A0A3Q0KTS4_SCHMA Loading...

Nucleolar protein 10

AlphaFold DB , UniProt , Accession A0A3Q0KTS4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 520 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	68.4	Low	81	Confident	53 Å²	53	67.5 Å²	67.5	26%	0.261	39%	0.385	S	S	.	.				0	125.9	0	-165.9	176.4	-155.3	0	0	108	Y12 L14 I42 V364	M1-Y12 HydrophobicContact CE-CD1 3.3Å; M1-Y12 HydrophobicContact CE-CE1 4.22Å; M1-Y12 HydrophobicContact CE-CG 3.53Å; M1-Y12 HydrophobicContact CG-CD1 4Å; M1-Y12 HydrophobicContact SD-CD1 3.58Å; M1-Y12 VanDerWaalsContact SD-CD1 3.58Å; M1-Y12 HydrophobicContact SD-CE1 4.29Å; M1-Y12 HydrophobicContact SD-CG 4.36Å; M1-L14 HydrophobicContact CE-CD2 3.52Å; M1-L14 HydrophobicContact CE-CG 4.2Å; M1-L14 HydrophobicContact CG-CD2 4.09Å; M1-L14 HydrophobicContact SD-CD2 4.24Å; M1-I42 HydrophobicContact CB-CD1 4.44Å; M1-I42 HydrophobicContact SD-CD1 4.28Å; M1-V364 HydrophobicContact CE-CG2 3.61Å
2	N	75.8	Confident	81.8	Confident	114 Å²	114	62.1 Å²	62.1	61%	0.61	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.1	124.6	175.9	-75.3	-9.3	0	0	0	108.8	N13	N2-N13 HydrophobicContact CB-CB 4.28Å; N2-N13 PolarHBondContact N-O 3.28Å; N2-N13 VanDerWaalsContact N-O 3.1Å; N2-N13 WeakPolarHBondContact O-CB 3.42Å; N2-N13 PolarHBondContact O-N 2.97Å
3	V	78.1	Confident	82.4	Confident	69 Å²	69	58.8 Å²	58.8	42%	0.418	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	124.2	-180	-170.3	0	0	0	0	109.1	K10 Y12	V3-K10 HydrophobicContact CG1-CB 4.22Å; V3-K10 HydrophobicContact CG1-CG 4.48Å; V3-Y12 HydrophobicContact CB-CD1 4.43Å; V3-Y12 HydrophobicContact CB-CE1 4.45Å; V3-Y12 HydrophobicContact CG1-CD1 4.29Å; V3-Y12 HydrophobicContact CG1-CE1 4.07Å; V3-Y12 HydrophobicContact CG2-CD1 3.55Å; V3-Y12 HydrophobicContact CG2-CE1 3.54Å
4	V	81.3	Confident	82.8	Confident	64 Å²	64	55.4 Å²	55.4	39%	0.388	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	118	175	177	0	0	0	0	107.3	I6 V11	V4-I6 HydrophobicContact CG1-CD1 3.45Å; V4-I6 VanDerWaalsContact CG1-CD1 3.45Å; V4-I6 HydrophobicContact CG1-CG1 3.68Å; V4-V11 PolarHBondContact N-O 3.42Å; V4-V11 PolarHBondContact O-N 2.96Å
5	K	77.8	Confident	82.7	Confident	141 Å²	141	52.9 Å²	52.9	61%	0.613	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	114.2	174.8	-72.7	-173	-177.4	-179.5	0	109	V9 K10	K5-V9 WeakPolarHBondContact CA-O 3.39Å; K5-K10 HydrophobicContact CD-CG 4.44Å; K5-K10 HydrophobicContact CG-CG 4.01Å
