaalsContact C-N 3.3Å; L863-Q865 PolarHBondContact O-N 3.43Å; L863-H866 CarbonylContact O-C 3.58Å; L863-H866 WeakPolarHBondContact O-CA 3.28Å; L863-H866 VanDerWaalsContact O-CB 3.3Å; L863-H866 WeakPolarHBondContact O-CB 3.08Å; L863-H866 PolarHBondContact O-N 3.39Å; L863-M867 HydrophobicContact CD1-CE 4.09Å; L863-M867 HydrophobicContact CD1-CG 4.3Å; L863-M867 HydrophobicContact CG-CG 4.47Å; L863-M867 WeakPolarHBondContact O-CG 3.34Å; L863-M867 PolarHBondContact O-N 3.11Å
864	Q	75.8	Confident	74.8	Confident	134 Å²	134	83.6 Å²	83.6	63%	0.626	41%	0.411	S	S	*	.	H	α-helix	trans	-62.2	-38.8	179.5	-165.9	178.5	17.7	0	0	111.6	A860 H866 M867 N868	A860-Q864 WeakPolarHBondContact O-CB 3.43Å; A860-Q864 PolarHBondContact O-N 3.3Å; Q864-H866 PolarHBondContact O-N 2.83Å; Q864-M867 PolarHBondContact O-N 3.37Å; Q864-N868 PolarHBondContact O-N 3.08Å; Q864-N868 VanDerWaalsContact O-N 3.14Å; Q864-N868 PolarHBondContact O-OD1 2.98Å
865	Q	74.8	Confident	74.7	Confident	70 Å²	70	78.4 Å²	78.4	33%	0.327	39%	0.394	S	S	.	.	H	α-helix	trans	-65.8	-19.5	171.9	177.8	170.3	104.9	0	0	113.6	K861 L863 W887	K861-Q865 WeakPolarHBondContact O-CB 3.44Å; K861-Q865 PolarHBondContact O-N 3.06Å; L863-Q865 VanDerWaalsContact C-N 3.3Å; L863-Q865 PolarHBondContact O-N 3.43Å; Q865-W887 VanDerWaalsContact CD-NE1 3.29Å; Q865-W887 VanDerWaalsContact CG-CD1 3.49Å; Q865-W887 HydrophobicContact CG-CG 4.4Å; Q865-W887 HydrophobicContact CG-CZ2 4.38Å; Q865-W887 VanDerWaalsContact OE1-CZ2 3.28Å
866	H	80.2	Confident	74.6	Confident	19 Å²	19	75.5 Å²	75.5	9%	0.088	38%	0.381	C	S	.	.	H	α-helix	trans	-90.1	-35.2	172.8	172.1	43.8	0	0	0	112.8	C850 C853 F857 D862 L863 Q864 N868 K869 H870	C850-H866 PolarHBondContact SG-NE2 3.02Å; C853-H866 PolarHBondContact SG-NE2 3.12Å; C853-H866 VanDerWaalsContact SG-NE2 3.42Å; F857-H866 HydrophobicContact CE1-CB 4.38Å; F857-H866 HydrophobicContact CE2-CB 3.99Å; F857-H866 AromaticContact CE2-CD2 3.19Å; F857-H866 WeakPolarHBondContact CE2-CD2 3.11Å; F857-H866 AromaticContact CE2-CG 3.77Å; F857-H866 AromaticContact CE2-NE2 3.99Å; F857-H866 HydrophobicContact CZ-CB 3.71Å; F857-H866 AromaticContact CZ-CD2 3.49Å; F857-H866 VanDerWaalsContact CZ-CD2 3.49Å; F857-H866 WeakPolarHBondContact CZ-CD2 3.5Å; F857-H866 AromaticContact CZ-CG 3.61Å; D862-H866 WeakPolarHBondContact O-CB 3.33Å; D862-H866 PolarHBondContact O-N 3.16Å; L863-H866 CarbonylContact O-C 3.58Å; L863-H866 WeakPolarHBondContact O-CA 3.28Å; L863-H866 VanDerWaalsContact O-CB 3.3Å; L863-H866 WeakPolarHBondContact O-CB 3.08Å; L863-H866 PolarHBondContact O-N 3.39Å; Q864-H866 PolarHBondContact O-N 2.83Å; H866-N868 PolarHBondContact O-N 3.39Å; H866-K869 WeakPolarHBondContact O-CA 3.32Å; H866-K869 VanDerWaalsContact O-CB 3.3Å; H866-K869 WeakPolarHBondContact O-CB 3.45Å; H866-K869 PolarHBondContact O-N 2.7Å; H866-H870 AromaticContact CE1-CD2 3.39Å; H866-H870 PolarHBondContact CE1-CD2 2.81Å; H866-H870 AromaticContact CE1-NE2 3.07Å; H866-H870 PolarHBondContact CE1-NE2 3.22Å; H866-H870 AromaticContact ND1-CD2 3.9Å; H866-H870 AromaticContact NE2-CD2 3.78Å; H866-H870 AromaticContact NE2-NE2 3.42Å; H866-H870 PolarHBondContact NE2-NE2 3.41Å; H866-H870 PolarHBondContact O-N 3.01Å
867	M	74.5	Confident	74.3	Confident	32 Å²	32	79.1 Å²	79.1	16%	0.158	39%	0.394	C	S	.	.	H	α-helix	trans	-54.7	-41.6	168.3	-68.4	-73.8	97.7	0	0	111.2	C850 L863 Q864 K869 H870 M871	C850-M867 HydrophobicContact CB-CE 3.96Å; C850-M867 WeakPolarHBondContact SG-CE 3.28Å; L863-M867 HydrophobicContact CD1-CE 4.09Å; L863-M867 HydrophobicContact CD1-CG 4.3Å; L863-M867 HydrophobicContact CG-CG 4.47Å; L863-M867 WeakPolarHBondContact O-CG 3.34Å; L863-M867 PolarHBondContact O-N 3.11Å; Q864-M867 PolarHBondContact O-N 3.37Å; M867-K869 PolarHBondContact O-N 2.93Å; M867-H870 PolarHBondContact O-N 2.93Å; M867-M871 PolarHBondContact O-N 3.35Å
868	N	79.3	Confident	73.9	Confident	34 Å²	34	77 Å²	77	18%	0.182	39%	0.385	C	S	.	.	H	α-helix	trans	-57.6	-6.5	170.7	-68.2	6.5	0	0	0	115	Q864 H866 L873	Q864-N868 PolarHBondContact O-N 3.08Å; Q864-N868 VanDerWaalsContact O-N 3.14Å; Q864-N868 PolarHBondContact O-OD1 2.98Å; H866-N868 PolarHBondContact O-N 3.39Å; N868-L873 WeakPolarHBondContact CB-O 3.22Å; N868-L873 VanDerWaalsContact O-O 3.04Å
869	K	72.4	Confident	73.7	Confident	119 Å²	119	81.3 Å²	81.3	52%	0.517	41%	0.409	S	S	.	.	H	α-helix	trans	-102.3	-25.7	171.8	-56.7	-176.6	-178.3	178.7	0	113.2	H866 M867	H866-K869 WeakPolarHBondContact O-CA 3.32Å; H866-K869 VanDerWaalsContact O-CB 3.3Å; H866-K869 WeakPolarHBondContact O-CB 3.45Å; H866-K869 PolarHBondContact O-N 2.7Å; M867-K869 PolarHBondContact O-N 2.93Å
870	H	73.3	Confident	73.1	Confident	78 Å²	78	80.7 Å²	80.7	36%	0.361	41%	0.412	S	S	.	.	H	α-helix	trans	-80.8	-50.5	173.3	-77.6	-85.7	0	0	0	110.6	H852 C853 H866 M867 G872	H852-H870 HydrophobicContact CB-CB 4.22Å; H852-H870 VanDerWaalsContact CB-ND1 3.3Å; H852-H870 WeakPolarHBondContact CB-ND1 3.49Å; H852-H870 PolarHBondContact O-CE1 3.35Å; C853-H870 PolarHBondContact SG-NE2 2.84Å; H866-H870 AromaticContact CE1-CD2 3.39Å; H866-H870 PolarHBondContact CE1-CD2 2.81Å; H866-H870 AromaticContact CE1-NE2 3.07Å; H866-H870 PolarHBondContact CE1-NE2 3.22Å; H866-H870 AromaticContact ND1-CD2 3.9Å; H866-H870 AromaticContact NE2-CD2 3.78Å; H866-H870 AromaticContact NE2-NE2 3.42Å; H866-H870 PolarHBondContact NE2-NE2 3.41Å; H866-H870 PolarHBondContact O-N 3.01Å; M867-H870 PolarHBondContact O-N 2.93Å; H870-G872 PolarHBondContact O-N 3.16Å
871	M	70.3	Confident	72.8	Confident	122 Å²	122	80.9 Å²	80.9	60%	0.601	41%	0.41	S	S	*	.	S	Bend	trans	-74.2	8	-179.8	-54.7	178.3	78.2	0	0	114	M867 L873	M867-M871 PolarHBondContact O-N 3.35Å; M871-L873 HydrophobicContact CB-CD1 4.02Å; M871-L873 HydrophobicContact CB-CG 3.84Å; M871-L873 HydrophobicContact CE-CD1 4.19Å; M871-L873 PolarHBondContact O-N 3.05Å; M871-L873 HydrophobicContact SD-CD1 4.08Å
872	G	68.3	Low	72.3	Confident	41 Å²	41	75.8 Å²	75.8	42%	0.423	40%	0.4	S	S	.	.			trans	64.6	-12.3	-174.1	0	0	0	0	0	116.6	H870 K874	H870-G872 PolarHBondContact O-N 3.16Å; G872-K874 WeakPolarHBondContact O-CG 3.49Å; G872-K874 PolarHBondContact O-N 3.46Å; G872-K874 VanDerWaalsContact O-N 3.13Å
873	L	63.9	Low	71.9	Confident	92 Å²	92	77.5 Å²	77.5	48%	0.482	40%	0.403	S	S	.	.			trans	-56.8	110	-170.2	-63.4	178.4	0	0	0	113.1	N868 M871 P875	N868-L873 WeakPolarHBondContact CB-O 3.22Å; N868-L873 VanDerWaalsContact O-O 3.04Å; M871-L873 HydrophobicContact CB-CD1 4.02Å; M871-L873 HydrophobicContact CB-CG 3.84Å; M871-L873 HydrophobicContact CE-CD1 4.19Å; M871-L873 PolarHBondContact O-N 3.05Å; M871-L873 HydrophobicContact SD-CD1 4.08Å; L873-P875 WeakPolarHBondContact O-CD 3.25Å
874	K	71.9	Confident	71.4	Confident	120 Å²	120	78.6 Å²	78.6	52%	0.522	41%	0.413	S	S	.	.			trans	-113.4	69	176.9	-67.2	150.4	-171.3	162.6	0	110.2	G872 F876 C884 Y885	G872-K874 WeakPolarHBondContact O-CG 3.49Å; G872-K874 PolarHBondContact O-N 3.46Å; G872-K874 VanDerWaalsContact O-N 3.13Å; K874-F876 PolarHBondContact O-N 2.81Å; K874-C884 HydrophobicContact CB-CB 3.38Å; K874-C884 HydrophobicContact CD-CB 3.97Å; K874-C884 HydrophobicContact CG-CB 4.23Å; K874-Y885 CarbonylContact C-O 3.18Å; K874-Y885 VanDerWaalsContact C-O 3.3Å; K874-Y885 WeakPolarHBondContact CA-O 3.33Å
875	P	70.7	Confident	71.5	Confident	85 Å²	85	75.2 Å²	75.2	55%	0.552	40%	0.395	S	S	*	.			trans	-66.1	2.1	-169.7	27.7	-37.8	0	0	0	115.5	L873	L873-P875 WeakPolarHBondContact O-CD 3.25Å
876	F	70.9	Confident	71.3	Confident	55 Å²	55	73.1 Å²	73.1	24%	0.241	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	85.2	176.5	-52.7	-71	0	0	0	110.4	K874 Y885 K888 W891	K874-F876 PolarHBondContact O-N 2.81Å; F876-Y885 WeakPolarHBondContact CB-O 3.24Å; F876-Y885 PolarHBondContact N-O 3.25Å; F876-Y885 VanDerWaalsContact N-O 3.16Å; F876-Y885 PolarHBondContact O-N 3.41Å; F876-K888 HydrophobicContact CD1-CB 4.33Å; F876-K888 HydrophobicContact CD1-CG 4.26Å; F876-K888 HydrophobicContact CD2-CB 4.18Å; F876-K888 HydrophobicContact CE1-CB 3.96Å; F876-K888 HydrophobicContact CE1-CD 3.9Å; F876-K888 HydrophobicContact CE1-CG 3.94Å; F876-K888 HydrophobicContact CE2-CB 3.79Å; F876-K888 HydrophobicContact CG-CB 4.44Å; F876-K888 HydrophobicContact CZ-CB 3.68Å; F876-K888 HydrophobicContact CZ-CD 4.14Å; F876-K888 HydrophobicContact CZ-CG 4.16Å; F876-W891 HydrophobicContact CB-CB 3.55Å; F876-W891 HydrophobicContact CB-CD2 4.19Å; F876-W891 HydrophobicContact CB-CG 3.51Å; F876-W891 HydrophobicContact CG-CB 4.31Å; F876-W891 HydrophobicContact CG-CG 4.43Å
877	Q	70.8	Confident	71	Confident	113 Å²	113	76.3 Å²	76.3	53%	0.528	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	140.7	174.1	-174.1	172.9	44.7	0	0	112	C884 W891	Q877-C884 VanDerWaalsContact CG-SG 3.59Å; Q877-W891 PolarHBondContact O-NE1 2.83Å
878	C	72.7	Confident	70.9	Confident	1 Å²	1	81.3 Å²	81.3	1%	0.007	42%	0.42	C	S	.	.			trans	-87.9	110.1	171	-169.1	0	0	0	0	111.6	V880 C881 G882 K883 H894 H898	C878-V880 PolarHBondContact O-N 2.8Å; C878-C881 PolarHBondContact O-N 3.36Å; C878-G882 WeakPolarHBondContact O-CA 3.37Å; C878-G882 PolarHBondContact O-N 2.79Å; C878-K883 WeakPolarHBondContact CB-O 3.43Å; C878-K883 PolarHBondContact N-O 3.11Å; C878-H894 PolarHBondContact SG-NE2 3.25Å; C878-H898 PolarHBondContact SG-CD2 3.21Å; C878-H898 PolarHBondContact SG-NE2 2.86Å
879	Q	69.5	Low	70.6	Confident	183 Å²	183	86.9 Å²	86.9	86%	0.855	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-20.5	174.6	-72.5	-75.3	6.1	0	0	114.7
880	V	66.8	Low	70.7	Confident	96 Å²	96	84 Å²	84	58%	0.582	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-23.3	-174.8	-174.4	0	0	0	0	113.2	C878 H898	C878-V880 PolarHBondContact O-N 2.8Å; V880-H898 HydrophobicContact CB-CB 4.34Å; V880-H898 HydrophobicContact CG1-CB 4.05Å; V880-H898 HydrophobicContact CG2-CB 4.29Å
881	C	67.3	Low	71.1	Confident	53 Å²	53	83.6 Å²	83.6	36%	0.358	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-152.6	24.8	-178.8	76.1	0	0	0	0	114.8	C878 K883 H894 H898	C878-C881 PolarHBondContact O-N 3.36Å; C881-K883 PolarHBondContact O-N 2.82Å; C881-H894 PolarHBondContact SG-NE2 2.84Å; C881-H898 VanDerWaalsContact SG-CE1 3.56Å; C881-H898 PolarHBondContact SG-NE2 3.37Å; C881-H898 VanDerWaalsContact SG-NE2 3.4Å
882	G	65.7	Low	71.3	Confident	42 Å²	42	84.7 Å²	84.7	43%	0.433	43%	0.427	S	S	.	.			trans	67.6	-14.6	175.2	0	0	0	0	0	116.8	C878 C884	C878-G882 WeakPolarHBondContact O-CA 3.37Å; C878-G882 PolarHBondContact O-N 2.79Å; G882-C884 PolarHBondContact O-N 3.03Å; G882-C884 PolarHBondContact O-SG 3.14Å
883	K	69.7	Low	71.5	Confident	109 Å²	109	84.4 Å²	84.4	47%	0.474	42%	0.418	S	S	.	.			trans	-64.4	119.6	-172.3	-70.9	176.4	-174.2	172.1	0	111.8	C878 C881 Y885	C878-K883 WeakPolarHBondContact CB-O 3.43Å; C878-K883 PolarHBondContact N-O 3.11Å; C881-K883 PolarHBondContact O-N 2.82Å; K883-Y885 HydrophobicContact CB-CE2 3.7Å; K883-Y885 WeakPolarHBondContact O-CD2 3.4Å; K883-Y885 VanDerWaalsContact O-CE2 3.27Å; K883-Y885 WeakPolarHBondContact O-CE2 3.41Å
884	C	71.6	Confident	72	Confident	53 Å²	53	81.1 Å²	81.1	36%	0.358	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	137.8	179.6	-51.5	0	0	0	0	111.9	K874 Q877 G882	K874-C884 HydrophobicContact CB-CB 3.38Å; K874-C884 HydrophobicContact CD-CB 3.97Å; K874-C884 HydrophobicContact CG-CB 4.23Å; Q877-C884 VanDerWaalsContact CG-SG 3.59Å; G882-C884 PolarHBondContact O-N 3.03Å; G882-C884 PolarHBondContact O-SG 3.14Å
885	Y	76.1	Confident	72.1	Confident	63 Å²	63	77.5 Å²	77.5	25%	0.247	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	141.4	-178.6	-63.9	-98.9	0	0	0	110.5	K874 F876 K883 W887 D890 W891 H894	K874-Y885 CarbonylContact C-O 3.18Å; K874-Y885 VanDerWaalsContact C-O 3.3Å; K874-Y885 WeakPolarHBondContact CA-O 3.33Å; F876-Y885 WeakPolarHBondContact CB-O 3.24Å; F876-Y885 PolarHBondContact N-O 3.25Å; F876-Y885 VanDerWaalsContact N-O 3.16Å; F876-Y885 PolarHBondContact O-N 3.41Å; K883-Y885 HydrophobicContact CB-CE2 3.7Å; K883-Y885 WeakPolarHBondContact O-CD2 3.4Å; K883-Y885 VanDerWaalsContact O-CE2 3.27Å; K883-Y885 WeakPolarHBondContact O-CE2 3.41Å; Y885-W887 VanDerWaalsContact C-N 3.34Å; Y885-D890 HydrophobicContact CD1-CB 4.16Å; Y885-W891 HydrophobicContact CD2-CB 4.41Å; Y885-W891 HydrophobicContact CG-CB 4.33Å; Y885-H894 HydrophobicContact CE1-CB 4.28Å; Y885-H894 HydrophobicContact CE2-CB 4.07Å; Y885-H894 AromaticContact CE2-CD2 3.22Å; Y885-H894 WeakPolarHBondContact CE2-CD2 3.44Å; Y885-H894 AromaticContact CE2-CG 3.75Å; Y885-H894 AromaticContact CE2-NE2 3.99Å; Y885-H894 AromaticContact CZ-CD2 3.52Å; Y885-H894 AromaticContact CZ-CG 3.58Å; Y885-H894 PolarHBondContact OH-CD2 2.9Å; Y885-H894 VanDerWaalsContact OH-CD2 3.31Å
886	S	70.7	Confident	72.3	Confident	26 Å²	26	78.4 Å²	78.4	18%	0.182	38%	0.383	C	S	.	.	S	Bend	trans	-80.6	-14.5	172.8	51.4	0	0	0	0	113.3
887	W	74.5	Confident	72.2	Confident	86 Å²	86	77 Å²	77	33%	0.326	38%	0.381	S	S	.	.			trans	-118.2	116.5	-173.2	-72.1	16.9	0	0	0	111.4	Q865 Y885 K889 D890 W891	Q865-W887 VanDerWaalsContact CD-NE1 3.29Å; Q865-W887 VanDerWaalsContact CG-CD1 3.49Å; Q865-W887 HydrophobicContact CG-CG 4.4Å; Q865-W887 HydrophobicContact CG-CZ2 4.38Å; Q865-W887 VanDerWaalsContact OE1-CZ2 3.28Å; Y885-W887 VanDerWaalsContact C-N 3.34Å; W887-K889 PolarHBondContact O-N 2.48Å; W887-K889 VanDerWaalsContact O-N 3.09Å; W887-D890 HydrophobicContact CB-CB 4.16Å; W887-D890 VanDerWaalsContact CE3-OD2 3.27Å; W887-D890 PolarHBondContact O-N 2.31Å; W887-W891 PolarHBondContact O-N 3.35Å