6	I	79.1	Confident	81.6	Confident	48 Å²	48	50.8 Å²	50.8	25%	0.246	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	130.8	177.2	-64.6	168.9	0	0	0	107.9	V4 G8 V9 G313 F314	V4-I6 HydrophobicContact CG1-CD1 3.45Å; V4-I6 VanDerWaalsContact CG1-CD1 3.45Å; V4-I6 HydrophobicContact CG1-CG1 3.68Å; I6-G8 PolarHBondContact O-N 3.48Å; I6-G8 VanDerWaalsContact O-N 3.12Å; I6-V9 PolarHBondContact N-O 2.96Å; I6-V9 PolarHBondContact O-N 3.41Å; I6-G313 WeakPolarHBondContact CD1-O 3.05Å; I6-F314 HydrophobicContact CD1-CB 3.98Å
7	N	80.2	Confident	80.4	Confident	114 Å²	114	53.5 Å²	53.5	61%	0.61	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	31.4	-177.5	-63.1	-8.3	0	0	0	114.5	V9	N7-V9 PolarHBondContact O-N 3.43Å
8	G	79.6	Confident	79	Confident	77 Å²	77	59.3 Å²	59.3	79%	0.794	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	-4.2	-176.7	0	0	0	0	0	114.8	I6	I6-G8 PolarHBondContact O-N 3.48Å; I6-G8 VanDerWaalsContact O-N 3.12Å
9	V	88.2	Confident	77.8	Confident	11 Å²	11	59.2 Å²	59.2	7%	0.067	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	134.8	175.1	-169.9	0	0	0	0	109.9	K5 I6 N7 F311 V312 I347 L349	K5-V9 WeakPolarHBondContact CA-O 3.39Å; I6-V9 PolarHBondContact N-O 2.96Å; I6-V9 PolarHBondContact O-N 3.41Å; N7-V9 PolarHBondContact O-N 3.43Å; V9-F311 HydrophobicContact CG1-CE1 4.42Å; V9-F311 HydrophobicContact CG1-CZ 4.48Å; V9-F311 HydrophobicContact CG2-CE2 4.43Å; V9-F311 HydrophobicContact CG2-CZ 4.4Å; V9-V312 HydrophobicContact CB-CG2 3.4Å; V9-V312 HydrophobicContact CG1-CG2 3.52Å; V9-V312 HydrophobicContact CG2-CG2 3.59Å; V9-I347 HydrophobicContact CG1-CG2 3.96Å; V9-L349 HydrophobicContact CB-CD2 4.38Å; V9-L349 HydrophobicContact CG1-CB 4Å; V9-L349 HydrophobicContact CG1-CD2 3.92Å; V9-L349 HydrophobicContact CG2-CD2 3.75Å
10	K	90.4	Very high	76.7	Confident	49 Å²	49	58.3 Å²	58.3	21%	0.213	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	122.6	176.6	-61.2	176.8	-167.3	172.2	0	109.1	V3 K5 Y12 E368	V3-K10 HydrophobicContact CG1-CB 4.22Å; V3-K10 HydrophobicContact CG1-CG 4.48Å; K5-K10 HydrophobicContact CD-CG 4.44Å; K5-K10 HydrophobicContact CG-CG 4.01Å; K10-Y12 HydrophobicContact CB-CD2 4.41Å; K10-Y12 HydrophobicContact CB-CE2 3.63Å; K10-Y12 HydrophobicContact CD-CE2 4.45Å; K10-Y12 WeakPolarHBondContact CD-OH 3.41Å; K10-E368 IonicContact NZ-OE1 3.45Å; K10-E368 PolarHBondContact NZ-OE1 2.88Å; K10-E368 IonicContact NZ-OE2 3Å; K10-E368 PolarHBondContact NZ-OE2 2.94Å