888	K	72.1	Confident	71.9	Confident	137 Å²	137	75.4 Å²	75.4	60%	0.596	37%	0.373	S	S	*	.	H	α-helix	trans	-55.1	-31.1	-179.2	-169.7	165.6	-174.8	163	0	114.1	F876 Y892	F876-K888 HydrophobicContact CD1-CB 4.33Å; F876-K888 HydrophobicContact CD1-CG 4.26Å; F876-K888 HydrophobicContact CD2-CB 4.18Å; F876-K888 HydrophobicContact CE1-CB 3.96Å; F876-K888 HydrophobicContact CE1-CD 3.9Å; F876-K888 HydrophobicContact CE1-CG 3.94Å; F876-K888 HydrophobicContact CE2-CB 3.79Å; F876-K888 HydrophobicContact CG-CB 4.44Å; F876-K888 HydrophobicContact CZ-CB 3.68Å; F876-K888 HydrophobicContact CZ-CD 4.14Å; F876-K888 HydrophobicContact CZ-CG 4.16Å; K888-Y892 VanDerWaalsContact O-CB 3.29Å; K888-Y892 WeakPolarHBondContact O-CB 3.49Å; K888-Y892 PolarHBondContact O-N 2.95Å
889	K	74.5	Confident	71.3	Confident	150 Å²	150	79.6 Å²	79.6	65%	0.652	40%	0.402	S	S	*	.	H	α-helix	trans	-69.4	-39.4	176.9	-174.6	-173.6	172.2	-166.4	0	112.3	W887 Y892 S893	W887-K889 PolarHBondContact O-N 2.48Å; W887-K889 VanDerWaalsContact O-N 3.09Å; K889-Y892 PolarHBondContact O-N 3.05Å; K889-S893 PolarHBondContact O-N 3.04Å; K889-S893 PolarHBondContact O-OG 2.91Å
890	D	73.8	Confident	70.7	Confident	60 Å²	60	72.6 Å²	72.6	32%	0.321	37%	0.372	S	S	.	.	H	α-helix	trans	-81.8	-33.8	-175.8	-61.8	-8.1	0	0	0	110.4	Y885 W887 S893 H894	Y885-D890 HydrophobicContact CD1-CB 4.16Å; W887-D890 HydrophobicContact CB-CB 4.16Å; W887-D890 VanDerWaalsContact CE3-OD2 3.27Å; W887-D890 PolarHBondContact O-N 2.31Å; D890-S893 WeakPolarHBondContact CA-OG 3.39Å; D890-S893 PolarHBondContact O-OG 3.38Å; D890-S893 VanDerWaalsContact O-OG 3.09Å; D890-H894 VanDerWaalsContact O-CB 3.23Å; D890-H894 WeakPolarHBondContact O-CB 3.36Å; D890-H894 PolarHBondContact O-N 3.28Å
891	W	80.6	Confident	70.1	Confident	68 Å²	68	73.1 Å²	73.1	26%	0.258	39%	0.386	S	S	.	.	H	α-helix	trans	-55.8	-49	161.1	173.9	83.7	0	0	0	111.6	F876 Q877 Y885 W887 S893 H894 V895	F876-W891 HydrophobicContact CB-CB 3.55Å; F876-W891 HydrophobicContact CB-CD2 4.19Å; F876-W891 HydrophobicContact CB-CG 3.51Å; F876-W891 HydrophobicContact CG-CB 4.31Å; F876-W891 HydrophobicContact CG-CG 4.43Å; Q877-W891 PolarHBondContact O-NE1 2.83Å; Y885-W891 HydrophobicContact CD2-CB 4.41Å; Y885-W891 HydrophobicContact CG-CB 4.33Å; W887-W891 PolarHBondContact O-N 3.35Å; W891-S893 PolarHBondContact O-N 3.13Å; W891-H894 CarbonylContact O-C 3.53Å; W891-H894 PolarHBondContact O-N 2.91Å; W891-V895 HydrophobicContact CD2-CG2 4.04Å; W891-V895 HydrophobicContact CG-CG2 4.3Å; W891-V895 HydrophobicContact CZ2-CG2 3.99Å; W891-V895 WeakPolarHBondContact O-CG2 3.48Å; W891-V895 PolarHBondContact O-N 3.27Å
892	Y	75.4	Confident	69.4	Low	146 Å²	146	77.6 Å²	77.6	57%	0.573	40%	0.402	S	S	*	.	H	α-helix	trans	-67.9	-36.2	-177.5	-174	-102.1	0	0	0	112.7	K888 K889 H894 K896	K888-Y892 VanDerWaalsContact O-CB 3.29Å; K888-Y892 WeakPolarHBondContact O-CB 3.49Å; K888-Y892 PolarHBondContact O-N 2.95Å; K889-Y892 PolarHBondContact O-N 3.05Å; Y892-H894 VanDerWaalsContact C-N 3.32Å; Y892-K896 WeakPolarHBondContact O-CB 3.48Å; Y892-K896 PolarHBondContact O-N 3.22Å
893	S	72.6	Confident	69.5	Low	34 Å²	34	76.9 Å²	76.9	24%	0.238	39%	0.39	C	S	.	.	H	α-helix	trans	-69.8	-29.9	172.8	65.5	0	0	0	0	112.3	K889 D890 W891 S897	K889-S893 PolarHBondContact O-N 3.04Å; K889-S893 PolarHBondContact O-OG 2.91Å; D890-S893 WeakPolarHBondContact CA-OG 3.39Å; D890-S893 PolarHBondContact O-OG 3.38Å; D890-S893 VanDerWaalsContact O-OG 3.09Å; W891-S893 PolarHBondContact O-N 3.13Å; S893-S897 PolarHBondContact O-N 2.82Å
894	H	74.8	Confident	69.5	Low	24 Å²	24	75.2 Å²	75.2	11%	0.111	38%	0.383	C	S	.	.	H	α-helix	trans	-77.1	-44.6	174	175.1	54	0	0	0	113.9	C878 C881 Y885 D890 W891 Y892 K896 S897 H898	C878-H894 PolarHBondContact SG-NE2 3.25Å; C881-H894 PolarHBondContact SG-NE2 2.84Å; Y885-H894 HydrophobicContact CE1-CB 4.28Å; Y885-H894 HydrophobicContact CE2-CB 4.07Å; Y885-H894 AromaticContact CE2-CD2 3.22Å; Y885-H894 WeakPolarHBondContact CE2-CD2 3.44Å; Y885-H894 AromaticContact CE2-CG 3.75Å; Y885-H894 AromaticContact CE2-NE2 3.99Å; Y885-H894 AromaticContact CZ-CD2 3.52Å; Y885-H894 AromaticContact CZ-CG 3.58Å; Y885-H894 PolarHBondContact OH-CD2 2.9Å; Y885-H894 VanDerWaalsContact OH-CD2 3.31Å; D890-H894 VanDerWaalsContact O-CB 3.23Å; D890-H894 WeakPolarHBondContact O-CB 3.36Å; D890-H894 PolarHBondContact O-N 3.28Å; W891-H894 CarbonylContact O-C 3.53Å; W891-H894 PolarHBondContact O-N 2.91Å; Y892-H894 VanDerWaalsContact C-N 3.32Å; H894-K896 PolarHBondContact O-N 3Å; H894-S897 PolarHBondContact ND1-OG 2.92Å; H894-S897 VanDerWaalsContact ND1-OG 3.17Å; H894-S897 WeakPolarHBondContact O-CA 3.4Å; H894-S897 WeakPolarHBondContact O-CB 3.3Å; H894-S897 PolarHBondContact O-N 2.93Å; H894-S897 PolarHBondContact O-OG 2.93Å; H894-H898 AromaticContact CE1-CD2 3.9Å; H894-H898 AromaticContact CE1-CE1 3.74Å; H894-H898 AromaticContact CE1-NE2 3.09Å; H894-H898 PolarHBondContact CE1-NE2 3.14Å; H894-H898 AromaticContact ND1-NE2 3.97Å; H894-H898 AromaticContact NE2-CD2 3.91Å; H894-H898 AromaticContact NE2-NE2 3.11Å; H894-H898 PolarHBondContact NE2-NE2 3.3Å; H894-H898 VanDerWaalsContact NE2-NE2 3.11Å; H894-H898 PolarHBondContact O-CD2 3.09Å; H894-H898 PolarHBondContact O-N 2.91Å
895	V	73.8	Confident	69.1	Low	43 Å²	43	78.1 Å²	78.1	26%	0.261	39%	0.389	S	S	.	.	H	α-helix	trans	-59.2	-33.8	169.9	171.8	0	0	0	0	110.2	W891 S897 H898 S899	W891-V895 HydrophobicContact CD2-CG2 4.04Å; W891-V895 HydrophobicContact CG-CG2 4.3Å; W891-V895 HydrophobicContact CZ2-CG2 3.99Å; W891-V895 WeakPolarHBondContact O-CG2 3.48Å; W891-V895 PolarHBondContact O-N 3.27Å; V895-S897 VanDerWaalsContact C-N 3.32Å; V895-S897 PolarHBondContact O-N 3.48Å; V895-H898 PolarHBondContact O-N 2.89Å; V895-S899 PolarHBondContact O-OG 3.49Å
896	K	74.3	Confident	68.8	Low	104 Å²	104	75.3 Å²	75.3	45%	0.452	38%	0.379	S	S	.	.	H	α-helix	trans	-69.3	-22.8	169.7	-169.8	154.7	-173	152.8	0	114.2	Y892 H894 H898 S899 V900	Y892-K896 WeakPolarHBondContact O-CB 3.48Å; Y892-K896 PolarHBondContact O-N 3.22Å; H894-K896 PolarHBondContact O-N 3Å; K896-H898 VanDerWaalsContact C-N 3.34Å; K896-S899 WeakPolarHBondContact CA-OG 3.46Å; K896-S899 PolarHBondContact O-N 2.79Å; K896-V900 HydrophobicContact CG-CG2 3.82Å; K896-V900 WeakPolarHBondContact O-CB 3.33Å; K896-V900 WeakPolarHBondContact O-CG2 3.45Å; K896-V900 PolarHBondContact O-N 3Å
897	S	69	Low	68.6	Low	26 Å²	26	81.1 Å²	81.1	18%	0.182	41%	0.408	C	S	.	.	H	α-helix	trans	-69.6	-29.3	171.8	66.2	0	0	0	0	113.5	S893 H894 V895 S899 F914	S893-S897 PolarHBondContact O-N 2.82Å; H894-S897 PolarHBondContact ND1-OG 2.92Å; H894-S897 VanDerWaalsContact ND1-OG 3.17Å; H894-S897 WeakPolarHBondContact O-CA 3.4Å; H894-S897 WeakPolarHBondContact O-CB 3.3Å; H894-S897 PolarHBondContact O-N 2.93Å; H894-S897 PolarHBondContact O-OG 2.93Å; V895-S897 VanDerWaalsContact C-N 3.32Å; V895-S897 PolarHBondContact O-N 3.48Å; S897-S899 VanDerWaalsContact C-N 3.34Å; S897-F914 WeakPolarHBondContact O-CD1 3.26Å
898	H	64.7	Low	67.6	Low	79 Å²	79	81.5 Å²	81.5	37%	0.366	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-14.8	174.5	-62.5	-64.6	0	0	0	114.5	C878 V880 C881 H894 V895 K896	C878-H898 PolarHBondContact SG-CD2 3.21Å; C878-H898 PolarHBondContact SG-NE2 2.86Å; V880-H898 HydrophobicContact CB-CB 4.34Å; V880-H898 HydrophobicContact CG1-CB 4.05Å; V880-H898 HydrophobicContact CG2-CB 4.29Å; C881-H898 VanDerWaalsContact SG-CE1 3.56Å; C881-H898 PolarHBondContact SG-NE2 3.37Å; C881-H898 VanDerWaalsContact SG-NE2 3.4Å; H894-H898 AromaticContact CE1-CD2 3.9Å; H894-H898 AromaticContact CE1-CE1 3.74Å; H894-H898 AromaticContact CE1-NE2 3.09Å; H894-H898 PolarHBondContact CE1-NE2 3.14Å; H894-H898 AromaticContact ND1-NE2 3.97Å; H894-H898 AromaticContact NE2-CD2 3.91Å; H894-H898 AromaticContact NE2-NE2 3.11Å; H894-H898 PolarHBondContact NE2-NE2 3.3Å; H894-H898 VanDerWaalsContact NE2-NE2 3.11Å; H894-H898 PolarHBondContact O-CD2 3.09Å; H894-H898 PolarHBondContact O-N 2.91Å; V895-H898 PolarHBondContact O-N 2.89Å; K896-H898 VanDerWaalsContact C-N 3.34Å
899	S	60.6	Low	67	Low	90 Å²	90	77.4 Å²	77.4	63%	0.629	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.6	12	-173.4	47.3	0	0	0	0	113.8	V895 K896 S897	V895-S899 PolarHBondContact O-OG 3.49Å; K896-S899 WeakPolarHBondContact CA-OG 3.46Å; K896-S899 PolarHBondContact O-N 2.79Å; S897-S899 VanDerWaalsContact C-N 3.34Å
900	V	57.2	Low	66.3	Low	36 Å²	36	72.9 Å²	72.9	22%	0.218	40%	0.403	C	S	.	.			trans	-108.2	98.8	177	165.3	0	0	0	0	108.7	K896 E902	K896-V900 HydrophobicContact CG-CG2 3.82Å; K896-V900 WeakPolarHBondContact O-CB 3.33Å; K896-V900 WeakPolarHBondContact O-CG2 3.45Å; K896-V900 PolarHBondContact O-N 3Å; V900-E902 WeakPolarHBondContact CG1-O 3.39Å; V900-E902 PolarHBondContact O-N 3.27Å
901	A	52.7	Low	65.8	Low	106 Å²	106	75.4 Å²	75.4	88%	0.876	41%	0.411	S	S	*	.	S	Bend	trans	-69.1	-14.9	179.9	0	0	0	0	0	114.2
902	E	52.3	Low	65.2	Low	147 Å²	147	77.3 Å²	77.3	69%	0.687	42%	0.423	S	S	*	.	S	Bend	trans	-123.8	101.6	169.8	-78.5	-152.6	114.7	0	0	111	V900	V900-E902 WeakPolarHBondContact CG1-O 3.39Å; V900-E902 PolarHBondContact O-N 3.27Å
903	P	69.3	Low	65.1	Low	28 Å²	28	72.3 Å²	72.3	18%	0.182	40%	0.404	C	S	.	.			trans	-62.9	149.3	171.5	-22.1	34.8	0	0	0	111.9	K905 E912 F914	P903-K905 PolarHBondContact O-N 2.85Å; P903-E912 HydrophobicContact CB-CB 3.67Å; P903-E912 HydrophobicContact CB-CG 4.07Å; P903-E912 HydrophobicContact CG-CB 4.44Å; P903-F914 HydrophobicContact CB-CD1 4.4Å; P903-F914 HydrophobicContact CB-CE1 4.14Å; P903-F914 HydrophobicContact CB-CZ 4.47Å; P903-F914 HydrophobicContact CG-CD1 4.34Å; P903-F914 HydrophobicContact CG-CE1 3.71Å; P903-F914 HydrophobicContact CG-CZ 4.15Å
904	F	69.6	Low	64.8	Low	73 Å²	73	74.7 Å²	74.7	32%	0.32	41%	0.411	S	S	.	.			trans	-73.1	80.6	171.7	-63	-77.3	0	0	0	110	F913 K916 F919	F904-F913 WeakPolarHBondContact CA-O 3.3Å; F904-F913 HydrophobicContact CB-CB 4.43Å; F904-F913 VanDerWaalsContact CB-O 3.23Å; F904-F913 WeakPolarHBondContact CB-O 3.13Å; F904-F913 VanDerWaalsContact CD2-O 3.29Å; F904-F913 WeakPolarHBondContact CD2-O 3.33Å; F904-F913 PolarHBondContact N-O 2.89Å; F904-F913 PolarHBondContact O-N 3.45Å; F904-K916 HydrophobicContact CD2-CB 4.29Å; F904-K916 HydrophobicContact CE1-CD 4.18Å; F904-K916 HydrophobicContact CE1-CG 4.3Å; F904-K916 HydrophobicContact CE2-CB 3.78Å; F904-K916 HydrophobicContact CE2-CG 4.37Å; F904-K916 HydrophobicContact CZ-CB 3.95Å; F904-K916 HydrophobicContact CZ-CD 3.97Å; F904-K916 HydrophobicContact CZ-CG 4.1Å; F904-F919 HydrophobicContact CB-CB 3.86Å; F904-F919 HydrophobicContact CB-CD1 4.4Å; F904-F919 HydrophobicContact CB-CD2 3.66Å; F904-F919 HydrophobicContact CB-CE2 4.27Å; F904-F919 HydrophobicContact CB-CG 3.72Å; F904-F919 HydrophobicContact CG-CB 4.4Å; F904-F919 HydrophobicContact CG-CG 4.43Å; F904-F919 WeakPolarHBondContact O-CD2 3.45Å
905	K	63	Low	64.6	Low	114 Å²	114	76.3 Å²	76.3	50%	0.496	42%	0.418	S	S	.	.			trans	-63.4	136.5	175.2	59.5	-163.2	171.6	-159	0	112.1	P903 N907 E912 F919	P903-K905 PolarHBondContact O-N 2.85Å; K905-N907 PolarHBondContact O-OD1 3.38Å; K905-E912 HydrophobicContact CB-CG 4.2Å; K905-F919 WeakPolarHBondContact O-CE2 3.42Å
906	C	69.4	Low	64.3	Low	4 Å²	4	79.9 Å²	79.9	3%	0.027	43%	0.43	C	S	.	.			trans	-91.3	104.6	176.6	-175.8	0	0	0	0	110.7	V908 C909 G910 K911 F919 H922	C906-V908 PolarHBondContact O-N 2.81Å; C906-C909 PolarHBondContact O-N 3.3Å; C906-C909 VanDerWaalsContact SG-SG 3.67Å; C906-G910 PolarHBondContact O-N 3.35Å; C906-K911 WeakPolarHBondContact CB-O 3.49Å; C906-K911 PolarHBondContact N-O 3.44Å; C906-F919 HydrophobicContact CB-CE2 4.25Å; C906-H922 PolarHBondContact SG-NE2 3.02Å
907	N	65.8	Low	64.1	Low	149 Å²	149	76.9 Å²	76.9	80%	0.797	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	3.6	-176.8	-57	20.4	0	0	0	116.5	K905	K905-N907 PolarHBondContact O-OD1 3.38Å
908	V	55.3	Low	64.2	Low	93 Å²	93	79 Å²	79	56%	0.564	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.9	-7.7	178.2	-165	0	0	0	0	112.7	C906 H928	C906-V908 PolarHBondContact O-N 2.81Å; V908-H928 HydrophobicContact CB-CB 4.13Å; V908-H928 WeakPolarHBondContact CG1-ND1 3.19Å; V908-H928 HydrophobicContact CG2-CB 3.99Å
909	C	58	Low	64.5	Low	52 Å²	52	77.5 Å²	77.5	35%	0.351	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147.4	13.8	176.8	72.2	0	0	0	0	115	C906 K911 H922	C906-C909 PolarHBondContact O-N 3.3Å; C906-C909 VanDerWaalsContact SG-SG 3.67Å; C909-K911 PolarHBondContact O-N 3.26Å; C909-H922 PolarHBondContact SG-CE1 3.05Å; C909-H922 PolarHBondContact SG-NE2 3.02Å
910	G	60.7	Low	65	Low	54 Å²	54	81.6 Å²	81.6	56%	0.557	43%	0.428	S	S	*	.			trans	72.6	-44.5	-177.5	0	0	0	0	0	114.3	C906 E912	C906-G910 PolarHBondContact O-N 3.35Å; G910-E912 PolarHBondContact O-N 3.45Å
911	K	63.7	Low	65.6	Low	114 Å²	114	87.3 Å²	87.3	50%	0.496	45%	0.446	S	S	.	.			trans	-45.4	127.8	-164.9	-67.1	-174.3	-176.4	-68.3	0	114.1	C906 C909 F913	C906-K911 WeakPolarHBondContact CB-O 3.49Å; C906-K911 PolarHBondContact N-O 3.44Å; C909-K911 PolarHBondContact O-N 3.26Å; K911-F913 HydrophobicContact CB-CE2 3.75Å; K911-F913 HydrophobicContact CB-CZ 4.02Å; K911-F913 VanDerWaalsContact O-CD2 3.32Å; K911-F913 WeakPolarHBondContact O-CD2 3.36Å; K911-F913 VanDerWaalsContact O-CE2 3.27Å; K911-F913 WeakPolarHBondContact O-CE2 3.21Å
912	E	68	Low	66.4	Low	108 Å²	108	83.8 Å²	83.8	51%	0.505	41%	0.411	S	S	.	.			trans	-93.8	141.8	-175.8	-64.7	-160.8	137.1	0	0	111.8	P903 K905 G910	P903-E912 HydrophobicContact CB-CB 3.67Å; P903-E912 HydrophobicContact CB-CG 4.07Å; P903-E912 HydrophobicContact CG-CB 4.44Å; K905-E912 HydrophobicContact CB-CG 4.2Å; G910-E912 PolarHBondContact O-N 3.45Å
913	F	72.8	Confident	67.2	Low	41 Å²	41	78.4 Å²	78.4	18%	0.18	39%	0.388	C	S	.	.			trans	-136.8	121.9	-178.2	-64.3	-84.1	0	0	0	110.6	F904 K911 L918 F919 H922	F904-F913 WeakPolarHBondContact CA-O 3.3Å; F904-F913 HydrophobicContact CB-CB 4.43Å; F904-F913 VanDerWaalsContact CB-O 3.23Å; F904-F913 WeakPolarHBondContact CB-O 3.13Å; F904-F913 VanDerWaalsContact CD2-O 3.29Å; F904-F913 WeakPolarHBondContact CD2-O 3.33Å; F904-F913 PolarHBondContact N-O 2.89Å; F904-F913 PolarHBondContact O-N 3.45Å; K911-F913 HydrophobicContact CB-CE2 3.75Å; K911-F913 HydrophobicContact CB-CZ 4.02Å; K911-F913 VanDerWaalsContact O-CD2 3.32Å; K911-F913 WeakPolarHBondContact O-CD2 3.36Å; K911-F913 VanDerWaalsContact O-CE2 3.27Å; K911-F913 WeakPolarHBondContact O-CE2 3.21Å; F913-L918 HydrophobicContact CD1-CB 4.1Å; F913-F919 HydrophobicContact CB-CB 3.96Å; F913-F919 HydrophobicContact CD2-CD2 4.05Å; F913-F919 HydrophobicContact CG-CB 4.43Å; F913-H922 HydrophobicContact CD2-CB 4.4Å; F913-H922 HydrophobicContact CE1-CB 3.93Å; F913-H922 HydrophobicContact CE2-CB 3.8Å; F913-H922 AromaticContact CE2-CD2 3.4Å; F913-H922 WeakPolarHBondContact CE2-CD2 3.47Å; F913-H922 AromaticContact CE2-CG 3.35Å; F913-H922 AromaticContact CE2-ND1 3.8Å; F913-H922 AromaticContact CE2-NE2 3.9Å; F913-H922 HydrophobicContact CZ-CB 3.54Å; F913-H922 AromaticContact CZ-CD2 3.83Å; F913-H922 AromaticContact CZ-CG 3.27Å; F913-H922 AromaticContact CZ-ND1 3.42Å; F913-H922 WeakPolarHBondContact CZ-ND1 3.46Å
914	F	66	Low	67.1	Low	84 Å²	84	86.2 Å²	86.2	37%	0.368	42%	0.419	S	S	.	.	S	Bend	trans	-79.5	-16.8	-179.3	-58.1	-87	0	0	0	113.7	S897 P903	S897-F914 WeakPolarHBondContact O-CD1 3.26Å; P903-F914 HydrophobicContact CB-CD1 4.4Å; P903-F914 HydrophobicContact CB-CE1 4.14Å; P903-F914 HydrophobicContact CB-CZ 4.47Å; P903-F914 HydrophobicContact CG-CD1 4.34Å; P903-F914 HydrophobicContact CG-CE1 3.71Å; P903-F914 HydrophobicContact CG-CZ 4.15Å
915	E	70.5	Confident	66.6	Low	58 Å²	58	91.3 Å²	91.3	27%	0.271	44%	0.441	S	S	.	.	S	Bend	trans	-111.1	126.3	174.2	-162.1	-162.3	174	0	0	111.9	A917 L918 F919	E915-A917 HydrophobicContact CG-CB 4.19Å; E915-A917 PolarHBondContact O-N 3.41Å; E915-A917 VanDerWaalsContact O-N 3.08Å; E915-A917 WeakPolarHBondContact OE1-CB 3.28Å; E915-L918 HydrophobicContact CB-CB 4.19Å; E915-L918 HydrophobicContact CB-CD1 4.01Å; E915-L918 HydrophobicContact CB-CG 3.98Å; E915-L918 WeakPolarHBondContact O-CA 3.32Å; E915-L918 PolarHBondContact O-N 3.27Å; E915-L918 WeakPolarHBondContact OE2-CG 3.24Å; E915-F919 PolarHBondContact O-N 3.42Å
916	K	68.6	Low	66.4	Low	118 Å²	118	87.3 Å²	87.3	51%	0.513	43%	0.429	S	S	.	.	H	α-helix	trans	-57.8	-23.7	176	-161.1	165.9	-165.5	164.1	0	113.6	F904 R920	F904-K916 HydrophobicContact CD2-CB 4.29Å; F904-K916 HydrophobicContact CE1-CD 4.18Å; F904-K916 HydrophobicContact CE1-CG 4.3Å; F904-K916 HydrophobicContact CE2-CB 3.78Å; F904-K916 HydrophobicContact CE2-CG 4.37Å; F904-K916 HydrophobicContact CZ-CB 3.95Å; F904-K916 HydrophobicContact CZ-CD 3.97Å; F904-K916 HydrophobicContact CZ-CG 4.1Å; K916-R920 WeakPolarHBondContact O-CB 3.38Å; K916-R920 VanDerWaalsContact O-CG 3.23Å; K916-R920 WeakPolarHBondContact O-CG 3.04Å; K916-R920 PolarHBondContact O-N 2.98Å
917	A	69.8	Low	65.6	Low	41 Å²	41	93 Å²	93	34%	0.339	46%	0.463	S	S	.	.	H	α-helix	trans	-78.9	-37.6	173.4	0	0	0	0	0	112.7	E915 R921	E915-A917 HydrophobicContact CG-CB 4.19Å; E915-A917 PolarHBondContact O-N 3.41Å; E915-A917 VanDerWaalsContact O-N 3.08Å; E915-A917 WeakPolarHBondContact OE1-CB 3.28Å; A917-R921 VanDerWaalsContact O-CB 3.28Å; A917-R921 WeakPolarHBondContact O-CB 3.25Å; A917-R921 PolarHBondContact O-N 3.02Å
918	L	69.8	Low	65.1	Low	69 Å²	69	89.1 Å²	89.1	36%	0.361	44%	0.441	S	S	.	.	H	α-helix	trans	-66.1	-44.1	170.7	-66.6	176	0	0	0	110.8	F913 E915 R920 R921 H922	F913-L918 HydrophobicContact CD1-CB 4.1Å; E915-L918 HydrophobicContact CB-CB 4.19Å; E915-L918 HydrophobicContact CB-CD1 4.01Å; E915-L918 HydrophobicContact CB-CG 3.98Å; E915-L918 WeakPolarHBondContact O-CA 3.32Å; E915-L918 PolarHBondContact O-N 3.27Å; E915-L918 WeakPolarHBondContact OE2-CG 3.24Å; L918-R920 PolarHBondContact O-N 2.93Å; L918-R921 CarbonylContact O-C 3.53Å; L918-R921 PolarHBondContact O-N 3.23Å; L918-R921 VanDerWaalsContact O-N 3.16Å; L918-H922 WeakPolarHBondContact O-CB 3.45Å; L918-H922 PolarHBondContact O-N 3.16Å
919	F	71.8	Confident	64.4	Low	48 Å²	48	86.9 Å²	86.9	21%	0.211	44%	0.436	C	S	.	.	H	α-helix	trans	-55.1	-51.5	171.7	179.8	-104.8	0	0	0	112	F904 K905 C906 F913 E915 R921 H922 V923	F904-F919 HydrophobicContact CB-CB 3.86Å; F904-F919 HydrophobicContact CB-CD1 4.4Å; F904-F919 HydrophobicContact CB-CD2 3.66Å; F904-F919 HydrophobicContact CB-CE2 4.27Å; F904-F919 HydrophobicContact CB-CG 3.72Å; F904-F919 HydrophobicContact CG-CB 4.4Å; F904-F919 HydrophobicContact CG-CG 4.43Å; F904-F919 WeakPolarHBondContact O-CD2 3.45Å; K905-F919 WeakPolarHBondContact O-CE2 3.42Å; C906-F919 HydrophobicContact CB-CE2 4.25Å; F913-F919 HydrophobicContact CB-CB 3.96Å; F913-F919 HydrophobicContact CD2-CD2 4.05Å; F913-F919 HydrophobicContact CG-CB 4.43Å; E915-F919 PolarHBondContact O-N 3.42Å; F919-R921 VanDerWaalsContact C-N 3.31Å; F919-R921 PolarHBondContact O-N 3.21Å; F919-H922 WeakPolarHBondContact O-CB 3.45Å; F919-H922 PolarHBondContact O-N 2.85Å; F919-H922 VanDerWaalsContact O-N 3.16Å; F919-V923 HydrophobicContact CD1-CG2 4.34Å; F919-V923 HydrophobicContact CD2-CG2 4.18Å; F919-V923 HydrophobicContact CE1-CG2 3.97Å; F919-V923 HydrophobicContact CE2-CG2 3.81Å; F919-V923 HydrophobicContact CG-CG2 4.45Å; F919-V923 HydrophobicContact CZ-CG2 3.7Å; F919-V923 WeakPolarHBondContact O-CG2 3.33Å; F919-V923 PolarHBondContact O-N 3.16Å
920	R	70.9	Confident	64	Low	176 Å²	176	94.5 Å²	94.5	66%	0.664	46%	0.464	S	S	*	.	H	α-helix	trans	-61.5	-35.7	176.3	-79.1	172.3	169.4	-174.5	-4	113	K916 L918 K924	K916-R920 WeakPolarHBondContact O-CB 3.38Å; K916-R920 VanDerWaalsContact O-CG 3.23Å; K916-R920 WeakPolarHBondContact O-CG 3.04Å; K916-R920 PolarHBondContact O-N 2.98Å; L918-R920 PolarHBondContact O-N 2.93Å; R920-K924 WeakPolarHBondContact O-CB 3.27Å; R920-K924 PolarHBondContact O-N 2.85Å; R920-K924 VanDerWaalsContact O-N 3.15Å
921	R	69.4	Low	63	Low	157 Å²	157	101.5 Å²	101.5	59%	0.592	48%	0.479	S	S	*	.	H	α-helix	trans	-69.8	-38	175.3	-169.9	-175.5	-59.3	151.2	6.1	111.3	A917 L918 F919 K925	A917-R921 VanDerWaalsContact O-CB 3.28Å; A917-R921 WeakPolarHBondContact O-CB 3.25Å; A917-R921 PolarHBondContact O-N 3.02Å; L918-R921 CarbonylContact O-C 3.53Å; L918-R921 PolarHBondContact O-N 3.23Å; L918-R921 VanDerWaalsContact O-N 3.16Å; F919-R921 VanDerWaalsContact C-N 3.31Å; F919-R921 PolarHBondContact O-N 3.21Å; R921-K925 WeakPolarHBondContact O-CB 3.42Å; R921-K925 PolarHBondContact O-N 3.2Å; R921-K925 VanDerWaalsContact O-N 3.13Å
922	H	70.9	Confident	62	Low	32 Å²	32	100.3 Å²	100.3	15%	0.148	50%	0.498	C	S	.	.	H	α-helix	trans	-66.1	-53.8	174.3	168	77.2	0	0	0	111.2	C906 C909 F913 L918 F919 K924 K925 A926	C906-H922 PolarHBondContact SG-NE2 3.02Å; C909-H922 PolarHBondContact SG-CE1 3.05Å; C909-H922 PolarHBondContact SG-NE2 3.02Å; F913-H922 HydrophobicContact CD2-CB 4.4Å; F913-H922 HydrophobicContact CE1-CB 3.93Å; F913-H922 HydrophobicContact CE2-CB 3.8Å; F913-H922 AromaticContact CE2-CD2 3.4Å; F913-H922 WeakPolarHBondContact CE2-CD2 3.47Å; F913-H922 AromaticContact CE2-CG 3.35Å; F913-H922 AromaticContact CE2-ND1 3.8Å; F913-H922 AromaticContact CE2-NE2 3.9Å; F913-H922 HydrophobicContact CZ-CB 3.54Å; F913-H922 AromaticContact CZ-CD2 3.83Å; F913-H922 AromaticContact CZ-CG 3.27Å; F913-H922 AromaticContact CZ-ND1 3.42Å; F913-H922 WeakPolarHBondContact CZ-ND1 3.46Å; L918-H922 WeakPolarHBondContact O-CB 3.45Å; L918-H922 PolarHBondContact O-N 3.16Å; F919-H922 WeakPolarHBondContact O-CB 3.45Å; F919-H922 PolarHBondContact O-N 2.85Å; F919-H922 VanDerWaalsContact O-N 3.16Å; H922-K924 PolarHBondContact O-N 3.5Å; H922-K925 CarbonylContact O-C 3.56Å; H922-K925 PolarHBondContact O-N 3.08Å; H922-A926 PolarHBondContact O-N 2.93Å
923	V	68.3	Low	60.3	Low	33 Å²	33	106.4 Å²	106.4	20%	0.2	52%	0.517	C	S	.	.	H	α-helix	trans	-64.3	-14	178.3	176	0	0	0	0	113.3	F919 A926 G929	F919-V923 HydrophobicContact CD1-CG2 4.34Å; F919-V923 HydrophobicContact CD2-CG2 4.18Å; F919-V923 HydrophobicContact CE1-CG2 3.97Å; F919-V923 HydrophobicContact CE2-CG2 3.81Å; F919-V923 HydrophobicContact CG-CG2 4.45Å; F919-V923 HydrophobicContact CZ-CG2 3.7Å; F919-V923 WeakPolarHBondContact O-CG2 3.33Å; F919-V923 PolarHBondContact O-N 3.16Å; V923-A926 CarbonylContact C-O 3.49Å; V923-A926 VanDerWaalsContact C-O 3.28Å; V923-G929 PolarHBondContact O-N 3.34Å
924	K	67.6	Low	58.8	Low	192 Å²	192	110.6 Å²	110.6	84%	0.835	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-8.4	171.5	-171.3	170.5	179.5	-179.7	0	113.8	R920 H922	R920-K924 WeakPolarHBondContact O-CB 3.27Å; R920-K924 PolarHBondContact O-N 2.85Å; R920-K924 VanDerWaalsContact O-N 3.15Å; H922-K924 PolarHBondContact O-N 3.5Å
925	K	59.5	Low	57.7	Low	181 Å²	181	114.5 Å²	114.5	79%	0.787	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.9	-41.7	-175.7	-172.9	-179.6	178.6	-174.2	0	112.6	R921 H922	R921-K925 WeakPolarHBondContact O-CB 3.42Å; R921-K925 PolarHBondContact O-N 3.2Å; R921-K925 VanDerWaalsContact O-N 3.13Å; H922-K925 CarbonylContact O-C 3.56Å; H922-K925 PolarHBondContact O-N 3.08Å
926	A	57	Low	56.3	Low	29 Å²	29	120.6 Å²	120.6	24%	0.24	59%	0.591	C	S	.	*	T	Hydrogen-bonded Turn	trans	-79	136	150.3	0	0	0	0	0	107.7	H922 V923 H928	H922-A926 PolarHBondContact O-N 2.93Å; V923-A926 CarbonylContact C-O 3.49Å; V923-A926 VanDerWaalsContact C-O 3.28Å; A926-H928 VanDerWaalsContact C-N 3.3Å; A926-H928 PolarHBondContact O-N 3.01Å
927	T	53.1	Low	55.4	Low	123 Å²	123	118 Å²	118	76%	0.755	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	57.8	-158	41.3	0	0	0	0	113.5
928	H	56.1	Low	54.7	Low	68 Å²	68	121.8 Å²	121.8	32%	0.315	60%	0.596	S	S	.	*			trans	-123.4	6.1	-168.2	-54	-42	0	0	0	115.4	V908 A926 K930	V908-H928 HydrophobicContact CB-CB 4.13Å; V908-H928 WeakPolarHBondContact CG1-ND1 3.19Å; V908-H928 HydrophobicContact CG2-CB 3.99Å; A926-H928 VanDerWaalsContact C-N 3.3Å; A926-H928 PolarHBondContact O-N 3.01Å; H928-K930 PolarHBondContact O-N 2.95Å
929	G	39.7	Very low	54.3	Low	46 Å²	46	122.3 Å²	122.3	47%	0.474	60%	0.597	S	S	.	*			trans	-72.5	114.3	176.6	0	0	0	0	0	113.7	V923 K931	V923-G929 PolarHBondContact O-N 3.34Å; G929-K931 PolarHBondContact O-N 3.38Å
930	K	49.3	Very low	54.1	Low	213 Å²	213	124.8 Å²	124.8	93%	0.926	61%	0.605	S	S	*	*	S	Bend	trans	-67	83.2	172.1	-75.8	-176.8	176.3	176.2	0	112.8	H928	H928-K930 PolarHBondContact O-N 2.95Å
931	K	40.4	Very low	54.2	Low	201 Å²	201	120.1 Å²	120.1	87%	0.874	59%	0.591	S	S	*	*	S	Bend	trans	-170.2	137.3	141.7	-104.9	173.9	-175	-170.9	0	108.4	G929 R933	G929-K931 PolarHBondContact O-N 3.38Å; K931-R933 PolarHBondContact O-N 2.92Å; K931-R933 VanDerWaalsContact O-N 3.14Å
932	G	43.4	Very low	54.7	Low	88 Å²	88	112.8 Å²	112.8	91%	0.907	56%	0.564	S	S	*	*			trans	-63.4	111.2	-160.7	0	0	0	0	0	115.4
933	R	32.1	Very low	54.7	Low	236 Å²	236	119.7 Å²	119.7	89%	0.891	60%	0.596	S	S	*	*			trans	-128.3	111.7	139.6	-172.8	172.5	-74.3	-158.5	-3.8	106.8	K931	K931-R933 PolarHBondContact O-N 2.92Å; K931-R933 VanDerWaalsContact O-N 3.14Å
934	V	40.2	Very low	54.8	Low	130 Å²	130	125.1 Å²	125.1	79%	0.788	62%	0.619	S	S	*	*			trans	-59	159.4	179.3	174.7	0	0	0	0	109.9	Q936	V934-Q936 PolarHBondContact O-N 3.17Å
935	K	44	Very low	55.3	Low	166 Å²	166	118.6 Å²	118.6	72%	0.722	60%	0.597	S	S	*	*			trans	-41	103.8	171.8	-73.1	-178.7	175.9	-177.5	0	111.4	N937	K935-N937 VanDerWaalsContact C-N 3.26Å
936	Q	41.3	Very low	55.9	Low	186 Å²	186	112.1 Å²	112.1	87%	0.869	58%	0.581	S	S	*	*				-95.3	76.8	125.3	-78.2	-175.9	-16	0	0	106.6	V934 L938	V934-Q936 PolarHBondContact O-N 3.17Å; Q936-L938 PolarHBondContact O-N 2.89Å
937	N	49.3	Very low	56.8	Low	63 Å²	63	118.7 Å²	118.7	34%	0.337	60%	0.6	S	S	.	*			trans	-55.6	104.8	144.1	-82.5	6.1	0	0	0	104.7	K935 E939	K935-N937 VanDerWaalsContact C-N 3.26Å; N937-E939 HydrophobicContact CB-CG 4.09Å; N937-E939 VanDerWaalsContact CB-OE1 3.22Å; N937-E939 WeakPolarHBondContact CB-OE1 3.46Å; N937-E939 PolarHBondContact ND2-OE1 3.3Å; N937-E939 PolarHBondContact O-N 2.84Å
938	L	55.3	Low	57.9	Low	120 Å²	120	118.5 Å²	118.5	63%	0.628	59%	0.589	S	S	*	*			trans	-77	71.4	163.5	-170.8	71.6	0	0	0	106.5	Q936 R940	Q936-L938 PolarHBondContact O-N 2.89Å; L938-R940 VanDerWaalsContact CD2-NH2 3.35Å; L938-R940 HydrophobicContact CG-CG 4.37Å; L938-R940 WeakPolarHBondContact O-CG 3.44Å; L938-R940 PolarHBondContact O-N 2.9Å; L938-R940 VanDerWaalsContact O-N 3.08Å
939	E	61.4	Low	58.8	Low	80 Å²	80	117 Å²	117	37%	0.374	58%	0.581	S	S	.	*			trans	-57.1	110.6	170.1	-89.2	152.9	-135.4	0	0	107	N937 E941 T950	N937-E939 HydrophobicContact CB-CG 4.09Å; N937-E939 VanDerWaalsContact CB-OE1 3.22Å; N937-E939 WeakPolarHBondContact CB-OE1 3.46Å; N937-E939 PolarHBondContact ND2-OE1 3.3Å; N937-E939 PolarHBondContact O-N 2.84Å; E939-E941 PolarHBondContact O-N 3.35Å; E939-T950 HydrophobicContact CG-CG2 4.14Å
940	R	66.8	Low	60.4	Low	101 Å²	101	119.5 Å²	119.5	38%	0.381	59%	0.588	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.3	104.6	-178	-63.8	-161.7	172	-134.8	-4.1	107.7	L938 F949 Y955	L938-R940 VanDerWaalsContact CD2-NH2 3.35Å; L938-R940 HydrophobicContact CG-CG 4.37Å; L938-R940 WeakPolarHBondContact O-CG 3.44Å; L938-R940 PolarHBondContact O-N 2.9Å; L938-R940 VanDerWaalsContact O-N 3.08Å; R940-F949 PolarHBondContact N-O 2.88Å; R940-F949 PolarHBondContact O-N 3.04Å; R940-Y955 HydrophobicContact CB-CD1 4Å; R940-Y955 HydrophobicContact CB-CD2 3.33Å; R940-Y955 HydrophobicContact CB-CE1 4.11Å; R940-Y955 HydrophobicContact CB-CE2 3.45Å; R940-Y955 VanDerWaalsContact CB-CE2 3.45Å; R940-Y955 HydrophobicContact CB-CG 3.61Å; R940-Y955 HydrophobicContact CG-CG 4.49Å; R940-Y955 VanDerWaalsContact O-CD2 3.24Å; R940-Y955 WeakPolarHBondContact O-CD2 3.49Å; R940-Y955 WeakPolarHBondContact O-CE2 3.1Å