11	V	92.2	Very high	76.1	Confident	2 Å²	2	58.3 Å²	58.3	1%	0.012	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124	170.4	-177.3	0	0	0	0	107.9	V4 V312 F314 Y345 I347	V4-V11 PolarHBondContact N-O 3.42Å; V4-V11 PolarHBondContact O-N 2.96Å; V11-V312 HydrophobicContact CG2-CG1 3.53Å; V11-F314 HydrophobicContact CG1-CD1 4.02Å; V11-F314 HydrophobicContact CG1-CD2 4.43Å; V11-F314 HydrophobicContact CG1-CE1 4.14Å; V11-F314 HydrophobicContact CG1-CG 4.17Å; V11-F314 HydrophobicContact CG1-CZ 4.4Å; V11-F314 HydrophobicContact CG2-CD1 4.11Å; V11-Y345 HydrophobicContact CG1-CD1 3.88Å; V11-I347 HydrophobicContact CG1-CG1 4.19Å; V11-I347 HydrophobicContact CG2-CD1 4.31Å; V11-I347 HydrophobicContact CG2-CG1 4.23Å
12	Y	90.8	Very high	75.7	Confident	3 Å²	3	64.4 Å²	64.4	1%	0.012	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	117.9	-179.8	-64.3	-97.6	0	0	0	109.8	M1 V3 K10 Y345 F346 P348 V364 E368	M1-Y12 HydrophobicContact CE-CD1 3.3Å; M1-Y12 HydrophobicContact CE-CE1 4.22Å; M1-Y12 HydrophobicContact CE-CG 3.53Å; M1-Y12 HydrophobicContact CG-CD1 4Å; M1-Y12 HydrophobicContact SD-CD1 3.58Å; M1-Y12 VanDerWaalsContact SD-CD1 3.58Å; M1-Y12 HydrophobicContact SD-CE1 4.29Å; M1-Y12 HydrophobicContact SD-CG 4.36Å; V3-Y12 HydrophobicContact CB-CD1 4.43Å; V3-Y12 HydrophobicContact CB-CE1 4.45Å; V3-Y12 HydrophobicContact CG1-CD1 4.29Å; V3-Y12 HydrophobicContact CG1-CE1 4.07Å; V3-Y12 HydrophobicContact CG2-CD1 3.55Å; V3-Y12 HydrophobicContact CG2-CE1 3.54Å; K10-Y12 HydrophobicContact CB-CD2 4.41Å; K10-Y12 HydrophobicContact CB-CE2 3.63Å; K10-Y12 HydrophobicContact CD-CE2 4.45Å; K10-Y12 WeakPolarHBondContact CD-OH 3.41Å; Y12-Y345 CarbonylContact O-C 3.4Å; Y12-Y345 WeakPolarHBondContact O-CA 3.49Å; Y12-F346 PolarHBondContact N-O 3.43Å; Y12-F346 PolarHBondContact O-N 3.07Å; Y12-P348 HydrophobicContact CD2-CG 3.89Å; Y12-P348 HydrophobicContact CE2-CG 3.53Å; Y12-V364 HydrophobicContact CD1-CG2 4.42Å; Y12-V364 HydrophobicContact CD2-CG2 4.46Å; Y12-V364 HydrophobicContact CE1-CG1 4.15Å; Y12-V364 HydrophobicContact CE1-CG2 4.39Å; Y12-V364 HydrophobicContact CE2-CG1 3.88Å; Y12-V364 HydrophobicContact CE2-CG2 4.5Å; Y12-V364 HydrophobicContact CG-CG2 4.44Å; Y12-E368 PolarHBondContact OH-OE1 3.38Å
13	N	89.2	Confident	75.4	Confident	19 Å²	19	69.7 Å²	69.7	10%	0.102	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	114	172.3	-171.2	-7.9	0	0	0	109.7	N2 T15 Y345	N2-N13 HydrophobicContact CB-CB 4.28Å; N2-N13 PolarHBondContact N-O 3.28Å; N2-N13 VanDerWaalsContact N-O 3.1Å; N2-N13 WeakPolarHBondContact O-CB 3.42Å; N2-N13 PolarHBondContact O-N 2.97Å; N13-T15 VanDerWaalsContact CG-OG1 3.23Å; N13-T15 PolarHBondContact ND2-OG1 2.95Å; N13-T15 VanDerWaalsContact OD1-CB 3.3Å; N13-T15 WeakPolarHBondContact OD1-CB 3.47Å; N13-T15 VanDerWaalsContact OD1-CG2 3.31Å; N13-T15 WeakPolarHBondContact OD1-CG2 3.4Å; N13-T15 PolarHBondContact OD1-N 3.15Å; N13-T15 PolarHBondContact OD1-OG1 3.27Å; N13-Y345 HydrophobicContact CB-CD1 3.99Å; N13-Y345 HydrophobicContact CB-CE1 3.77Å
14	L	87.5	Confident	75.1	Confident	11 Å²	11	66.8 Å²	66.8	6%	0.058	35%	0.346	C	S	.	.			trans	-96.8	-1.2	-178.7	-67.8	160.8	0	0	0	112.2	M1 A16 L44 L332 T344 F346 L360	M1-L14 HydrophobicContact CE-CD2 3.52Å; M1-L14 HydrophobicContact CE-CG 4.2Å; M1-L14 HydrophobicContact CG-CD2 4.09Å; M1-L14 HydrophobicContact SD-CD2 4.24Å; L14-A16 PolarHBondContact O-N 3.09Å; L14-L44 HydrophobicContact CB-CD1 4.47Å; L14-L44 HydrophobicContact CD1-CD1 3.79Å; L14-L332 HydrophobicContact CD1-CD1 4.35Å; L14-T344 VanDerWaalsContact CB-OG1 3.32Å; L14-T344 WeakPolarHBondContact CB-OG1 2.96Å; L14-T344 PolarHBondContact N-O 3.4Å; L14-F346 HydrophobicContact CD1-CB 3.71Å; L14-L360 HydrophobicContact CD1-CD1 3.46Å; L14-L360 VanDerWaalsContact CD1-CD1 3.46Å; L14-L360 HydrophobicContact CD1-CG 4.48Å
15	T	82.4	Confident	74.8	Confident	18 Å²	18	66.3 Å²	66.3	11%	0.11	35%	0.345	C	S	.	.			trans	-65.8	131	-179.8	55.8	0	0	0	0	112.6	N13 N17	N13-T15 VanDerWaalsContact CG-OG1 3.23Å; N13-T15 PolarHBondContact ND2-OG1 2.95Å; N13-T15 VanDerWaalsContact OD1-CB 3.3Å; N13-T15 WeakPolarHBondContact OD1-CB 3.47Å; N13-T15 VanDerWaalsContact OD1-CG2 3.31Å; N13-T15 WeakPolarHBondContact OD1-CG2 3.4Å; N13-T15 PolarHBondContact OD1-N 3.15Å; N13-T15 PolarHBondContact OD1-OG1 3.27Å; T15-N17 VanDerWaalsContact C-N 3.27Å; T15-N17 VanDerWaalsContact CB-OD1 3.3Å; T15-N17 WeakPolarHBondContact CB-OD1 3.48Å; T15-N17 PolarHBondContact O-N 3.39Å; T15-N17 VanDerWaalsContact OG1-CG 3.27Å; T15-N17 PolarHBondContact OG1-ND2 2.94Å; T15-N17 PolarHBondContact OG1-OD1 3.37Å
16	A	64.7	Low	74.7	Confident	19 Å²	19	68 Å²	68	16%	0.157	35%	0.352	C	S	.	.			trans	-80.2	67.5	-179.7	0	0	0	0	0	112.2	L14 R18 R41 K341	L14-A16 PolarHBondContact O-N 3.09Å; A16-R18 PolarHBondContact O-N 2.95Å; A16-R41 HydrophobicContact CB-CG 4.48Å; A16-R41 VanDerWaalsContact CB-CZ 3.45Å; A16-R41 VanDerWaalsContact CB-NH2 3.29Å; A16-K341 HydrophobicContact CB-CD 4.32Å; A16-K341 WeakPolarHBondContact O-CD 2.98Å; A16-K341 PolarHBondContact O-NZ 2.94Å