941	E	74.1	Confident	61.2	Low	77 Å²	77	114.5 Å²	114.5	36%	0.36	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.9	124.5	177.7	-41.6	-162.8	-169.9	0	0	108	E939 Q943 R947 K948	E939-E941 PolarHBondContact O-N 3.35Å; E941-Q943 PolarHBondContact O-N 2.85Å; E941-R947 WeakPolarHBondContact CA-O 3.36Å; E941-K948 HydrophobicContact CB-CG 4.4Å; E941-K948 HydrophobicContact CG-CB 4.35Å; E941-K948 HydrophobicContact CG-CD 3.96Å; E941-K948 HydrophobicContact CG-CG 3.82Å; E941-K948 WeakPolarHBondContact OE1-CD 3.27Å; E941-K948 WeakPolarHBondContact OE1-CE 3.41Å; E941-K948 IonicContact OE1-NZ 3.33Å; E941-K948 PolarHBondContact OE1-NZ 3.38Å; E941-K948 WeakPolarHBondContact OE2-CE 3.24Å; E941-K948 IonicContact OE2-NZ 3.59Å; E941-K948 PolarHBondContact OE2-NZ 2.78Å
942	C	78.1	Confident	62.7	Low	4 Å²	4	108.7 Å²	108.7	3%	0.027	55%	0.546	C	S	.	.			trans	-69.7	116.8	176	-173.9	0	0	0	0	109.1	Q944 C945 G946 R947 Y955 H958	C942-Q944 PolarHBondContact O-N 3.41Å; C942-Q944 VanDerWaalsContact O-N 3.08Å; C942-C945 PolarHBondContact O-N 3.33Å; C942-C945 VanDerWaalsContact O-N 3.11Å; C942-G946 WeakPolarHBondContact O-CA 3.42Å; C942-G946 PolarHBondContact O-N 2.87Å; C942-R947 PolarHBondContact N-O 2.82Å; C942-Y955 HydrophobicContact CB-CE2 4.47Å; C942-H958 VanDerWaalsContact CB-NE2 3.26Å; C942-H958 WeakPolarHBondContact CB-NE2 3.17Å
943	Q	72.7	Confident	63.8	Low	177 Å²	177	114 Å²	114	83%	0.827	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-25.1	178.6	-60.9	-65.6	-48.6	0	0	112.3	E941	E941-Q943 PolarHBondContact O-N 2.85Å
944	Q	69.6	Low	65.7	Low	147 Å²	147	105.5 Å²	105.5	69%	0.687	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-16.3	-179.4	-145.1	70.2	18.3	0	0	114.8	C942 H962	C942-Q944 PolarHBondContact O-N 3.41Å; C942-Q944 VanDerWaalsContact O-N 3.08Å; Q944-H962 HydrophobicContact CB-CB 4.36Å; Q944-H962 HydrophobicContact CG-CB 4.31Å
945	C	77.1	Confident	67.2	Low	54 Å²	54	101.1 Å²	101.1	37%	0.365	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-156.9	10.7	-178	73.9	0	0	0	0	116.5	C942 R947 H958 H962	C942-C945 PolarHBondContact O-N 3.33Å; C942-C945 VanDerWaalsContact O-N 3.11Å; C945-R947 PolarHBondContact O-N 3.28Å; C945-H958 PolarHBondContact SG-CE1 3.18Å; C945-H958 PolarHBondContact SG-NE2 3.22Å; C945-H962 PolarHBondContact SG-NE2 3.37Å
946	G	73.6	Confident	68.5	Low	45 Å²	45	100.3 Å²	100.3	46%	0.464	47%	0.471	S	S	.	.			trans	69.5	-7.9	178	0	0	0	0	0	116.6	C942 K948	C942-G946 WeakPolarHBondContact O-CA 3.42Å; C942-G946 PolarHBondContact O-N 2.87Å; G946-K948 PolarHBondContact O-N 3.16Å
947	R	74.4	Confident	70.1	Confident	167 Å²	167	96.5 Å²	96.5	63%	0.63	45%	0.449	S	S	*	.			trans	-63.1	124.7	-177.5	-71.2	-179.3	178.1	-176.4	0.6	111.2	E941 C942 C945 F949	E941-R947 WeakPolarHBondContact CA-O 3.36Å; C942-R947 PolarHBondContact N-O 2.82Å; C945-R947 PolarHBondContact O-N 3.28Å; R947-F949 HydrophobicContact CB-CD2 4.49Å; R947-F949 HydrophobicContact CB-CE2 3.53Å; R947-F949 HydrophobicContact CB-CZ 3.96Å; R947-F949 VanDerWaalsContact O-CD2 3.25Å; R947-F949 WeakPolarHBondContact O-CD2 3.37Å; R947-F949 VanDerWaalsContact O-CE2 3.28Å; R947-F949 WeakPolarHBondContact O-CE2 3.31Å
948	K	76.3	Confident	71.3	Confident	120 Å²	120	94.5 Å²	94.5	52%	0.522	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	127.9	-176.2	-45.6	-161.5	-177.9	-148.3	0	111.2	E941 G946	E941-K948 HydrophobicContact CB-CG 4.4Å; E941-K948 HydrophobicContact CG-CB 4.35Å; E941-K948 HydrophobicContact CG-CD 3.96Å; E941-K948 HydrophobicContact CG-CG 3.82Å; E941-K948 WeakPolarHBondContact OE1-CD 3.27Å; E941-K948 WeakPolarHBondContact OE1-CE 3.41Å; E941-K948 IonicContact OE1-NZ 3.33Å; E941-K948 PolarHBondContact OE1-NZ 3.38Å; E941-K948 WeakPolarHBondContact OE2-CE 3.24Å; E941-K948 IonicContact OE2-NZ 3.59Å; E941-K948 PolarHBondContact OE2-NZ 2.78Å; G946-K948 PolarHBondContact O-N 3.16Å
949	F	76.4	Confident	72.3	Confident	35 Å²	35	90.6 Å²	90.6	15%	0.154	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	127.2	-179	-65.3	-91.4	0	0	0	111.9	R940 R947 E954 Y955 H958	R940-F949 PolarHBondContact N-O 2.88Å; R940-F949 PolarHBondContact O-N 3.04Å; R947-F949 HydrophobicContact CB-CD2 4.49Å; R947-F949 HydrophobicContact CB-CE2 3.53Å; R947-F949 HydrophobicContact CB-CZ 3.96Å; R947-F949 VanDerWaalsContact O-CD2 3.25Å; R947-F949 WeakPolarHBondContact O-CD2 3.37Å; R947-F949 VanDerWaalsContact O-CE2 3.28Å; R947-F949 WeakPolarHBondContact O-CE2 3.31Å; F949-E954 HydrophobicContact CD1-CB 3.82Å; F949-E954 HydrophobicContact CE1-CB 4.47Å; F949-Y955 HydrophobicContact CB-CD2 4.32Å; F949-Y955 HydrophobicContact CD2-CD2 4.01Å; F949-Y955 HydrophobicContact CG-CD2 4.47Å; F949-H958 AromaticContact CD2-CD2 3.98Å; F949-H958 HydrophobicContact CE1-CB 4.18Å; F949-H958 HydrophobicContact CE2-CB 4.11Å; F949-H958 AromaticContact CE2-CD2 3.04Å; F949-H958 WeakPolarHBondContact CE2-CD2 3.26Å; F949-H958 AromaticContact CE2-CG 3.62Å; F949-H958 AromaticContact CE2-NE2 3.55Å; F949-H958 HydrophobicContact CZ-CB 3.71Å; F949-H958 AromaticContact CZ-CD2 3.38Å; F949-H958 WeakPolarHBondContact CZ-CD2 3.4Å; F949-H958 AromaticContact CZ-CG 3.42Å; F949-H958 VanDerWaalsContact CZ-CG 3.42Å; F949-H958 AromaticContact CZ-NE2 3.9Å
950	T	72.4	Confident	73	Confident	100 Å²	100	88.5 Å²	88.5	61%	0.613	41%	0.408	S	S	*	.	S	Bend	trans	-79.2	-18.3	175.3	56.4	0	0	0	0	112.9	E939	E939-T950 HydrophobicContact CG-CG2 4.14Å
951	Q	66.7	Low	73.2	Confident	108 Å²	108	89.6 Å²	89.6	51%	0.505	42%	0.421	S	S	.	.	S	Bend	trans	-118	126.6	180	-58.2	-174.5	75.2	0	0	112.7	R953 E954 Y955	Q951-R953 PolarHBondContact O-N 3.32Å; Q951-R953 VanDerWaalsContact O-N 3.12Å; Q951-E954 HydrophobicContact CB-CB 4.31Å; Q951-E954 HydrophobicContact CB-CG 4.04Å; Q951-E954 WeakPolarHBondContact CB-OE2 3.38Å; Q951-E954 WeakPolarHBondContact CG-OE2 3.4Å; Q951-E954 PolarHBondContact NE2-OE1 3.07Å; Q951-E954 PolarHBondContact NE2-OE2 3.33Å; Q951-E954 PolarHBondContact O-N 3.13Å; Q951-Y955 PolarHBondContact O-N 2.95Å
952	L	70.6	Confident	72.9	Confident	78 Å²	78	89.6 Å²	89.6	41%	0.408	42%	0.421	S	S	.	.	H	α-helix	trans	-61.2	-21.4	179.2	-179.1	60.5	0	0	0	114.6	Y955 R956	L952-Y955 HydrophobicContact CD1-CD1 4.21Å; L952-R956 PolarHBondContact O-N 3.16Å
953	R	68	Low	72.3	Confident	200 Å²	200	95.7 Å²	95.7	76%	0.755	45%	0.449	S	S	*	.	H	α-helix	trans	-74.1	-42.9	172.6	-178	-175.2	-77.4	-86.7	7.2	111.1	Q951 R956 R957	Q951-R953 PolarHBondContact O-N 3.32Å; Q951-R953 VanDerWaalsContact O-N 3.12Å; R953-R956 PolarHBondContact O-N 3.39Å; R953-R957 PolarHBondContact O-N 2.95Å
954	E	70.5	Confident	71.9	Confident	58 Å²	58	89.8 Å²	89.8	27%	0.271	44%	0.436	S	S	.	.	H	α-helix	trans	-71.5	-39.7	-178.1	-61.1	176.9	146.5	0	0	110.6	F949 Q951 H958	F949-E954 HydrophobicContact CD1-CB 3.82Å; F949-E954 HydrophobicContact CE1-CB 4.47Å; Q951-E954 HydrophobicContact CB-CB 4.31Å; Q951-E954 HydrophobicContact CB-CG 4.04Å; Q951-E954 WeakPolarHBondContact CB-OE2 3.38Å; Q951-E954 WeakPolarHBondContact CG-OE2 3.4Å; Q951-E954 PolarHBondContact NE2-OE1 3.07Å; Q951-E954 PolarHBondContact NE2-OE2 3.33Å; Q951-E954 PolarHBondContact O-N 3.13Å; E954-H958 VanDerWaalsContact O-CB 3.26Å; E954-H958 WeakPolarHBondContact O-CB 3.31Å; E954-H958 PolarHBondContact O-N 3.42Å
955	Y	73.4	Confident	71.7	Confident	38 Å²	38	86.8 Å²	86.8	15%	0.149	43%	0.427	C	S	.	.	H	α-helix	trans	-55.6	-48.5	169	-177.1	-108.9	0	0	0	112.7	R940 C942 F949 Q951 L952 H958 I959	R940-Y955 HydrophobicContact CB-CD1 4Å; R940-Y955 HydrophobicContact CB-CD2 3.33Å; R940-Y955 HydrophobicContact CB-CE1 4.11Å; R940-Y955 HydrophobicContact CB-CE2 3.45Å; R940-Y955 VanDerWaalsContact CB-CE2 3.45Å; R940-Y955 HydrophobicContact CB-CG 3.61Å; R940-Y955 HydrophobicContact CG-CG 4.49Å; R940-Y955 VanDerWaalsContact O-CD2 3.24Å; R940-Y955 WeakPolarHBondContact O-CD2 3.49Å; R940-Y955 WeakPolarHBondContact O-CE2 3.1Å; C942-Y955 HydrophobicContact CB-CE2 4.47Å; F949-Y955 HydrophobicContact CB-CD2 4.32Å; F949-Y955 HydrophobicContact CD2-CD2 4.01Å; F949-Y955 HydrophobicContact CG-CD2 4.47Å; Q951-Y955 PolarHBondContact O-N 2.95Å; L952-Y955 HydrophobicContact CD1-CD1 4.21Å; Y955-H958 PolarHBondContact O-N 3.42Å; Y955-I959 HydrophobicContact CD1-CD1 4.15Å; Y955-I959 HydrophobicContact CD2-CD1 4.49Å; Y955-I959 HydrophobicContact CE1-CD1 3.46Å; Y955-I959 VanDerWaalsContact CE1-CD1 3.46Å; Y955-I959 HydrophobicContact CE2-CD1 3.87Å; Y955-I959 PolarHBondContact O-N 3.18Å; Y955-I959 WeakPolarHBondContact OH-CD1 3.48Å
956	R	71.3	Confident	71.3	Confident	148 Å²	148	89.9 Å²	89.9	56%	0.558	44%	0.435	S	S	*	.	H	α-helix	trans	-65.5	-50.1	179.6	-94.1	-172.8	-82.4	178.9	-13.2	112.6	L952 R953 H958 I959 N960	L952-R956 PolarHBondContact O-N 3.16Å; R953-R956 PolarHBondContact O-N 3.39Å; R956-H958 PolarHBondContact O-N 3.27Å; R956-H958 VanDerWaalsContact O-N 3.15Å; R956-I959 PolarHBondContact O-N 2.86Å; R956-N960 PolarHBondContact O-N 3.04Å; R956-N960 PolarHBondContact O-OD1 3.25Å
957	R	73.8	Confident	71.1	Confident	107 Å²	107	91 Å²	91	40%	0.404	43%	0.434	S	S	.	.	H	α-helix	trans	-49.8	-42.4	173.6	175.3	-175.5	68.4	-163.1	-4	112	R953 N961 D979	R953-R957 PolarHBondContact O-N 2.95Å; R957-N961 PolarHBondContact O-N 3.13Å; R957-D979 WeakPolarHBondContact CD-OD2 3.3Å; R957-D979 HydrophobicContact CG-CB 4.43Å; R957-D979 IonicContact NH1-OD2 2.81Å
958	H	75.9	Confident	71.1	Confident	21 Å²	21	86.7 Å²	86.7	10%	0.097	42%	0.42	C	S	.	.	H	α-helix	trans	-71.6	-37.8	-179.8	170.1	59.1	0	0	0	113.3	C942 C945 F949 E954 Y955 R956 N961 H962	C942-H958 VanDerWaalsContact CB-NE2 3.26Å; C942-H958 WeakPolarHBondContact CB-NE2 3.17Å; C945-H958 PolarHBondContact SG-CE1 3.18Å; C945-H958 PolarHBondContact SG-NE2 3.22Å; F949-H958 AromaticContact CD2-CD2 3.98Å; F949-H958 HydrophobicContact CE1-CB 4.18Å; F949-H958 HydrophobicContact CE2-CB 4.11Å; F949-H958 AromaticContact CE2-CD2 3.04Å; F949-H958 WeakPolarHBondContact CE2-CD2 3.26Å; F949-H958 AromaticContact CE2-CG 3.62Å; F949-H958 AromaticContact CE2-NE2 3.55Å; F949-H958 HydrophobicContact CZ-CB 3.71Å; F949-H958 AromaticContact CZ-CD2 3.38Å; F949-H958 WeakPolarHBondContact CZ-CD2 3.4Å; F949-H958 AromaticContact CZ-CG 3.42Å; F949-H958 VanDerWaalsContact CZ-CG 3.42Å; F949-H958 AromaticContact CZ-NE2 3.9Å; E954-H958 VanDerWaalsContact O-CB 3.26Å; E954-H958 WeakPolarHBondContact O-CB 3.31Å; E954-H958 PolarHBondContact O-N 3.42Å; Y955-H958 PolarHBondContact O-N 3.42Å; R956-H958 PolarHBondContact O-N 3.27Å; R956-H958 VanDerWaalsContact O-N 3.15Å; H958-N961 WeakPolarHBondContact O-CB 3.22Å; H958-N961 PolarHBondContact O-N 2.87Å; H958-H962 AromaticContact CE1-CD2 3.37Å; H958-H962 PolarHBondContact CE1-CD2 3.27Å; H958-H962 AromaticContact CE1-NE2 3.09Å; H958-H962 PolarHBondContact CE1-NE2 3.46Å; H958-H962 AromaticContact ND1-CD2 3.89Å; H958-H962 AromaticContact ND1-NE2 3.95Å; H958-H962 AromaticContact NE2-CD2 3.68Å; H958-H962 AromaticContact NE2-NE2 3.58Å; H958-H962 PolarHBondContact O-CD2 3.09Å; H958-H962 PolarHBondContact O-N 3.32Å
959	I	76.2	Confident	71.1	Confident	37 Å²	37	86.7 Å²	86.7	19%	0.19	42%	0.422	C	S	.	.	H	α-helix	trans	-67.5	-41.2	172.4	-80.1	-175.3	0	0	0	112	Y955 R956 N961 H962 Q963	Y955-I959 HydrophobicContact CD1-CD1 4.15Å; Y955-I959 HydrophobicContact CD2-CD1 4.49Å; Y955-I959 HydrophobicContact CE1-CD1 3.46Å; Y955-I959 VanDerWaalsContact CE1-CD1 3.46Å; Y955-I959 HydrophobicContact CE2-CD1 3.87Å; Y955-I959 PolarHBondContact O-N 3.18Å; Y955-I959 WeakPolarHBondContact OH-CD1 3.48Å; R956-I959 PolarHBondContact O-N 2.86Å; I959-N961 PolarHBondContact O-N 3.05Å; I959-H962 CarbonylContact O-C 3.59Å; I959-H962 WeakPolarHBondContact O-CA 3.17Å; I959-H962 WeakPolarHBondContact O-CB 3.21Å; I959-H962 PolarHBondContact O-N 3.11Å; I959-Q963 HydrophobicContact CG2-CG 4.03Å; I959-Q963 VanDerWaalsContact CG2-OE1 3.24Å; I959-Q963 WeakPolarHBondContact O-CG 3.02Å; I959-Q963 PolarHBondContact O-N 3.16Å
960	N	75.4	Confident	71.3	Confident	36 Å²	36	85.1 Å²	85.1	19%	0.193	42%	0.415	C	S	.	.	H	α-helix	trans	-54.7	-38.2	173	-70.2	29	0	0	0	111.1	R956 H962 Q963 G964 A978	R956-N960 PolarHBondContact O-N 3.04Å; R956-N960 PolarHBondContact O-OD1 3.25Å; N960-H962 VanDerWaalsContact C-N 3.31Å; N960-H962 PolarHBondContact O-N 3.34Å; N960-Q963 PolarHBondContact O-N 3.15Å; N960-G964 PolarHBondContact O-N 2.96Å; N960-A978 HydrophobicContact CB-CB 3.78Å
961	N	70.5	Confident	71.4	Confident	124 Å²	124	86 Å²	86	66%	0.663	42%	0.415	S	S	*	.	H	α-helix	trans	-70.7	-19.6	174.9	-157.8	116.6	0	0	0	114	R957 H958 I959	R957-N961 PolarHBondContact O-N 3.13Å; H958-N961 WeakPolarHBondContact O-CB 3.22Å; H958-N961 PolarHBondContact O-N 2.87Å; I959-N961 PolarHBondContact O-N 3.05Å
962	H	68.8	Low	71.7	Confident	78 Å²	78	85.1 Å²	85.1	36%	0.361	42%	0.418	S	S	.	.	H	α-helix	trans	-89.6	-30.1	172.3	-85.3	-67.6	0	0	0	112.9	Q944 C945 H958 I959 N960 G964	Q944-H962 HydrophobicContact CB-CB 4.36Å; Q944-H962 HydrophobicContact CG-CB 4.31Å; C945-H962 PolarHBondContact SG-NE2 3.37Å; H958-H962 AromaticContact CE1-CD2 3.37Å; H958-H962 PolarHBondContact CE1-CD2 3.27Å; H958-H962 AromaticContact CE1-NE2 3.09Å; H958-H962 PolarHBondContact CE1-NE2 3.46Å; H958-H962 AromaticContact ND1-CD2 3.89Å; H958-H962 AromaticContact ND1-NE2 3.95Å; H958-H962 AromaticContact NE2-CD2 3.68Å; H958-H962 AromaticContact NE2-NE2 3.58Å; H958-H962 PolarHBondContact O-CD2 3.09Å; H958-H962 PolarHBondContact O-N 3.32Å; I959-H962 CarbonylContact O-C 3.59Å; I959-H962 WeakPolarHBondContact O-CA 3.17Å; I959-H962 WeakPolarHBondContact O-CB 3.21Å; I959-H962 PolarHBondContact O-N 3.11Å; N960-H962 VanDerWaalsContact C-N 3.31Å; N960-H962 PolarHBondContact O-N 3.34Å; H962-G964 VanDerWaalsContact C-N 3.33Å