17	N	60.4	Low	74.7	Confident	98 Å²	98	69.3 Å²	69.3	52%	0.524	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	14.2	-167.7	-67.5	-17.5	0	0	0	116.4	T15	T15-N17 VanDerWaalsContact C-N 3.27Å; T15-N17 VanDerWaalsContact CB-OD1 3.3Å; T15-N17 WeakPolarHBondContact CB-OD1 3.48Å; T15-N17 PolarHBondContact O-N 3.39Å; T15-N17 VanDerWaalsContact OG1-CG 3.27Å; T15-N17 PolarHBondContact OG1-ND2 2.94Å; T15-N17 PolarHBondContact OG1-OD1 3.37Å
18	R	56.6	Low	74.5	Confident	158 Å²	158	68.6 Å²	68.6	60%	0.596	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.2	38.6	178.6	-67.5	-172.5	176.4	-172.9	-1.9	113.7	A16 L20 E37	A16-R18 PolarHBondContact O-N 2.95Å; R18-L20 PolarHBondContact O-N 3.03Å; R18-E37 IonicContact CZ-OE2 2.88Å; R18-E37 IonicContact NH1-OE1 3.9Å; R18-E37 PolarHBondContact NH1-OE1 3.36Å; R18-E37 IonicContact NH1-OE2 3.07Å; R18-E37 PolarHBondContact NH1-OE2 2.81Å
19	S	55	Low	74.3	Confident	56 Å²	56	68.8 Å²	68.8	39%	0.392	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-69.1	130.5	163.6	43.7	0	0	0	0	109.4	K341	S19-K341 VanDerWaalsContact CB-NZ 3.26Å; S19-K341 WeakPolarHBondContact OG-CE 2.95Å; S19-K341 PolarHBondContact OG-NZ 2.88Å
20	L	57.1	Low	73.6	Confident	41 Å²	41	77.6 Å²	77.6	22%	0.215	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-56.1	145.7	160.3	-76.6	157.3	0	0	0	108.5	R18 A24 K29 R32	R18-L20 PolarHBondContact O-N 3.03Å; L20-A24 HydrophobicContact CB-CB 3.75Å; L20-A24 HydrophobicContact CD2-CB 4.18Å; L20-A24 HydrophobicContact CG-CB 4.43Å; L20-K29 HydrophobicContact CB-CG 4.35Å; L20-K29 VanDerWaalsContact CD1-CA 3.49Å; L20-K29 HydrophobicContact CD1-CB 4.2Å; L20-K29 HydrophobicContact CD1-CG 3.76Å; L20-R32 HydrophobicContact CD1-CB 4.06Å; L20-R32 HydrophobicContact CD1-CG 4.21Å
21	P	62.7	Low	72.9	Confident	60 Å²	60	82.9 Å²	82.9	39%	0.39	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-49.4	150.7	171.9	-23.5	30.7	0	0	0	111.2	W23 A24	P21-W23 HydrophobicContact CB-CD2 4.06Å; P21-W23 HydrophobicContact CB-CG 4.17Å; P21-W23 HydrophobicContact CB-CZ2 4.07Å; P21-W23 HydrophobicContact CG-CZ2 4.1Å; P21-W23 PolarHBondContact O-N 3.43Å; P21-A24 WeakPolarHBondContact O-CB 3.46Å; P21-A24 PolarHBondContact O-N 3.48Å
22	E	61.5	Low	71.7	Confident	181 Å²	181	88 Å²	88	85%	0.846	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-38.2	-177.7	-161.8	-174.2	174.9	0	0	111.6	A24 K29	E22-A24 VanDerWaalsContact C-N 3.27Å; E22-A24 PolarHBondContact O-N 3.19Å; E22-K29 PolarHBondContact O-NZ 3.44Å
23	W	69.3	Low	70.5	Confident	225 Å²	225	95.3 Å²	95.3	85%	0.852	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-5.8	176.9	58	-96.2	0	0	0	114.7	P21 S25	P21-W23 HydrophobicContact CB-CD2 4.06Å; P21-W23 HydrophobicContact CB-CG 4.17Å; P21-W23 HydrophobicContact CB-CZ2 4.07Å; P21-W23 HydrophobicContact CG-CZ2 4.1Å; P21-W23 PolarHBondContact O-N 3.43Å; W23-S25 PolarHBondContact O-N 3.29Å
24	A	70.4	Confident	69.5	Low	8 Å²	8	99 Å²	99	7%	0.066	47%	0.471	C	S	.	.	S	Bend	trans	-59.9	139.4	175.5	0	0	0	0	0	110.5	L20 P21 E22 K29	L20-A24 HydrophobicContact CB-CB 3.75Å; L20-A24 HydrophobicContact CD2-CB 4.18Å; L20-A24 HydrophobicContact CG-CB 4.43Å; P21-A24 WeakPolarHBondContact O-CB 3.46Å; P21-A24 PolarHBondContact O-N 3.48Å; E22-A24 VanDerWaalsContact C-N 3.27Å; E22-A24 PolarHBondContact O-N 3.19Å; A24-K29 VanDerWaalsContact O-CE 3.27Å; A24-K29 WeakPolarHBondContact O-CE 3.46Å
25	S	74.7	Confident	68.7	Low	53 Å²	53	102 Å²	102	37%	0.371	49%	0.487	S	S	.	.			trans	-60.7	148.3	-172.2	68.3	0	0	0	0	111.3	W23 S27 E28 K29	W23-S25 PolarHBondContact O-N 3.29Å; S25-S27 PolarHBondContact O-N 3.42Å; S25-E28 PolarHBondContact N-OE2 2.95Å; S25-E28 VanDerWaalsContact N-OE2 3.07Å; S25-E28 PolarHBondContact O-N 3.16Å; S25-E28 VanDerWaalsContact O-N 3.11Å; S25-E28 VanDerWaalsContact OG-CG 3.3Å; S25-E28 WeakPolarHBondContact OG-CG 3.46Å; S25-E28 PolarHBondContact OG-N 3.5Å; S25-E28 VanDerWaalsContact OG-N 3.16Å; S25-E28 PolarHBondContact OG-OE2 2.96Å; S25-K29 PolarHBondContact O-N 2.91Å
26	K	76.9	Confident	68.1	Low	177 Å²	177	105.9 Å²	105.9	77%	0.77	51%	0.511	S	S	*	.	H	α-helix	trans	-56	-27.7	174.5	-71.6	-176.5	-179.1	176	0	111.9	R30	K26-R30 WeakPolarHBondContact O-CG 3.39Å; K26-R30 PolarHBondContact O-N 2.94Å
27	S	79.4	Confident	68.2	Low	75 Å²	75	110.6 Å²	110.6	52%	0.524	53%	0.53	S	S	.	.	H	α-helix	trans	-69.1	-47.6	176.5	-168.1	0	0	0	0	112.2	S25 K29 R30 K31	S25-S27 PolarHBondContact O-N 3.42Å; S27-K29 PolarHBondContact O-N 2.93Å; S27-R30 WeakPolarHBondContact O-CB 3.43Å; S27-R30 PolarHBondContact O-N 3.32Å; S27-R30 VanDerWaalsContact O-N 3.12Å; S27-K31 PolarHBondContact O-N 3.44Å