963	Q	65.8	Low	71.9	Confident	131 Å²	131	83.9 Å²	83.9	61%	0.612	42%	0.415	S	S	*	.	S	Bend	trans	-87.3	1.6	-178.2	-66.6	-177.8	-49	0	0	113.4	I959 N960 V965	I959-Q963 HydrophobicContact CG2-CG 4.03Å; I959-Q963 VanDerWaalsContact CG2-OE1 3.24Å; I959-Q963 WeakPolarHBondContact O-CG 3.02Å; I959-Q963 PolarHBondContact O-N 3.16Å; N960-Q963 PolarHBondContact O-N 3.15Å; Q963-V965 HydrophobicContact CB-CG2 4.09Å; Q963-V965 PolarHBondContact O-N 3.33Å
964	G	63.2	Low	72.2	Confident	54 Å²	54	77.2 Å²	77.2	56%	0.557	41%	0.409	S	S	*	.			trans	71.3	-25.4	-174.2	0	0	0	0	0	114.6	N960 H962 K966	N960-G964 PolarHBondContact O-N 2.96Å; H962-G964 VanDerWaalsContact C-N 3.33Å; G964-K966 WeakPolarHBondContact O-CG 3.08Å; G964-K966 PolarHBondContact O-N 3.28Å
965	V	65.9	Low	72.6	Confident	83 Å²	83	78 Å²	78	50%	0.503	42%	0.417	S	S	.	.			trans	-56.6	107.3	-179	-170.4	0	0	0	0	111.2	Q963 P967	Q963-V965 HydrophobicContact CB-CG2 4.09Å; Q963-V965 PolarHBondContact O-N 3.33Å; V965-P967 HydrophobicContact CG1-CG 4.11Å; V965-P967 WeakPolarHBondContact O-CD 3.26Å
966	K	68	Low	72.8	Confident	120 Å²	120	77 Å²	77	52%	0.522	42%	0.417	S	S	.	.			trans	-112.1	84.8	178	-73.1	154.3	160.2	-168	0	108.8	G964 F968 A976 W977	G964-K966 WeakPolarHBondContact O-CG 3.08Å; G964-K966 PolarHBondContact O-N 3.28Å; K966-F968 PolarHBondContact O-N 2.93Å; K966-A976 HydrophobicContact CB-CB 3.65Å; K966-A976 HydrophobicContact CD-CB 4.09Å; K966-A976 WeakPolarHBondContact CD-O 3.5Å; K966-A976 VanDerWaalsContact CE-O 3.23Å; K966-A976 WeakPolarHBondContact CE-O 3.43Å; K966-A976 HydrophobicContact CG-CB 4.41Å; K966-A976 WeakPolarHBondContact CG-O 3.47Å; K966-W977 CarbonylContact C-O 3.54Å; K966-W977 WeakPolarHBondContact CA-O 3.38Å
967	P	70.8	Confident	73	Confident	69 Å²	69	72.5 Å²	72.5	45%	0.448	40%	0.4	S	S	.	.			trans	-75	17.1	-168.1	-8.6	24.9	0	0	0	114.9	V965	V965-P967 HydrophobicContact CG1-CG 4.11Å; V965-P967 WeakPolarHBondContact O-CD 3.26Å
968	F	72.6	Confident	73	Confident	75 Å²	75	68.1 Å²	68.1	33%	0.329	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	86.4	-168.3	-57.1	-68.8	0	0	0	108.4	K966 A976 W977 A980 L983	K966-F968 PolarHBondContact O-N 2.93Å; F968-A976 WeakPolarHBondContact O-CA 3.42Å; F968-W977 VanDerWaalsContact O-CE3 3.32Å; F968-W977 PolarHBondContact O-N 2.78Å; F968-A980 HydrophobicContact CD1-CB 3.78Å; F968-A980 HydrophobicContact CD2-CB 4.26Å; F968-A980 VanDerWaalsContact CD2-N 3.31Å; F968-A980 HydrophobicContact CE1-CB 3.73Å; F968-A980 HydrophobicContact CE2-CB 4.2Å; F968-A980 HydrophobicContact CG-CB 4.06Å; F968-A980 HydrophobicContact CZ-CB 3.94Å; F968-L983 HydrophobicContact CB-CB 4.12Å; F968-L983 HydrophobicContact CB-CD2 3.88Å
969	E	76.9	Confident	72.9	Confident	120 Å²	120	68.7 Å²	68.7	56%	0.561	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	158.3	172.5	68.4	-133.8	136.2	0	0	112.5	L971 V975 A976 L983	E969-L971 HydrophobicContact CG-CD2 4.47Å; E969-V975 CarbonylContact C-O 3.52Å; E969-V975 WeakPolarHBondContact CA-O 3.42Å; E969-A976 HydrophobicContact CB-CB 3.83Å; E969-L983 VanDerWaalsContact O-CD1 3.22Å; E969-L983 WeakPolarHBondContact O-CD1 3.37Å; E969-L983 WeakPolarHBondContact O-CD2 3.46Å
970	C	81.1	Confident	72.8	Confident	3 Å²	3	69.1 Å²	69.1	2%	0.02	40%	0.4	C	S	.	.			trans	-98.7	113.4	168.7	-175.1	0	0	0	0	109.1	T972 C973 G974 V975 W977 L983	C970-T972 PolarHBondContact O-N 3.11Å; C970-C973 PolarHBondContact O-N 3.08Å; C970-G974 PolarHBondContact O-N 3.14Å; C970-V975 PolarHBondContact N-O 3.36Å; C970-W977 HydrophobicContact CB-CH2 3.83Å; C970-W977 HydrophobicContact CB-CZ3 3.68Å; C970-L983 HydrophobicContact CB-CD1 3.75Å
971	L	74.2	Confident	72.9	Confident	118 Å²	118	76.7 Å²	76.7	62%	0.618	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-18	176.9	-57	172.9	0	0	0	113	E969 I1049	E969-L971 HydrophobicContact CG-CD2 4.47Å; L971-I1049 HydrophobicContact CD1-CG2 3.75Å
972	T	72.1	Confident	73.3	Confident	90 Å²	90	72.3 Å²	72.3	55%	0.552	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-12.9	178.7	-37.2	0	0	0	0	114.2	C970 H990	C970-T972 PolarHBondContact O-N 3.11Å; T972-H990 HydrophobicContact CG2-CB 4.05Å
973	C	75.7	Confident	73.9	Confident	51 Å²	51	70.1 Å²	70.1	35%	0.345	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-155.7	7.9	-179.8	73.2	0	0	0	0	116.6	C970 V975 H986 H990	C970-C973 PolarHBondContact O-N 3.08Å; C973-V975 PolarHBondContact O-N 3.26Å; C973-H986 PolarHBondContact SG-CE1 3.48Å; C973-H986 PolarHBondContact SG-NE2 3.48Å; C973-H990 WeakPolarHBondContact CB-NE2 3.44Å
974	G	74.1	Confident	74.5	Confident	61 Å²	61	68.9 Å²	68.9	63%	0.629	39%	0.388	S	S	*	.			trans	69.3	-15.1	179	0	0	0	0	0	116.3	C970 A976	C970-G974 PolarHBondContact O-N 3.14Å; G974-A976 PolarHBondContact O-N 3.05Å
975	V	78.6	Confident	75.3	Confident	73 Å²	73	70.9 Å²	70.9	44%	0.442	38%	0.379	S	S	.	.			trans	-63.8	138.7	178.5	-176.3	0	0	0	0	109.8	E969 C970 C973 W977	E969-V975 CarbonylContact C-O 3.52Å; E969-V975 WeakPolarHBondContact CA-O 3.42Å; C970-V975 PolarHBondContact N-O 3.36Å; C973-V975 PolarHBondContact O-N 3.26Å; V975-W977 HydrophobicContact CB-CH2 3.65Å; V975-W977 HydrophobicContact CB-CZ2 3.88Å; V975-W977 HydrophobicContact CG1-CH2 3.69Å; V975-W977 HydrophobicContact CG1-CZ2 3.4Å; V975-W977 WeakPolarHBondContact O-CH2 3.49Å; V975-W977 WeakPolarHBondContact O-CZ3 3.48Å
976	A	77.3	Confident	76	Confident	19 Å²	19	68.6 Å²	68.6	16%	0.157	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	146.5	-176.8	0	0	0	0	0	114.3	K966 F968 E969 G974	K966-A976 HydrophobicContact CB-CB 3.65Å; K966-A976 HydrophobicContact CD-CB 4.09Å; K966-A976 WeakPolarHBondContact CD-O 3.5Å; K966-A976 VanDerWaalsContact CE-O 3.23Å; K966-A976 WeakPolarHBondContact CE-O 3.43Å; K966-A976 HydrophobicContact CG-CB 4.41Å; K966-A976 WeakPolarHBondContact CG-O 3.47Å; F968-A976 WeakPolarHBondContact O-CA 3.42Å; E969-A976 HydrophobicContact CB-CB 3.83Å; G974-A976 PolarHBondContact O-N 3.05Å
977	W	75.4	Confident	76.5	Confident	52 Å²	52	64.9 Å²	64.9	20%	0.197	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	153.6	-178.7	-57	-88.1	0	0	0	113.1	K966 F968 C970 V975 D979 L983 H986	K966-W977 CarbonylContact C-O 3.54Å; K966-W977 WeakPolarHBondContact CA-O 3.38Å; F968-W977 VanDerWaalsContact O-CE3 3.32Å; F968-W977 PolarHBondContact O-N 2.78Å; C970-W977 HydrophobicContact CB-CH2 3.83Å; C970-W977 HydrophobicContact CB-CZ3 3.68Å; V975-W977 HydrophobicContact CB-CH2 3.65Å; V975-W977 HydrophobicContact CB-CZ2 3.88Å; V975-W977 HydrophobicContact CG1-CH2 3.69Å; V975-W977 HydrophobicContact CG1-CZ2 3.4Å; V975-W977 WeakPolarHBondContact O-CH2 3.49Å; V975-W977 WeakPolarHBondContact O-CZ3 3.48Å; W977-D979 PolarHBondContact O-N 3.4Å; W977-L983 HydrophobicContact CE3-CB 3.81Å; W977-L983 HydrophobicContact CE3-CD1 3.79Å; W977-L983 HydrophobicContact CE3-CG 4.41Å; W977-L983 HydrophobicContact CZ3-CB 4.38Å; W977-L983 HydrophobicContact CZ3-CD1 3.49Å; W977-L983 VanDerWaalsContact CZ3-CD1 3.49Å; W977-H986 HydrophobicContact CH2-CB 3.91Å; W977-H986 AromaticContact CH2-CD2 2.97Å; W977-H986 WeakPolarHBondContact CH2-CD2 3.46Å; W977-H986 AromaticContact CH2-CE1 3.96Å; W977-H986 AromaticContact CH2-CG 3.32Å; W977-H986 AromaticContact CH2-ND1 3.95Å; W977-H986 AromaticContact CH2-NE2 3.4Å; W977-H986 WeakPolarHBondContact CH2-NE2 3.23Å; W977-H986 HydrophobicContact CZ2-CB 3.63Å; W977-H986 AromaticContact CZ2-CD2 3.51Å; W977-H986 AromaticContact CZ2-CG 3.3Å; W977-H986 AromaticContact CZ2-ND1 3.75Å; W977-H986 AromaticContact CZ2-NE2 3.99Å; W977-H986 AromaticContact CZ3-CD2 3.7Å
978	A	74.1	Confident	77	Confident	15 Å²	15	63.7 Å²	63.7	12%	0.124	34%	0.336	C	S	.	.	S	Bend	trans	-69.6	-4.2	171.4	0	0	0	0	0	114.8	N960	N960-A978 HydrophobicContact CB-CB 3.78Å
979	D	74.8	Confident	77.1	Confident	34 Å²	34	64 Å²	64	18%	0.182	34%	0.344	C	S	.	.	S	Bend	trans	-148.2	119.6	-164.7	-132.2	17.8	0	0	0	110.9	R957 W977 R981 S982 L983	R957-D979 WeakPolarHBondContact CD-OD2 3.3Å; R957-D979 HydrophobicContact CG-CB 4.43Å; R957-D979 IonicContact NH1-OD2 2.81Å; W977-D979 PolarHBondContact O-N 3.4Å; D979-R981 PolarHBondContact O-N 3.08Å; D979-S982 WeakPolarHBondContact O-CA 3.45Å; D979-S982 WeakPolarHBondContact O-CB 3.23Å; D979-S982 PolarHBondContact O-N 3.11Å; D979-L983 PolarHBondContact O-N 3.01Å
980	A	73.8	Confident	77	Confident	46 Å²	46	63.1 Å²	63.1	38%	0.38	34%	0.34	S	S	.	.	H	α-helix	trans	-57.6	-22.6	178.5	0	0	0	0	0	114.4	F968 K984	F968-A980 HydrophobicContact CD1-CB 3.78Å; F968-A980 HydrophobicContact CD2-CB 4.26Å; F968-A980 VanDerWaalsContact CD2-N 3.31Å; F968-A980 HydrophobicContact CE1-CB 3.73Å; F968-A980 HydrophobicContact CE2-CB 4.2Å; F968-A980 HydrophobicContact CG-CB 4.06Å; F968-A980 HydrophobicContact CZ-CB 3.94Å; A980-K984 PolarHBondContact O-N 3.04Å
981	R	77.4	Confident	76.5	Confident	194 Å²	194	66.1 Å²	66.1	73%	0.732	36%	0.358	S	S	*	.	H	α-helix	trans	-73.5	-29	173.6	-176.5	176.9	-74.3	-152.3	-4	112.3	D979 R985	D979-R981 PolarHBondContact O-N 3.08Å; R981-R985 PolarHBondContact O-N 3.47Å
982	S	79.6	Confident	76.4	Confident	32 Å²	32	62.7 Å²	62.7	22%	0.224	35%	0.352	C	S	.	.	H	α-helix	trans	-73.5	-44.1	172.7	-61.4	0	0	0	0	110.2	D979 R985 H986	D979-S982 WeakPolarHBondContact O-CA 3.45Å; D979-S982 WeakPolarHBondContact O-CB 3.23Å; D979-S982 PolarHBondContact O-N 3.11Å; S982-R985 PolarHBondContact O-N 3.05Å; S982-R985 VanDerWaalsContact O-N 3.13Å; S982-H986 PolarHBondContact O-N 3.18Å
983	L	80.6	Confident	76.5	Confident	33 Å²	33	61 Å²	61	17%	0.173	34%	0.338	C	S	.	.	H	α-helix	trans	-54.2	-58.7	170.9	174.3	61.5	0	0	0	111.4	F968 E969 C970 W977 D979 R985 H986 V987	F968-L983 HydrophobicContact CB-CB 4.12Å; F968-L983 HydrophobicContact CB-CD2 3.88Å; E969-L983 VanDerWaalsContact O-CD1 3.22Å; E969-L983 WeakPolarHBondContact O-CD1 3.37Å; E969-L983 WeakPolarHBondContact O-CD2 3.46Å; C970-L983 HydrophobicContact CB-CD1 3.75Å; W977-L983 HydrophobicContact CE3-CB 3.81Å; W977-L983 HydrophobicContact CE3-CD1 3.79Å; W977-L983 HydrophobicContact CE3-CG 4.41Å; W977-L983 HydrophobicContact CZ3-CB 4.38Å; W977-L983 HydrophobicContact CZ3-CD1 3.49Å; W977-L983 VanDerWaalsContact CZ3-CD1 3.49Å; D979-L983 PolarHBondContact O-N 3.01Å; L983-R985 PolarHBondContact O-N 2.94Å; L983-H986 CarbonylContact O-C 3.59Å; L983-H986 PolarHBondContact O-N 3.45Å; L983-V987 HydrophobicContact CD1-CG2 3.71Å; L983-V987 HydrophobicContact CG-CG2 4.16Å; L983-V987 WeakPolarHBondContact O-CG2 3.5Å; L983-V987 PolarHBondContact O-N 2.82Å
984	K	78.8	Confident	76.5	Confident	105 Å²	105	65.6 Å²	65.6	46%	0.457	35%	0.347	S	S	.	.	H	α-helix	trans	-69	4	179	-173.2	148.8	-175.7	146.4	0	114.5	A980 R988	A980-K984 PolarHBondContact O-N 3.04Å; K984-R988 PolarHBondContact O-NH1 3.37Å
985	R	79.7	Confident	76.7	Confident	95 Å²	95	66.3 Å²	66.3	36%	0.358	34%	0.341	S	S	.	.	H	α-helix	trans	-95.5	-43.2	161.7	178	176.5	61.4	-169.9	-1.2	111.4	R981 S982 L983 R988 I1006 D1007	R981-R985 PolarHBondContact O-N 3.47Å; S982-R985 PolarHBondContact O-N 3.05Å; S982-R985 VanDerWaalsContact O-N 3.13Å; L983-R985 PolarHBondContact O-N 2.94Å; R985-R988 WeakPolarHBondContact O-CB 3.5Å; R985-R988 PolarHBondContact O-N 2.85Å; R985-I1006 HydrophobicContact CG-CG2 4.41Å; R985-D1007 WeakPolarHBondContact CD-OD2 3.43Å; R985-D1007 HydrophobicContact CG-CB 4.36Å; R985-D1007 IonicContact CZ-OD2 3.8Å; R985-D1007 IonicContact NE-OD2 3.88Å; R985-D1007 IonicContact NH1-OD2 2.88Å; R985-D1007 PolarHBondContact NH1-OD2 3.21Å
986	H	80.6	Confident	76.7	Confident	36 Å²	36	66.6 Å²	66.6	17%	0.167	34%	0.335	C	S	.	.	H	α-helix	trans	-70.1	-34	178.4	163.5	82.4	0	0	0	112.7	C973 W977 S982 L983 R988 T989 H990	C973-H986 PolarHBondContact SG-CE1 3.48Å; C973-H986 PolarHBondContact SG-NE2 3.48Å; W977-H986 HydrophobicContact CH2-CB 3.91Å; W977-H986 AromaticContact CH2-CD2 2.97Å; W977-H986 WeakPolarHBondContact CH2-CD2 3.46Å; W977-H986 AromaticContact CH2-CE1 3.96Å; W977-H986 AromaticContact CH2-CG 3.32Å; W977-H986 AromaticContact CH2-ND1 3.95Å; W977-H986 AromaticContact CH2-NE2 3.4Å; W977-H986 WeakPolarHBondContact CH2-NE2 3.23Å; W977-H986 HydrophobicContact CZ2-CB 3.63Å; W977-H986 AromaticContact CZ2-CD2 3.51Å; W977-H986 AromaticContact CZ2-CG 3.3Å; W977-H986 AromaticContact CZ2-ND1 3.75Å; W977-H986 AromaticContact CZ2-NE2 3.99Å; W977-H986 AromaticContact CZ3-CD2 3.7Å; S982-H986 PolarHBondContact O-N 3.18Å; L983-H986 CarbonylContact O-C 3.59Å; L983-H986 PolarHBondContact O-N 3.45Å; H986-R988 PolarHBondContact O-N 3.47Å; H986-T989 PolarHBondContact ND1-OG1 3.25Å; H986-T989 PolarHBondContact O-N 3.27Å; H986-T989 PolarHBondContact O-OG1 2.97Å; H986-H990 AromaticContact CE1-CD2 3.72Å; H986-H990 AromaticContact NE2-CD2 3.37Å; H986-H990 PolarHBondContact NE2-CD2 3.23Å
987	V	78.4	Confident	76.9	Confident	41 Å²	41	69.5 Å²	69.5	25%	0.248	35%	0.35	C	S	.	.	H	α-helix	trans	-56.1	-29.5	172.1	173.6	0	0	0	0	111.6	L983 T989 H990 T991	L983-V987 HydrophobicContact CD1-CG2 3.71Å; L983-V987 HydrophobicContact CG-CG2 4.16Å; L983-V987 WeakPolarHBondContact O-CG2 3.5Å; L983-V987 PolarHBondContact O-N 2.82Å; V987-T989 VanDerWaalsContact C-N 3.34Å; V987-T989 PolarHBondContact O-N 2.77Å; V987-H990 WeakPolarHBondContact O-CB 3.5Å; V987-H990 PolarHBondContact O-N 3.22Å; V987-H990 VanDerWaalsContact O-N 3.12Å; V987-T991 HydrophobicContact CG1-CG2 4.17Å; V987-T991 PolarHBondContact O-N 3.35Å; V987-T991 PolarHBondContact O-OG1 3.16Å
988	R	81.3	Confident	77.3	Confident	45 Å²	45	67 Å²	67	17%	0.17	34%	0.341	C	S	.	.	H	α-helix	trans	-75.7	-11.6	173.2	-63.3	-163	-170.1	84.6	7.3	115.6	K984 R985 H986 H990 G992 E993 I1006	K984-R988 PolarHBondContact O-NH1 3.37Å; R985-R988 WeakPolarHBondContact O-CB 3.5Å; R985-R988 PolarHBondContact O-N 2.85Å; H986-R988 PolarHBondContact O-N 3.47Å; R988-H990 VanDerWaalsContact C-N 3.3Å; R988-G992 PolarHBondContact O-N 2.98Å; R988-E993 HydrophobicContact CB-CB 4.1Å; R988-E993 WeakPolarHBondContact CD-O 3.5Å; R988-E993 HydrophobicContact CG-CB 3.82Å; R988-E993 IonicContact NE-OE2 3.28Å; R988-E993 PolarHBondContact NE-OE2 3.23Å; R988-I1006 HydrophobicContact CB-CG2 3.58Å
989	T	75.4	Confident	77.3	Confident	80 Å²	80	70.7 Å²	70.7	49%	0.491	36%	0.364	S	S	.	.	H	α-helix	trans	-76.4	-23.7	165.3	58.3	0	0	0	0	111.2	H986 V987 I1006	H986-T989 PolarHBondContact ND1-OG1 3.25Å; H986-T989 PolarHBondContact O-N 3.27Å; H986-T989 PolarHBondContact O-OG1 2.97Å; V987-T989 VanDerWaalsContact C-N 3.34Å; V987-T989 PolarHBondContact O-N 2.77Å; T989-I1006 HydrophobicContact CG2-CD1 3.71Å
990	H	73.9	Confident	77.2	Confident	103 Å²	103	73.5 Å²	73.5	48%	0.477	38%	0.377	S	S	.	.	H	α-helix	trans	-86.4	-46.2	172.7	-66.7	-67	0	0	0	112.7	T972 C973 H986 V987 R988 G992	T972-H990 HydrophobicContact CG2-CB 4.05Å; C973-H990 WeakPolarHBondContact CB-NE2 3.44Å; H986-H990 AromaticContact CE1-CD2 3.72Å; H986-H990 AromaticContact NE2-CD2 3.37Å; H986-H990 PolarHBondContact NE2-CD2 3.23Å; V987-H990 WeakPolarHBondContact O-CB 3.5Å; V987-H990 PolarHBondContact O-N 3.22Å; V987-H990 VanDerWaalsContact O-N 3.12Å; R988-H990 VanDerWaalsContact C-N 3.3Å; H990-G992 PolarHBondContact O-N 3.21Å
991	T	70.8	Confident	77.6	Confident	66 Å²	66	73.8 Å²	73.8	41%	0.405	38%	0.375	S	S	.	.	S	Bend	trans	-79	4.1	-179	64.3	0	0	0	0	114.5	V987 E993	V987-T991 HydrophobicContact CG1-CG2 4.17Å; V987-T991 PolarHBondContact O-N 3.35Å; V987-T991 PolarHBondContact O-OG1 3.16Å; T991-E993 PolarHBondContact O-N 2.88Å; T991-E993 WeakPolarHBondContact OG1-CG 3.48Å; T991-E993 PolarHBondContact OG1-OE1 3.46Å
992	G	72.1	Confident	77.4	Confident	46 Å²	46	72.2 Å²	72.2	47%	0.474	38%	0.376	S	S	.	.			trans	65.6	-9.9	-177.6	0	0	0	0	0	115.9	R988 H990 R994	R988-G992 PolarHBondContact O-N 2.98Å; H990-G992 PolarHBondContact O-N 3.21Å; G992-R994 WeakPolarHBondContact O-CG 3.42Å; G992-R994 PolarHBondContact O-N 3.43Å; G992-R994 VanDerWaalsContact O-N 3.16Å
993	E	73.5	Confident	77.3	Confident	55 Å²	55	75 Å²	75	26%	0.257	39%	0.386	S	S	.	.			trans	-52.8	117.2	-175.1	-79.6	175.9	-142.7	0	0	112.7	R988 T991 P995 Q1042	R988-E993 HydrophobicContact CB-CB 4.1Å; R988-E993 WeakPolarHBondContact CD-O 3.5Å; R988-E993 HydrophobicContact CG-CB 3.82Å; R988-E993 IonicContact NE-OE2 3.28Å; R988-E993 PolarHBondContact NE-OE2 3.23Å; T991-E993 PolarHBondContact O-N 2.88Å; T991-E993 WeakPolarHBondContact OG1-CG 3.48Å; T991-E993 PolarHBondContact OG1-OE1 3.46Å; E993-P995 WeakPolarHBondContact O-CD 3.22Å; E993-Q1042 PolarHBondContact OE1-NE2 3.28Å; E993-Q1042 PolarHBondContact OE1-OE1 2.91Å
994	R	77.4	Confident	77.3	Confident	146 Å²	146	75 Å²	75	55%	0.551	39%	0.39	S	S	*	.			trans	-121.5	69.4	178	-73.5	156.1	174.1	-119.4	17.9	112.1	G992 Y996 A1004 H1005 I1006	G992-R994 WeakPolarHBondContact O-CG 3.42Å; G992-R994 PolarHBondContact O-N 3.43Å; G992-R994 VanDerWaalsContact O-N 3.16Å; R994-Y996 PolarHBondContact O-N 3.4Å; R994-A1004 HydrophobicContact CB-CB 3.58Å; R994-A1004 VanDerWaalsContact CD-O 3.26Å; R994-A1004 WeakPolarHBondContact CD-O 3.48Å; R994-A1004 HydrophobicContact CG-CB 4.38Å; R994-A1004 WeakPolarHBondContact CG-O 3.42Å; R994-A1004 PolarHBondContact NH1-O 3.46Å; R994-H1005 CarbonylContact C-O 3.58Å; R994-H1005 VanDerWaalsContact CA-O 3.31Å; R994-H1005 WeakPolarHBondContact CA-O 3.43Å; R994-I1006 HydrophobicContact CG-CG1 3.71Å
995	P	78.4	Confident	77.3	Confident	76 Å²	76	71 Å²	71	49%	0.494	37%	0.373	S	S	.	.			trans	-72.4	-0.2	-170.9	-16.6	32.7	0	0	0	115.3	E993	E993-P995 WeakPolarHBondContact O-CD 3.22Å
996	Y	77.9	Confident	77.2	Confident	80 Å²	80	68.2 Å²	68.2	31%	0.314	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	75.4	-176.6	-59.2	-78.3	0	0	0	110.3	R994 H1005 A1008	R994-Y996 PolarHBondContact O-N 3.4Å; Y996-H1005 WeakPolarHBondContact CB-O 3.35Å; Y996-H1005 PolarHBondContact N-O 3.35Å; Y996-H1005 PolarHBondContact O-CD2 2.82Å; Y996-H1005 PolarHBondContact O-N 3.38Å; Y996-A1008 HydrophobicContact CD1-CB 3.92Å; Y996-A1008 HydrophobicContact CE1-CB 3.66Å; Y996-A1008 HydrophobicContact CE2-CB 4.42Å; Y996-A1008 HydrophobicContact CG-CB 4.41Å
997	V	80.3	Confident	77.2	Confident	80 Å²	80	68.1 Å²	68.1	49%	0.485	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	135.3	173	179.5	0	0	0	0	110.3	Q1002 E1003 A1004	V997-Q1002 HydrophobicContact CG1-CB 4.39Å; V997-E1003 CarbonylContact C-O 3.48Å; V997-E1003 WeakPolarHBondContact CA-O 3.41Å; V997-A1004 HydrophobicContact CG2-CB 4.17Å
998	C	84.3	Confident	77.1	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	36%	0.364	C	S	.	.			trans	-74.9	124.6	172.6	-174.3	0	0	0	0	110.7	M1000 Q1002 E1003 L1011 H1019	C998-M1000 PolarHBondContact O-N 3.38Å; C998-M1000 VanDerWaalsContact O-N 3.15Å; C998-Q1002 WeakPolarHBondContact O-CA 3.38Å; C998-Q1002 PolarHBondContact O-N 2.81Å; C998-E1003 HydrophobicContact CB-CB 4.39Å; C998-E1003 PolarHBondContact N-O 2.83Å; C998-L1011 HydrophobicContact CB-CD1 3.6Å; C998-H1019 VanDerWaalsContact SG-CD2 3.53Å
999	P	74.5	Confident	77	Confident	92 Å²	92	73 Å²	73	60%	0.597	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-9.9	-178.8	29.3	-36	0	0	0	114.2	M1015	P999-M1015 HydrophobicContact CG-CE 4.07Å
1000	M	73.6	Confident	77.2	Confident	93 Å²	93	72.2 Å²	72.2	46%	0.458	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-32.3	-176.1	-58.5	-56.7	-60.4	0	0	113.9	C998 M1015 H1019	C998-M1000 PolarHBondContact O-N 3.38Å; C998-M1000 VanDerWaalsContact O-N 3.15Å; M1000-M1015 HydrophobicContact CG-CE 4.49Å; M1000-H1019 HydrophobicContact CG-CB 4.48Å
1001	C	80.6	Confident	77.6	Confident	51 Å²	51	68.3 Å²	68.3	35%	0.345	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.8	2.8	-179.8	67.8	0	0	0	0	114	E1003 H1014 H1019	C1001-E1003 PolarHBondContact O-N 3.38Å; C1001-H1014 PolarHBondContact SG-NE2 3.41Å; C1001-H1019 PolarHBondContact SG-NE2 2.99Å
1002	Q	73.6	Confident	78	Confident	162 Å²	162	72.1 Å²	72.1	76%	0.757	37%	0.37	S	S	*	.			trans	60.3	8.5	-177.9	-50.8	-170.7	20.8	0	0	116.1	V997 C998 A1004	V997-Q1002 HydrophobicContact CG1-CB 4.39Å; C998-Q1002 WeakPolarHBondContact O-CA 3.38Å; C998-Q1002 PolarHBondContact O-N 2.81Å; Q1002-A1004 PolarHBondContact O-N 3.12Å; Q1002-A1004 VanDerWaalsContact O-N 3.14Å
1003	E	77.9	Confident	78.4	Confident	90 Å²	90	77 Å²	77	42%	0.421	38%	0.378	S	S	.	.			trans	-57.2	120.3	172.4	-84	-172.2	-127.3	0	0	112.1	V997 C998 C1001 H1005 H1014	V997-E1003 CarbonylContact C-O 3.48Å; V997-E1003 WeakPolarHBondContact CA-O 3.41Å; C998-E1003 HydrophobicContact CB-CB 4.39Å; C998-E1003 PolarHBondContact N-O 2.83Å; C1001-E1003 PolarHBondContact O-N 3.38Å; E1003-H1005 PolarHBondContact O-CD2 3.06Å; E1003-H1005 IonicContact OE2-CE1 3.33Å; E1003-H1005 PolarHBondContact OE2-CE1 2.99Å; E1003-H1014 IonicContact OE1-CE1 3.14Å; E1003-H1014 PolarHBondContact OE1-CE1 3.31Å; E1003-H1014 IonicContact OE1-ND1 2.89Å; E1003-H1014 IonicContact OE2-CE1 3.94Å; E1003-H1014 IonicContact OE2-ND1 3.81Å
1004	A	81	Confident	78.8	Confident	32 Å²	32	75.1 Å²	75.1	26%	0.264	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	117.6	178.2	0	0	0	0	0	110.7	R994 V997 Q1002	R994-A1004 HydrophobicContact CB-CB 3.58Å; R994-A1004 VanDerWaalsContact CD-O 3.26Å; R994-A1004 WeakPolarHBondContact CD-O 3.48Å; R994-A1004 HydrophobicContact CG-CB 4.38Å; R994-A1004 WeakPolarHBondContact CG-O 3.42Å; R994-A1004 PolarHBondContact NH1-O 3.46Å; V997-A1004 HydrophobicContact CG2-CB 4.17Å; Q1002-A1004 PolarHBondContact O-N 3.12Å; Q1002-A1004 VanDerWaalsContact O-N 3.14Å
1005	H	77.8	Confident	78.9	Confident	22 Å²	22	69.5 Å²	69.5	10%	0.102	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	152.4	178.1	-45.8	-78.5	0	0	0	113.9	R994 Y996 E1003 L1011 H1014	R994-H1005 CarbonylContact C-O 3.58Å; R994-H1005 VanDerWaalsContact CA-O 3.31Å; R994-H1005 WeakPolarHBondContact CA-O 3.43Å; Y996-H1005 WeakPolarHBondContact CB-O 3.35Å; Y996-H1005 PolarHBondContact N-O 3.35Å; Y996-H1005 PolarHBondContact O-CD2 2.82Å; Y996-H1005 PolarHBondContact O-N 3.38Å; E1003-H1005 PolarHBondContact O-CD2 3.06Å; E1003-H1005 IonicContact OE2-CE1 3.33Å; E1003-H1005 PolarHBondContact OE2-CE1 2.99Å; H1005-L1011 HydrophobicContact CB-CB 4.36Å; H1005-L1011 VanDerWaalsContact CD2-CA 3.43Å; H1005-L1011 WeakPolarHBondContact CD2-CA 3.47Å; H1005-H1014 AromaticContact CE1-CG 3.5Å; H1005-H1014 VanDerWaalsContact CE1-CG 3.5Å; H1005-H1014 AromaticContact CE1-ND1 3.73Å; H1005-H1014 WeakPolarHBondContact NE2-CB 3.31Å; H1005-H1014 AromaticContact NE2-CD2 3.71Å; H1005-H1014 AromaticContact NE2-CG 3.33Å; H1005-H1014 VanDerWaalsContact NE2-CG 3.33Å; H1005-H1014 AromaticContact NE2-ND1 3.97Å
1006	I	78.4	Confident	79	Confident	37 Å²	37	69 Å²	69	19%	0.19	35%	0.352	C	S	.	.	S	Bend	trans	-73.6	-27.1	-176.7	-60.3	177.2	0	0	0	113.6	R985 R988 T989 R994	R985-I1006 HydrophobicContact CG-CG2 4.41Å; R988-I1006 HydrophobicContact CB-CG2 3.58Å; T989-I1006 HydrophobicContact CG2-CD1 3.71Å; R994-I1006 HydrophobicContact CG-CG1 3.71Å
1007	D	79.8	Confident	79.1	Confident	34 Å²	34	72.4 Å²	72.4	18%	0.182	37%	0.369	C	S	.	.	S	Bend	trans	-141.5	140.2	-167.8	-160.5	28.7	0	0	0	111.6	R985 R1009 T1010 L1011	R985-D1007 WeakPolarHBondContact CD-OD2 3.43Å; R985-D1007 HydrophobicContact CG-CB 4.36Å; R985-D1007 IonicContact CZ-OD2 3.8Å; R985-D1007 IonicContact NE-OD2 3.88Å; R985-D1007 IonicContact NH1-OD2 2.88Å; R985-D1007 PolarHBondContact NH1-OD2 3.21Å; D1007-R1009 PolarHBondContact O-N 3.28Å; D1007-T1010 PolarHBondContact N-OG1 3Å; D1007-T1010 PolarHBondContact O-N 3.12Å; D1007-T1010 PolarHBondContact O-OG1 2.74Å; D1007-L1011 PolarHBondContact O-N 2.94Å
1008	A	77.4	Confident	78.7	Confident	26 Å²	26	75.8 Å²	75.8	22%	0.215	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	4.2	174.1	0	0	0	0	0	113.9	Y996 R1012	Y996-A1008 HydrophobicContact CD1-CB 3.92Å; Y996-A1008 HydrophobicContact CE1-CB 3.66Å; Y996-A1008 HydrophobicContact CE2-CB 4.42Å; Y996-A1008 HydrophobicContact CG-CB 4.41Å; A1008-R1012 VanDerWaalsContact O-CZ 3.29Å; A1008-R1012 PolarHBondContact O-NE 3.25Å; A1008-R1012 PolarHBondContact O-NH2 2.75Å
1009	R	78.5	Confident	78.3	Confident	162 Å²	162	77.3 Å²	77.3	61%	0.611	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-36.6	169.1	-174	-174.2	-67.4	-140.5	-1.3	111.9	D1007 K1013	D1007-R1009 PolarHBondContact O-N 3.28Å; R1009-K1013 PolarHBondContact O-N 3.19Å; R1009-K1013 VanDerWaalsContact O-N 3.09Å
1010	T	79.5	Confident	77.9	Confident	63 Å²	63	76.6 Å²	76.6	39%	0.387	37%	0.374	S	S	.	.	H	α-helix	trans	-72.9	-44.1	177.2	41.4	0	0	0	0	110.4	D1007 R1012 K1013 H1014	D1007-T1010 PolarHBondContact N-OG1 3Å; D1007-T1010 PolarHBondContact O-N 3.12Å; D1007-T1010 PolarHBondContact O-OG1 2.74Å; T1010-R1012 VanDerWaalsContact C-N 3.3Å; T1010-R1012 PolarHBondContact O-N 3.37Å; T1010-K1013 CarbonylContact O-C 3.35Å; T1010-K1013 WeakPolarHBondContact O-CA 3.4Å; T1010-K1013 WeakPolarHBondContact O-CB 2.97Å; T1010-K1013 PolarHBondContact O-N 2.84Å; T1010-H1014 PolarHBondContact O-N 3.21Å
1011	L	81.5	Confident	77.2	Confident	21 Å²	21	80 Å²	80	11%	0.11	39%	0.394	C	S	.	.	H	α-helix	trans	-53.7	-43.3	170.7	173.5	58	0	0	0	112.8	C998 H1005 D1007 K1013 H1014 M1015	C998-L1011 HydrophobicContact CB-CD1 3.6Å; H1005-L1011 HydrophobicContact CB-CB 4.36Å; H1005-L1011 VanDerWaalsContact CD2-CA 3.43Å; H1005-L1011 WeakPolarHBondContact CD2-CA 3.47Å; D1007-L1011 PolarHBondContact O-N 2.94Å; L1011-K1013 PolarHBondContact O-N 3.44Å; L1011-H1014 WeakPolarHBondContact O-CB 2.92Å; L1011-H1014 PolarHBondContact O-N 3.32Å; L1011-M1015 HydrophobicContact CD1-CG 3.84Å; L1011-M1015 HydrophobicContact CD1-SD 3.91Å; L1011-M1015 HydrophobicContact CG-CG 4.47Å; L1011-M1015 HydrophobicContact CG-SD 4.19Å; L1011-M1015 WeakPolarHBondContact O-CG 3.46Å; L1011-M1015 PolarHBondContact O-N 3.43Å
1012	R	79.8	Confident	76.1	Confident	147 Å²	147	80.4 Å²	80.4	56%	0.555	40%	0.398	S	S	*	.	H	α-helix	trans	-71.4	-27.4	177	-82.7	-177.3	-64.8	137.1	6.4	114	A1008 T1010 A1016	A1008-R1012 VanDerWaalsContact O-CZ 3.29Å; A1008-R1012 PolarHBondContact O-NE 3.25Å; A1008-R1012 PolarHBondContact O-NH2 2.75Å; T1010-R1012 VanDerWaalsContact C-N 3.3Å; T1010-R1012 PolarHBondContact O-N 3.37Å; R1012-A1016 WeakPolarHBondContact O-CB 3.23Å; R1012-A1016 PolarHBondContact O-N 2.89Å; R1012-A1016 VanDerWaalsContact O-N 3.17Å
1013	K	80.8	Confident	75.3	Confident	148 Å²	148	77.6 Å²	77.6	64%	0.643	39%	0.388	S	S	*	.	H	α-helix	trans	-71.6	-35.1	169.7	-84.6	-171.3	166.5	-162	0	111.7	R1009 T1010 L1011 K1017	R1009-K1013 PolarHBondContact O-N 3.19Å; R1009-K1013 VanDerWaalsContact O-N 3.09Å; T1010-K1013 CarbonylContact O-C 3.35Å; T1010-K1013 WeakPolarHBondContact O-CA 3.4Å; T1010-K1013 WeakPolarHBondContact O-CB 2.97Å; T1010-K1013 PolarHBondContact O-N 2.84Å; L1011-K1013 PolarHBondContact O-N 3.44Å; K1013-K1017 WeakPolarHBondContact O-CB 3.18Å; K1013-K1017 WeakPolarHBondContact O-CG 3.48Å; K1013-K1017 PolarHBondContact O-N 3.09Å
1014	H	82.2	Confident	73.5	Confident	16 Å²	16	76.9 Å²	76.9	7%	0.074	39%	0.391	C	S	.	.	H	α-helix	trans	-64.5	-57.2	174.9	176.7	78	0	0	0	111.2	C1001 E1003 H1005 T1010 L1011 A1016 K1017 Y1018 H1019	C1001-H1014 PolarHBondContact SG-NE2 3.41Å; E1003-H1014 IonicContact OE1-CE1 3.14Å; E1003-H1014 PolarHBondContact OE1-CE1 3.31Å; E1003-H1014 IonicContact OE1-ND1 2.89Å; E1003-H1014 IonicContact OE2-CE1 3.94Å; E1003-H1014 IonicContact OE2-ND1 3.81Å; H1005-H1014 AromaticContact CE1-CG 3.5Å; H1005-H1014 VanDerWaalsContact CE1-CG 3.5Å; H1005-H1014 AromaticContact CE1-ND1 3.73Å; H1005-H1014 WeakPolarHBondContact NE2-CB 3.31Å; H1005-H1014 AromaticContact NE2-CD2 3.71Å; H1005-H1014 AromaticContact NE2-CG 3.33Å; H1005-H1014 VanDerWaalsContact NE2-CG 3.33Å; H1005-H1014 AromaticContact NE2-ND1 3.97Å; T1010-H1014 PolarHBondContact O-N 3.21Å; L1011-H1014 WeakPolarHBondContact O-CB 2.92Å; L1011-H1014 PolarHBondContact O-N 3.32Å; H1014-A1016 VanDerWaalsContact C-N 3.28Å; H1014-A1016 PolarHBondContact O-N 3.07Å; H1014-K1017 PolarHBondContact O-N 3.15Å; H1014-Y1018 AromaticContact CE1-CD2 3.25Å; H1014-Y1018 WeakPolarHBondContact CE1-CD2 3.43Å; H1014-Y1018 AromaticContact CE1-CE2 3.76Å; H1014-Y1018 AromaticContact CE1-CG 3.79Å; H1014-Y1018 AromaticContact ND1-CD2 3.24Å; H1014-Y1018 WeakPolarHBondContact ND1-CD2 3.16Å; H1014-Y1018 AromaticContact ND1-CE2 3.61Å; H1014-Y1018 WeakPolarHBondContact O-CD2 3.37Å; H1014-Y1018 PolarHBondContact O-N 3.02Å; H1014-H1019 AromaticContact CD2-CD2 3.83Å; H1014-H1019 AromaticContact CD2-NE2 3.78Å; H1014-H1019 AromaticContact NE2-CD2 3.04Å; H1014-H1019 PolarHBondContact NE2-CD2 2.86Å; H1014-H1019 AromaticContact NE2-CE1 3.24Å; H1014-H1019 PolarHBondContact NE2-CE1 2.99Å; H1014-H1019 AromaticContact NE2-NE2 2.25Å; H1014-H1019 PolarHBondContact NE2-NE2 2.67Å
1015	M	78.6	Confident	71.7	Confident	27 Å²	27	79.3 Å²	79.3	13%	0.133	42%	0.419	C	S	.	.	H	α-helix	trans	-59.1	-39.6	178.9	-63.4	-177.5	83.8	0	0	112	P999 M1000 L1011 K1017 H1019	P999-M1015 HydrophobicContact CG-CE 4.07Å; M1000-M1015 HydrophobicContact CG-CE 4.49Å; L1011-M1015 HydrophobicContact CD1-CG 3.84Å; L1011-M1015 HydrophobicContact CD1-SD 3.91Å; L1011-M1015 HydrophobicContact CG-CG 4.47Å; L1011-M1015 HydrophobicContact CG-SD 4.19Å; L1011-M1015 WeakPolarHBondContact O-CG 3.46Å; L1011-M1015 PolarHBondContact O-N 3.43Å; M1015-K1017 PolarHBondContact O-N 2.86Å; M1015-H1019 CarbonylContact O-C 3.59Å; M1015-H1019 WeakPolarHBondContact O-CA 3.37Å; M1015-H1019 PolarHBondContact O-N 2.72Å
1016	A	80.9	Confident	69.9	Low	67 Å²	67	87.8 Å²	87.8	55%	0.554	46%	0.456	S	S	*	.	H	α-helix	trans	-78.1	9	175.4	0	0	0	0	0	114.9	R1012 H1014	R1012-A1016 WeakPolarHBondContact O-CB 3.23Å; R1012-A1016 PolarHBondContact O-N 2.89Å; R1012-A1016 VanDerWaalsContact O-N 3.17Å; H1014-A1016 VanDerWaalsContact C-N 3.28Å; H1014-A1016 PolarHBondContact O-N 3.07Å
1017	K	79.6	Confident	68.1	Low	151 Å²	151	91.1 Å²	91.1	66%	0.657	47%	0.473	S	S	*	.	H	α-helix	trans	-117.3	-44.5	170.9	-88.6	-170.3	160.4	-149	0	112.6	K1013 H1014 M1015	K1013-K1017 WeakPolarHBondContact O-CB 3.18Å; K1013-K1017 WeakPolarHBondContact O-CG 3.48Å; K1013-K1017 PolarHBondContact O-N 3.09Å; H1014-K1017 PolarHBondContact O-N 3.15Å; M1015-K1017 PolarHBondContact O-N 2.86Å
1018	Y	73.6	Confident	65.9	Low	151 Å²	151	97 Å²	97	59%	0.592	50%	0.501	S	S	*	.	H	α-helix	trans	-112.6	-9.2	-169.8	-55.2	-72.8	0	0	0	114.1	H1014	H1014-Y1018 AromaticContact CE1-CD2 3.25Å; H1014-Y1018 WeakPolarHBondContact CE1-CD2 3.43Å; H1014-Y1018 AromaticContact CE1-CE2 3.76Å; H1014-Y1018 AromaticContact CE1-CG 3.79Å; H1014-Y1018 AromaticContact ND1-CD2 3.24Å; H1014-Y1018 WeakPolarHBondContact ND1-CD2 3.16Å; H1014-Y1018 AromaticContact ND1-CE2 3.61Å; H1014-Y1018 WeakPolarHBondContact O-CD2 3.37Å; H1014-Y1018 PolarHBondContact O-N 3.02Å
1019	H	75.8	Confident	64.2	Low	31 Å²	31	100.2 Å²	100.2	14%	0.144	51%	0.514	C	S	.	.	S	Bend	trans	-132	39.9	179.8	-52.4	-47.3	0	0	0	111	C998 M1000 C1001 H1014 M1015	C998-H1019 VanDerWaalsContact SG-CD2 3.53Å; M1000-H1019 HydrophobicContact CG-CB 4.48Å; C1001-H1019 PolarHBondContact SG-NE2 2.99Å; H1014-H1019 AromaticContact CD2-CD2 3.83Å; H1014-H1019 AromaticContact CD2-NE2 3.78Å; H1014-H1019 AromaticContact NE2-CD2 3.04Å; H1014-H1019 PolarHBondContact NE2-CD2 2.86Å; H1014-H1019 AromaticContact NE2-CE1 3.24Å; H1014-H1019 PolarHBondContact NE2-CE1 2.99Å; H1014-H1019 AromaticContact NE2-NE2 2.25Å; H1014-H1019 PolarHBondContact NE2-NE2 2.67Å; M1015-H1019 CarbonylContact O-C 3.59Å; M1015-H1019 WeakPolarHBondContact O-CA 3.37Å; M1015-H1019 PolarHBondContact O-N 2.72Å
1020	V	65.7	Low	62	Low	77 Å²	77	98.6 Å²	98.6	47%	0.467	51%	0.514	S	S	.	.	S	Bend	trans	-60.5	-48.7	-175.6	179.5	0	0	0	0	111.1
1021	D	59.2	Low	60.3	Low	164 Å²	164	104 Å²	104	88%	0.877	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-12	-171.8	-47.9	-70.8	0	0	0	113.4
1022	S	56.4	Low	58	Low	61 Å²	61	109.6 Å²	109.6	43%	0.427	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-115.6	49.2	176.9	-173.8	0	0	0	0	111.6	P1024	S1022-P1024 WeakPolarHBondContact O-CD 3.47Å
1023	L	57.2	Low	55.7	Low	103 Å²	103	107 Å²	107	54%	0.539	56%	0.563	S	S	.	*			trans	-88.2	107.2	167	-74	173.4	0	0	0	110.3	G1025	L1023-G1025 PolarHBondContact O-N 3.37Å
1024	P	40.8	Very low	53.4	Low	74 Å²	74	105.7 Å²	105.7	48%	0.481	56%	0.562	S	S	.	*			trans	-68.5	112.1	174.5	-14.1	30.5	0	0	0	108.5	S1022 K1026 I1027	S1022-P1024 WeakPolarHBondContact O-CD 3.47Å; P1024-K1026 PolarHBondContact O-N 2.92Å; P1024-I1027 HydrophobicContact CB-CD1 4.3Å; P1024-I1027 HydrophobicContact CB-CG1 4.27Å; P1024-I1027 HydrophobicContact CG-CD1 4.04Å; P1024-I1027 PolarHBondContact O-N 3.42Å
1025	G	43.1	Very low	51.2	Low	84 Å²	84	112.6 Å²	112.6	87%	0.866	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	18.8	-166.8	0	0	0	0	0	117.7	L1023	L1023-G1025 PolarHBondContact O-N 3.37Å
1026	K	39.6	Very low	48.8	Very low	200 Å²	200	119.1 Å²	119.1	87%	0.87	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.4	-2.6	173.7	-73.8	-179.4	178.9	170.9	0	114.5	P1024 M1028	P1024-K1026 PolarHBondContact O-N 2.92Å; K1026-M1028 PolarHBondContact O-N 3.08Å
1027	I	41.2	Very low	46.3	Very low	107 Å²	107	122.8 Å²	122.8	55%	0.549	63%	0.627	S	S	.	*			trans	-79.3	55.6	171	-39.9	-177.4	0	0	0	110.9	P1024 L1029	P1024-I1027 HydrophobicContact CB-CD1 4.3Å; P1024-I1027 HydrophobicContact CB-CG1 4.27Å; P1024-I1027 HydrophobicContact CG-CD1 4.04Å; P1024-I1027 PolarHBondContact O-N 3.42Å; I1027-L1029 HydrophobicContact CG2-CD1 3.85Å; I1027-L1029 PolarHBondContact O-N 3.23Å
1028	M	33.3	Very low	44.1	Very low	157 Å²	157	122.5 Å²	122.5	77%	0.773	63%	0.633	S	S	*	*			trans	-66.5	100.8	157	-84	179.5	51.3	0	0	107.8	K1026 E1030	K1026-M1028 PolarHBondContact O-N 3.08Å; M1028-E1030 PolarHBondContact O-N 3.08Å
1029	L	41.2	Very low	42.1	Very low	94 Å²	94	122.8 Å²	122.8	49%	0.492	64%	0.64	S	S	.	*			trans	-64.2	91.1	161.9	-80.9	92.9	0	0	0	108.6	I1027 L1034	I1027-L1029 HydrophobicContact CG2-CD1 3.85Å; I1027-L1029 PolarHBondContact O-N 3.23Å; L1029-L1034 HydrophobicContact CD2-CD1 3.83Å
1030	E	33	Very low	40.3	Very low	128 Å²	128	125 Å²	125	60%	0.598	67%	0.672	S	S	*	*			trans	-54.2	145.6	163	-73.2	-148.5	125.3	0	0	109.9	M1028 D1032	M1028-E1030 PolarHBondContact O-N 3.08Å; E1030-D1032 PolarHBondContact O-N 3.46Å; E1030-D1032 VanDerWaalsContact O-N 3.09Å
1031	K	42.7	Very low	39	Very low	176 Å²	176	126.4 Å²	126.4	77%	0.765	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	117	179.3	-83.2	177.1	176.8	167.2	0	110.7
1032	D	33.8	Very low	38.3	Very low	139 Å²	139	122.3 Å²	122.3	74%	0.743	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	76	37.8	163.5	-43.3	-40.5	0	0	0	115.7	E1030	E1030-D1032 PolarHBondContact O-N 3.46Å; E1030-D1032 VanDerWaalsContact O-N 3.09Å
1033	T	31.8	Very low	37.1	Very low	93 Å²	93	125.2 Å²	125.2	57%	0.571	67%	0.671	S	S	*	*			trans	-123.2	1.6	178.3	48.6	0	0	0	0	117.6	Q1035	T1033-Q1035 PolarHBondContact O-N 3.48Å
1034	L	31.7	Very low	36.1	Very low	120 Å²	120	128 Å²	128	63%	0.628	68%	0.681	S	S	*	*			trans	-75	92.5	165.9	-88	175.3	0	0	0	110.4	L1029 F1036	L1029-L1034 HydrophobicContact CD2-CD1 3.83Å; L1034-F1036 VanDerWaalsContact C-N 3.27Å; L1034-F1036 HydrophobicContact CB-CD2 4.37Å; L1034-F1036 HydrophobicContact CD1-CE2 4.49Å; L1034-F1036 HydrophobicContact CD2-CD2 4.48Å; L1034-F1036 HydrophobicContact CD2-CE2 4Å; L1034-F1036 PolarHBondContact O-N 2.87Å
1035	Q	36.1	Very low	35.8	Very low	160 Å²	160	130.6 Å²	130.6	75%	0.748	69%	0.686	S	S	*	*			trans	-85.2	57.2	-176.3	-161.8	-179.2	-59.8	0	0	112.7	T1033	T1033-Q1035 PolarHBondContact O-N 3.48Å
1036	F	27.2	Very low	35.3	Very low	164 Å²	164	129.9 Å²	129.9	72%	0.719	67%	0.673	S	S	*	*			trans	-64	144.5	168	-80	-73.2	0	0	0	111.2	L1034 N1038	L1034-F1036 VanDerWaalsContact C-N 3.27Å; L1034-F1036 HydrophobicContact CB-CD2 4.37Å; L1034-F1036 HydrophobicContact CD1-CE2 4.49Å; L1034-F1036 HydrophobicContact CD2-CD2 4.48Å; L1034-F1036 HydrophobicContact CD2-CE2 4Å; L1034-F1036 PolarHBondContact O-N 2.87Å; F1036-N1038 PolarHBondContact O-N 2.89Å
1037	H	29.4	Very low	35	Very low	144 Å²	144	125.3 Å²	125.3	67%	0.667	66%	0.661	S	S	*	*			trans	-71.8	95	-177.3	-101.3	44.3	0	0	0	111.6	Q1039	H1037-Q1039 PolarHBondContact CD2-NE2 3.01Å; H1037-Q1039 PolarHBondContact NE2-NE2 2.88Å; H1037-Q1039 PolarHBondContact O-N 2.87Å; H1037-Q1039 VanDerWaalsContact O-N 3.11Å
1038	N	32.5	Very low	34.9	Very low	146 Å²	146	123.8 Å²	123.8	78%	0.781	66%	0.66	S	S	*	*			trans	-77.1	79.5	154.2	-84.3	-110.7	0	0	0	108.3	F1036	F1036-N1038 PolarHBondContact O-N 2.89Å
1039	Q	31.6	Very low	35.2	Very low	156 Å²	156	119.9 Å²	119.9	73%	0.729	64%	0.641	S	S	*	*			trans	-93.7	111.8	158.7	-70.4	-168.4	8.2	0	0	107.6	H1037	H1037-Q1039 PolarHBondContact CD2-NE2 3.01Å; H1037-Q1039 PolarHBondContact NE2-NE2 2.88Å; H1037-Q1039 PolarHBondContact O-N 2.87Å; H1037-Q1039 VanDerWaalsContact O-N 3.11Å
1040	G	38.7	Very low	35	Very low	79 Å²	79	122.2 Å²	122.2	81%	0.814	65%	0.654	S	S	*	*	S	Bend	trans	77.2	49.9	157.3	0	0	0	0	0	119.8
1041	T	37.9	Very low	35.2	Very low	105 Å²	105	118.7 Å²	118.7	64%	0.644	65%	0.646	S	S	*	*			trans	-139.6	141.5	156.6	48.1	0	0	0	0	114
1042	Q	44.4	Very low	35	Very low	79 Å²	79	114.1 Å²	114.1	37%	0.369	64%	0.636	S	S	.	*	S	Bend	trans	49.2	78.8	163.7	-61.4	174.1	29.8	0	0	118.1	E993	E993-Q1042 PolarHBondContact OE1-NE2 3.28Å; E993-Q1042 PolarHBondContact OE1-OE1 2.91Å
1043	V	32.7	Very low	35.4	Very low	122 Å²	122	114.8 Å²	114.8	74%	0.739	64%	0.64	S	S	*	*	S	Bend	trans	-124.9	-37	141.7	178.5	0	0	0	0	110.8	H1045 A1046	V1043-H1045 VanDerWaalsContact C-N 3.31Å; V1043-H1045 PolarHBondContact O-N 3.33Å; V1043-A1046 PolarHBondContact O-N 2.88Å
1044	E	34.8	Very low	35.5	Very low	161 Å²	161	116.9 Å²	116.9	75%	0.752	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-62.9	-33.8	178.5	-74.6	141.7	-170.9	0	0	113.2	A1046 V1047 S1048	E1044-A1046 PolarHBondContact O-N 2.82Å; E1044-V1047 WeakPolarHBondContact O-CA 3.2Å; E1044-V1047 PolarHBondContact O-N 3.04Å; E1044-S1048 PolarHBondContact O-N 3.01Å; E1044-S1048 VanDerWaalsContact O-N 3.12Å; E1044-S1048 PolarHBondContact O-OG 3.33Å
1045	H	34.3	Very low	35.9	Very low	128 Å²	128	116.4 Å²	116.4	59%	0.593	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-65.1	-6.3	177.1	-144.5	-59.5	0	0	0	114.8	V1043 I1049	V1043-H1045 VanDerWaalsContact C-N 3.31Å; V1043-H1045 PolarHBondContact O-N 3.33Å; H1045-I1049 VanDerWaalsContact O-CD1 3.31Å; H1045-I1049 WeakPolarHBondContact O-CD1 3.3Å; H1045-I1049 WeakPolarHBondContact O-CG1 3.25Å
1046	A	32.8	Very low	35.9	Very low	70 Å²	70	114.8 Å²	114.8	58%	0.579	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-99.4	-4.8	170.3	0	0	0	0	0	113.3	V1043 E1044	V1043-A1046 PolarHBondContact O-N 2.88Å; E1044-A1046 PolarHBondContact O-N 2.82Å
1047	V	34.8	Very low	36.6	Very low	104 Å²	104	115.7 Å²	115.7	63%	0.63	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	-40.9	171.3	-177.2	0	0	0	0	109.6	E1044 I1049 L1050	E1044-V1047 WeakPolarHBondContact O-CA 3.2Å; E1044-V1047 PolarHBondContact O-N 3.04Å; V1047-I1049 PolarHBondContact O-N 3.44Å; V1047-L1050 PolarHBondContact O-N 2.69Å; V1047-L1050 VanDerWaalsContact O-N 3.08Å
1048	S	37.5	Very low	37.3	Very low	75 Å²	75	116 Å²	116	52%	0.524	67%	0.666	S	S	.	*	G	3₁₀ helix	trans	-61.6	-26.9	178.3	-48.3	0	0	0	0	114.2	E1044	E1044-S1048 PolarHBondContact O-N 3.01Å; E1044-S1048 VanDerWaalsContact O-N 3.12Å; E1044-S1048 PolarHBondContact O-OG 3.33Å
1049	I	39.7	Very low	37.5	Very low	75 Å²	75	118.4 Å²	118.4	39%	0.385	67%	0.665	S	S	.	*	G	3₁₀ helix	trans	-77.4	-26.8	177.4	-61.4	173.5	0	0	0	111.5	L971 H1045 V1047 A1051	L971-I1049 HydrophobicContact CD1-CG2 3.75Å; H1045-I1049 VanDerWaalsContact O-CD1 3.31Å; H1045-I1049 WeakPolarHBondContact O-CD1 3.3Å; H1045-I1049 WeakPolarHBondContact O-CG1 3.25Å; V1047-I1049 PolarHBondContact O-N 3.44Å; I1049-A1051 PolarHBondContact O-N 3.48Å
1050	L	37.1	Very low	37.3	Very low	143 Å²	143	116.9 Å²	116.9	75%	0.749	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-86.3	18	176.5	-66.3	175.2	0	0	0	113	V1047	V1047-L1050 PolarHBondContact O-N 2.69Å; V1047-L1050 VanDerWaalsContact O-N 3.08Å
1051	A	36.9	Very low	36.8	Very low	53 Å²	53	117.6 Å²	117.6	44%	0.438	67%	0.669	S	S	.	*	G	3₁₀ helix	trans	-121.3	4.1	176.3	0	0	0	0	0	113	I1049 R1059	I1049-A1051 PolarHBondContact O-N 3.48Å; A1051-R1059 PolarHBondContact O-NH2 3.3Å
1052	S	40.1	Very low	36.3	Very low	80 Å²	80	121.7 Å²	121.7	56%	0.559	68%	0.681	S	S	*	*	S	Bend	trans	-90.4	-39.6	-176.6	-61	0	0	0	0	113.6	L1054	S1052-L1054 PolarHBondContact O-N 3.14Å
1053	D	41.6	Very low	35.8	Very low	153 Å²	153	123.8 Å²	123.8	82%	0.818	70%	0.701	S	S	*	*			trans	-99.6	85.4	-172.8	-58.7	-43	0	0	0	112
1054	L	34.8	Very low	35.5	Very low	138 Å²	138	122.7 Å²	122.7	72%	0.723	71%	0.705	S	S	*	*			trans	-138.5	140.4	162.5	-135.6	82.7	0	0	0	109.4	S1052	S1052-L1054 PolarHBondContact O-N 3.14Å
1055	P	39.7	Very low	35.1	Very low	110 Å²	110	119.8 Å²	119.8	71%	0.714	71%	0.709	S	S	*	*			trans	-60.5	161.9	-178.1	-26.3	36.8	0	0	0	115	E1057	P1055-E1057 PolarHBondContact O-N 3.15Å; P1055-E1057 VanDerWaalsContact O-N 3.14Å
1056	P	36.5	Very low	34.9	Very low	125 Å²	125	120.2 Å²	120.2	81%	0.812	72%	0.72	S	S	*	*	G	3₁₀ helix	trans	-79.1	-0.5	-151.4	30	-36.9	0	0	0	117.3	L1058	P1056-L1058 VanDerWaalsContact C-N 3.33Å; P1056-L1058 PolarHBondContact O-N 3.3Å
1057	E	40.6	Very low	35.1	Very low	183 Å²	183	126 Å²	126	86%	0.855	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-81.9	0.3	-168.9	-61.5	-173.2	159.1	0	0	115.4	P1055	P1055-E1057 PolarHBondContact O-N 3.15Å; P1055-E1057 VanDerWaalsContact O-N 3.14Å
1058	L	44.9	Very low	34.8	Very low	150 Å²	150	130.5 Å²	130.5	79%	0.785	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-133.5	45	-171.3	-68.2	175.1	0	0	0	114.8	P1056	P1056-L1058 VanDerWaalsContact C-N 3.33Å; P1056-L1058 PolarHBondContact O-N 3.3Å
1059	R	36	Very low	34.6	Very low	198 Å²	198	135 Å²	135	75%	0.747	77%	0.767	S	S	*	*			trans	-141.8	119.9	170.8	-79	-166.7	175.5	173.3	4.3	115.9	A1051	A1051-R1059 PolarHBondContact O-NH2 3.3Å
1060	S	27.8	Very low	33.9	Very low	124 Å²	124	140.6 Å²	140.6	87%	0.867	79%	0.791	S	S	*	*			trans	-163.8	151.3	152.7	56.6	0	0	0	0	108.7
1061	A	27.9	Very low	33.5	Very low	93 Å²	93	140.2 Å²	140.2	77%	0.769	80%	0.795	S	S	*	*			cis	-151.5	152.3	-25.5	0	0	0	0	0	109
1062	H	27.4	Very low	32.9	Very low	192 Å²	192	144 Å²	144	89%	0.889	81%	0.812	S	S	*	*			trans	-136.6	124.6	165	-94.5	-66.7	0	0	0	107.9
1063	P	33.6	Very low	32.3	Very low	123 Å²	123	147.8 Å²	147.8	80%	0.799	83%	0.826	S	S	*	*			trans	-75.1	161.6	171.8	31.9	-33.8	0	0	0	111.4
1064	A	27.3	Very low	31.7	Very low	98 Å²	98	148.2 Å²	148.2	81%	0.81	83%	0.826	S	S	*	*			trans	-84.7	171.3	-173.7	0	0	0	0	0	113.5
1065	A	26.9	Very low	31.6	Very low	101 Å²	101	146.5 Å²	146.5	84%	0.835	82%	0.821	S	S	*	*			trans	-108.3	138.6	160.4	0	0	0	0	0	109.1
1066	T	29.5	Very low	31.5	Very low	136 Å²	136	149.8 Å²	149.8	83%	0.834	83%	0.827	S	S	*	*			trans	-136.2	123	170.2	46.8	0	0	0	0	107.6
1067	E	36.3	Very low	31.3	Very low	192 Å²	192	152.7 Å²	152.7	90%	0.897	83%	0.83	S	S	*	*			trans	-105.1	120.2	161.3	-70.3	-179.1	164.5	0	0	107.2
1068	E	29.9	Very low	31	Very low	199 Å²	199	150.2 Å²	150.2	93%	0.93	83%	0.827	S	S	*	*			trans	-135.1	160.3	132.5	-71.7	-156.3	149.5	0	0	107.4
1069	L	31.7	Very low	30.9	Very low	170 Å²	170	150 Å²	150	89%	0.89	83%	0.832	S	S	*	*			trans	-86.4	148.8	-152.7	-58.3	162.9	0	0	0	113.8
1070	E	25.4	Very low	31.1	Very low	191 Å²	191	149.8 Å²	149.8	89%	0.893	84%	0.84	S	S	*	*				-164	154.6	127.6	-117	172.6	-163.1	0	0	112.5
1071	T	28.5	Very low	31.6	Very low	136 Å²	136	147.3 Å²	147.3	83%	0.834	83%	0.827	S	S	*	*			trans	-135.8	121.1	-178.4	52.7	0	0	0	0	111.2
1072	V	24.6	Very low	32.1	Very low	131 Å²	131	148.7 Å²	148.7	79%	0.794	83%	0.825	S	S	*	*			trans	-135.4	130	166	-177.4	0	0	0	0	109.7
1073	L	28.3	Very low	32.7	Very low	161 Å²	161	148.5 Å²	148.5	84%	0.843	83%	0.825	S	S	*	*			trans	-135.4	126.8	163.9	-90.1	172.6	0	0	0	107.4
1074	I	27.9	Very low	32.8	Very low	161 Å²	161	146.3 Å²	146.3	83%	0.826	82%	0.817	S	S	*	*			trans	-131.6	144.4	157	-61.8	-176	0	0	0	106.9
1075	T	32.2	Very low	33.3	Very low	102 Å²	102	146.5 Å²	146.5	63%	0.626	81%	0.808	S	S	*	*			trans	-110.2	164.2	-167.9	44	0	0	0	0	112.8
1076	E	38.8	Very low	33.8	Very low	179 Å²	179	150.6 Å²	150.6	84%	0.836	81%	0.81	S	S	*	*			trans	55.5	90.4	144.2	-71.8	162.1	-155.1	0	0	118.8
1077	E	31.8	Very low	33.9	Very low	186 Å²	186	147.5 Å²	147.5	87%	0.869	80%	0.798	S	S	*	*				-154.6	163.2	127.6	-116.2	175.2	-170.5	0	0	110.1
1078	T	35.3	Very low	33.8	Very low	131 Å²	131	141.5 Å²	141.5	80%	0.804	78%	0.782	S	S	*	*			trans	84.9	27.5	-173	74.5	0	0	0	0	119.3	E1080	T1078-E1080 PolarHBondContact O-N 3.36Å
1079	V	42.1	Very low	34	Very low	147 Å²	147	140.6 Å²	140.6	89%	0.891	78%	0.777	S	S	*	*			trans	-89.3	57	154.2	-171	0	0	0	0	110.2
1080	E	40.3	Very low	33.7	Very low	193 Å²	193	136.6 Å²	136.6	90%	0.902	77%	0.769	S	S	*	*	S	Bend	trans	-162.5	50.7	170.9	-123.6	169.7	-128.1	0	0	113	T1078	T1078-E1080 PolarHBondContact O-N 3.36Å
1081	A	37.5	Very low	33.9	Very low	72 Å²	72	131.7 Å²	131.7	60%	0.595	76%	0.761	S	S	*	*	S	Bend	trans	-141.2	-1.8	179.3	0	0	0	0	0	116
1082	V	39.2	Very low	33.9	Very low	122 Å²	122	131.2 Å²	131.2	74%	0.739	75%	0.753	S	S	*	*	S	Bend	trans	-126	2	-173.7	-167.6	0	0	0	0	114	A1084	V1082-A1084 PolarHBondContact O-N 3.26Å
1083	E	40.4	Very low	34.1	Very low	188 Å²	188	133.3 Å²	133.3	88%	0.879	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-15.5	158.5	-69.4	-159	141	0	0	112
1084	A	34.5	Very low	34.1	Very low	76 Å²	76	129.6 Å²	129.6	63%	0.628	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-18	-176	0	0	0	0	0	115.7	V1082	V1082-A1084 PolarHBondContact O-N 3.26Å
1085	V	38	Very low	34.2	Very low	103 Å²	103	127.2 Å²	127.2	62%	0.624	75%	0.752	S	S	*	*	S	Bend	trans	-118	8	-176.7	-166.5	0	0	0	0	113	A1087 A1088	V1085-A1087 PolarHBondContact O-N 2.89Å; V1085-A1088 PolarHBondContact O-N 3.33Å
1086	Q	38.3	Very low	34.5	Very low	186 Å²	186	129.1 Å²	129.1	87%	0.869	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	35.8	154	-154.9	170.1	17.8	0	0	111.5
1087	A	31.6	Very low	34.3	Very low	71 Å²	71	125.3 Å²	125.3	59%	0.587	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.5	-1.2	-175.5	0	0	0	0	0	112.9	V1085	V1085-A1087 PolarHBondContact O-N 2.89Å
1088	A	33.3	Very low	35.1	Very low	67 Å²	67	122.7 Å²	122.7	55%	0.554	76%	0.76	S	S	*	*			trans	-107	96.8	158.3	0	0	0	0	0	106.7	V1085	V1085-A1088 PolarHBondContact O-N 3.33Å
1089	Q	33.5	Very low	35	Very low	180 Å²	180	125.1 Å²	125.1	84%	0.841	77%	0.767	S	S	*	*				57.1	133.6	82.8	-61.8	171.1	4.1	0	0	112.8
1090	A	27.3	Very low	35	Very low	86 Å²	86	122.8 Å²	122.8	71%	0.711	76%	0.756	S	S	*	*			cis	-175.3	166.2	-15.8	0	0	0	0	0	105.9
1091	A	29.1	Very low	35.4	Very low	87 Å²	87	120.2 Å²	120.2	72%	0.719	75%	0.749	S	S	*	*			trans	67	138.2	161.5	0	0	0	0	0	118.4
1092	N	28.8	Very low	36	Very low	126 Å²	126	125.3 Å²	125.3	67%	0.674	76%	0.761	S	S	*	*			trans	62.8	115.6	141.7	-67.6	46.6	0	0	0	119
1093	E	27.1	Very low	36.4	Very low	176 Å²	176	122 Å²	122	82%	0.822	75%	0.751	S	S	*	*				64.8	105.2	76	-65.7	176.6	155.9	0	0	112.6
1094	G	29.8	Very low	36.9	Very low	82 Å²	82	119 Å²	119	85%	0.845	74%	0.74	S	S	*	*			trans	-171.2	107.7	179.1	0	0	0	0	0	113.7
1095	S	29.3	Very low	37.3	Very low	112 Å²	112	122.9 Å²	122.9	78%	0.783	75%	0.747	S	S	*	*			trans	-46.5	136.1	-177	52.2	0	0	0	0	119.5
1096	V	39.2	Very low	37.6	Very low	142 Å²	142	125.8 Å²	125.8	86%	0.861	75%	0.754	S	S	*	*				33.2	116.3	126.4	-173.6	0	0	0	0	119.4
1097	A	33.2	Very low	38.2	Very low	99 Å²	99	121.9 Å²	121.9	82%	0.818	74%	0.742	S	S	*	*			trans	-160.6	154.2	138.7	0	0	0	0	0	111.1
1098	T	48.6	Very low	38.8	Very low	131 Å²	131	123 Å²	123	80%	0.804	74%	0.741	S	S	*	*			trans	-120.4	134.5	179.8	52.2	0	0	0	0	111.7
1099	L	34.7	Very low	39.2	Very low	182 Å²	182	125.9 Å²	125.9	95%	0.953	75%	0.748	S	S	*	*			trans	-139.8	168.6	165.9	-76	-179.9	0	0	0	111.2
1100	S	41.3	Very low	39.9	Very low	97 Å²	97	125.6 Å²	125.6	68%	0.678	74%	0.74	S	S	*	*			trans	-113.8	175	-149.8	51.8	0	0	0	0	116.5	Q1102	S1100-Q1102 PolarHBondContact O-N 3.28Å
1101	D	48	Very low	41.2	Very low	139 Å²	139	126.5 Å²	126.5	74%	0.743	74%	0.737	S	S	*	*	G	3₁₀ helix	trans	-61.2	-3.1	-159.6	-56.7	-61	0	0	0	118.4	G1103	D1101-G1103 VanDerWaalsContact C-N 3.27Å; D1101-G1103 PolarHBondContact O-N 3.46Å
1102	Q	49.8	Very low	41.7	Very low	180 Å²	180	129.7 Å²	129.7	84%	0.841	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-73.4	-15.8	-172.7	-160.7	164.3	4.7	0	0	113.9	S1100	S1100-Q1102 PolarHBondContact O-N 3.28Å
1103	G	47.9	Very low	42.2	Very low	53 Å²	53	128 Å²	128	55%	0.546	74%	0.744	S	S	.	*	G	3₁₀ helix	trans	-79.3	-20.5	-178.6	0	0	0	0	0	116.1	D1101	D1101-G1103 VanDerWaalsContact C-N 3.27Å; D1101-G1103 PolarHBondContact O-N 3.46Å
1104	I	51.9	Low	42.9	Very low	125 Å²	125	126.6 Å²	126.6	64%	0.641	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-76	-31.3	-168	-62.7	175.1	0	0	0	112.3	Q1106	I1104-Q1106 VanDerWaalsContact C-N 3.3Å; I1104-Q1106 PolarHBondContact O-N 3.37Å
1105	M	42.3	Very low	43.4	Very low	156 Å²	156	132.4 Å²	132.4	77%	0.768	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-71.7	-17.8	-169.6	-149.3	72.9	74.1	0	0	114.6
1106	Q	44.6	Very low	43.7	Very low	164 Å²	164	131 Å²	131	77%	0.766	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-87	-24.3	-173.6	-71	-176.1	-28	0	0	114.1	I1104	I1104-Q1106 VanDerWaalsContact C-N 3.3Å; I1104-Q1106 PolarHBondContact O-N 3.37Å
1107	V	50.3	Low	43.2	Very low	104 Å²	104	132.5 Å²	132.5	63%	0.63	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-34	-175.6	-177.6	0	0	0	0	112.1	N1109 Y1110	V1107-N1109 VanDerWaalsContact C-N 3.34Å; V1107-N1109 PolarHBondContact O-N 3.04Å; V1107-Y1110 PolarHBondContact O-N 2.97Å
1108	V	45.7	Very low	43.3	Very low	94 Å²	94	134 Å²	134	57%	0.57	74%	0.742	S	S	*	*	H	α-helix	trans	-64.8	-35.5	-172.8	-177.2	0	0	0	0	112.7	Y1110	V1108-Y1110 VanDerWaalsContact C-N 3.27Å; V1108-Y1110 PolarHBondContact O-N 3.07Å
1109	N	41.3	Very low	42.4	Very low	128 Å²	128	131 Å²	131	68%	0.684	74%	0.737	S	S	*	*	H	α-helix	trans	-74	-13.2	-177.5	-74.6	-9.8	0	0	0	114.1	V1107	V1107-N1109 VanDerWaalsContact C-N 3.34Å; V1107-N1109 PolarHBondContact O-N 3.04Å
1110	Y	48	Very low	42.2	Very low	174 Å²	174	128.8 Å²	128.8	68%	0.682	73%	0.731	S	S	*	*	H	α-helix	trans	-79.4	-36.1	-178.2	-174.4	-107.8	0	0	0	112.8	V1107 V1108	V1107-Y1110 PolarHBondContact O-N 2.97Å; V1108-Y1110 VanDerWaalsContact C-N 3.27Å; V1108-Y1110 PolarHBondContact O-N 3.07Å
1111	V	54.3	Low	41.7	Very low	106 Å²	106	132.1 Å²	132.1	64%	0.642	73%	0.733	S	S	*	*	H	α-helix	trans	-75.4	-28.4	-170.9	-176.5	0	0	0	0	112.7	A1113	V1111-A1113 PolarHBondContact O-N 3.29Å; V1111-A1113 VanDerWaalsContact O-N 3.15Å
1112	L	40.1	Very low	40.7	Very low	154 Å²	154	130.7 Å²	130.7	81%	0.806	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-2.8	-177.5	-68.8	172.7	0	0	0	114.6
1113	A	38.9	Very low	39.8	Very low	90 Å²	90	131 Å²	131	74%	0.744	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	-5.9	-174	0	0	0	0	0	115.2	V1111	V1111-A1113 PolarHBondContact O-N 3.29Å; V1111-A1113 VanDerWaalsContact O-N 3.15Å
1114	Q	42	Very low	38.8	Very low	147 Å²	147	132 Å²	132	69%	0.687	73%	0.73	S	S	*	*	S	Bend	trans	-116.9	2.3	-156.4	-134.4	175.3	20.5	0	0	117.1
1115	Q	40.7	Very low	37.6	Very low	204 Å²	204	131.3 Å²	131.3	95%	0.953	74%	0.737	S	S	*	*			trans	-112.9	56.6	-178.7	-73.2	-171.4	-35.1	0	0	113.4
1116	A	34.5	Very low	36.9	Very low	81 Å²	81	132.5 Å²	132.5	67%	0.669	74%	0.74	S	S	*	*			trans	-121.6	148.9	163	0	0	0	0	0	110.2
1117	M	29.6	Very low	36.1	Very low	175 Å²	175	133 Å²	133	86%	0.862	74%	0.742	S	S	*	*			trans	87.5	119.6	170.6	-45.8	-61	-82.8	0	0	119
1118	S	35.1	Very low	35	Very low	131 Å²	131	135.9 Å²	135.9	92%	0.916	75%	0.753	S	S	*	*			trans	65.9	151.7	158.8	66	0	0	0	0	120.8
1119	G	28.3	Very low	34	Very low	68 Å²	68	139.7 Å²	139.7	70%	0.701	76%	0.764	S	S	*	*			cis	152.6	134.2	-20.2	0	0	0	0	0	118.3
1120	V	32	Very low	33.5	Very low	135 Å²	135	139.2 Å²	139.2	82%	0.818	77%	0.766	S	S	*	*			trans	89	114.1	144.7	-178.9	0	0	0	0	122.6
1121	K	29.8	Very low	32.4	Very low	167 Å²	167	138.5 Å²	138.5	73%	0.726	77%	0.771	S	S	*	*			trans	63.3	160.5	145.4	-76.2	177.4	147.6	-73.6	0	121.3
1122	D	28.6	Very low	31.1	Very low	108 Å²	108	140.7 Å²	140.7	58%	0.578	77%	0.774	S	S	*	*			cis	-158.7	161.2	0.2	-110.5	-24	0	0	0	111.8
1123	E	29.9	Very low	30.4	Very low	187 Å²	187	139.1 Å²	139.1	87%	0.874	77%	0.77	S	S	*	*			trans	54.5	164.8	156.6	-67.1	-178.5	173.4	0	0	122
1124	A	26.7	Very low	29.7	Very low	75 Å²	75	143.7 Å²	143.7	62%	0.62	78%	0.776	S	S	*	*			cis	-172.3	155.3	-39.6	0	0	0	0	0	111.8
1125	S	26.4	Very low	29.3	Very low	110 Å²	110	142.6 Å²	142.6	77%	0.769	78%	0.779	S	S	*	*			trans	65.5	159.3	165.4	8.6	0	0	0	0	118
1126	E	28.8	Very low	28.5	Very low	180 Å²	180	137.6 Å²	137.6	84%	0.841	77%	0.773	S	S	*	*			cis	-151.8	-165.1	-4.3	-138.1	163	-137.3	0	0	112.4
1127	E	26.5	Very low	28.5	Very low	174 Å²	174	142.2 Å²	142.2	81%	0.813	78%	0.781	S	S	*	*			trans	-71.6	178.5	-164.9	-52.3	176.7	142.7	0	0	116.3
1128	I	27.9	Very low	28.4	Very low	166 Å²	166	140.3 Å²	140.3	85%	0.851	78%	0.778	S	S	*	*				-161.1	153	85.1	-88.9	162.7	0	0	0	112.5
1129	H	25.8	Very low	28.3	Very low	173 Å²	173	137.9 Å²	137.9	80%	0.801	77%	0.766	S	S	*	*			trans	-83.4	158.8	-179.2	-151.3	81.3	0	0	0	114.1
1130	T	29	Very low	28.5	Very low	119 Å²	119	143 Å²	143	73%	0.73	77%	0.772	S	S	*	*			trans	-89.6	136.8	-178.9	53.6	0	0	0	0	114.2
1131	M	26.4	Very low	28.7	Very low	159 Å²	159	142.3 Å²	142.3	78%	0.783	77%	0.768	S	S	*	*			trans	-175	158.5	155.8	-98.1	161.1	75.9	0	0	106.7
1132	E	25.3	Very low	29.3	Very low	151 Å²	151	146.6 Å²	146.6	71%	0.706	79%	0.79	S	S	*	*			cis	-148.1	131.9	6.2	-118.6	170.4	167.6	0	0	106.8
1133	V	26	Very low	29.3	Very low	121 Å²	121	148.6 Å²	148.6	73%	0.733	80%	0.801	S	S	*	*				89.3	148.2	91.9	162.6	0	0	0	0	116.4
1134	E	25.6	Very low	29.3	Very low	187 Å²	187	146.5 Å²	146.5	87%	0.874	80%	0.797	S	S	*	*			trans	89.4	155.7	163.7	-100.2	170.1	-141.9	0	0	122.3
1135	V	32.7	Very low	29.4	Very low	123 Å²	123	150.5 Å²	150.5	75%	0.745	81%	0.807	S	S	*	*			trans	-127.3	140.3	-157.3	171.7	0	0	0	0	109.6
1136	A	24.4	Very low	29.6	Very low	100 Å²	100	152.9 Å²	152.9	83%	0.826	81%	0.809	S	S	*	*			trans	-133.3	134.6	161.2	0	0	0	0	0	111.1
1137	H	33.4	Very low	29.7	Very low	178 Å²	178	151.2 Å²	151.2	82%	0.824	81%	0.807	S	S	*	*			trans	-97.8	137.7	168.8	-86.7	40.7	0	0	0	110.3
1138	V	28	Very low	29.9	Very low	135 Å²	135	149.7 Å²	149.7	82%	0.818	81%	0.807	S	S	*	*			trans	-147.3	124.3	146.2	-156.4	0	0	0	0	102.6
1139	A	33.7	Very low	30	Very low	80 Å²	80	148.5 Å²	148.5	66%	0.661	80%	0.804	S	S	*	*				56.7	150.3	64.3	0	0	0	0	0	111.6
1140	E	32.5	Very low	30.3	Very low	175 Å²	175	146.6 Å²	146.6	82%	0.818	80%	0.804	S	S	*	*			cis	-165.1	163.8	11.8	-149.6	167.5	-136.3	0	0	108.9
1141	V	35.9	Very low	30.4	Very low	121 Å²	121	148.9 Å²	148.9	73%	0.733	81%	0.81	S	S	*	*			trans	68.4	143.1	166.8	-173.4	0	0	0	0	115.2
1142	E	41.3	Very low	30.8	Very low	257 Å²	257	148 Å²	148	100%	1.201	81%	0.813	S	S	*	*			cis	-129	0	6.2	-151	155.1	-130.7	0	0	112.1

Retrieved 1,142 of 1,142 residues in 716.7 ms (Link to these results)

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