28	E	75.5	Confident	68.4	Low	100 Å²	100	109 Å²	109	47%	0.467	52%	0.52	S	S	.	.	H	α-helix	trans	-64.1	-40.6	175.4	-73.2	162.8	140.8	0	0	112	S25 R30 K31 R32	S25-E28 PolarHBondContact N-OE2 2.95Å; S25-E28 VanDerWaalsContact N-OE2 3.07Å; S25-E28 PolarHBondContact O-N 3.16Å; S25-E28 VanDerWaalsContact O-N 3.11Å; S25-E28 VanDerWaalsContact OG-CG 3.3Å; S25-E28 WeakPolarHBondContact OG-CG 3.46Å; S25-E28 PolarHBondContact OG-N 3.5Å; S25-E28 VanDerWaalsContact OG-N 3.16Å; S25-E28 PolarHBondContact OG-OE2 2.96Å; E28-R30 PolarHBondContact O-N 3.42Å; E28-K31 PolarHBondContact O-N 2.96Å; E28-R32 PolarHBondContact O-N 3.45Å
29	K	74.5	Confident	68.7	Low	80 Å²	80	106.6 Å²	106.6	35%	0.348	53%	0.528	S	S	.	.	H	α-helix	trans	-59.3	-35.7	172.9	-70	-179.6	-177.4	175	0	111.9	L20 E22 A24 S25 S27 K33	L20-K29 HydrophobicContact CB-CG 4.35Å; L20-K29 VanDerWaalsContact CD1-CA 3.49Å; L20-K29 HydrophobicContact CD1-CB 4.2Å; L20-K29 HydrophobicContact CD1-CG 3.76Å; E22-K29 PolarHBondContact O-NZ 3.44Å; A24-K29 VanDerWaalsContact O-CE 3.27Å; A24-K29 WeakPolarHBondContact O-CE 3.46Å; S25-K29 PolarHBondContact O-N 2.91Å; S27-K29 PolarHBondContact O-N 2.93Å; K29-K33 PolarHBondContact O-N 3.31Å
30	R	74.9	Confident	69.3	Low	197 Å²	197	112.8 Å²	112.8	74%	0.743	54%	0.543	S	S	*	.	H	α-helix	trans	-73.7	-41.4	174.2	-78.3	177.5	-179.5	178.2	0.4	112.6	K26 S27 E28 R32 K33	K26-R30 WeakPolarHBondContact O-CG 3.39Å; K26-R30 PolarHBondContact O-N 2.94Å; S27-R30 WeakPolarHBondContact O-CB 3.43Å; S27-R30 PolarHBondContact O-N 3.32Å; S27-R30 VanDerWaalsContact O-N 3.12Å; E28-R30 PolarHBondContact O-N 3.42Å; R30-R32 PolarHBondContact O-N 2.91Å; R30-K33 WeakPolarHBondContact O-CB 3.23Å; R30-K33 PolarHBondContact O-N 2.97Å
31	K	75.5	Confident	70	Confident	160 Å²	160	114.8 Å²	114.8	70%	0.696	55%	0.548	S	S	*	.	H	α-helix	trans	-60.3	-43.4	176.6	-82.9	-173.3	175.5	-179.3	0	111.9	S27 E28 K33 S34	S27-K31 PolarHBondContact O-N 3.44Å; E28-K31 PolarHBondContact O-N 2.96Å; K31-K33 VanDerWaalsContact C-N 3.29Å; K31-K33 PolarHBondContact O-N 3.48Å; K31-S34 PolarHBondContact O-N 2.87Å; K31-S34 PolarHBondContact O-OG 3.05Å
32	R	66.2	Low	70.7	Confident	108 Å²	108	113.7 Å²	113.7	41%	0.408	54%	0.538	S	S	.	.	H	α-helix	trans	-72.6	-16.8	176.8	-84.8	-156.4	178.9	173.3	0.4	114.7	L20 E28 R30 S34 D35	L20-R32 HydrophobicContact CD1-CB 4.06Å; L20-R32 HydrophobicContact CD1-CG 4.21Å; E28-R32 PolarHBondContact O-N 3.45Å; R30-R32 PolarHBondContact O-N 2.91Å; R32-S34 PolarHBondContact O-N 3.03Å; R32-D35 WeakPolarHBondContact O-CB 3.4Å; R32-D35 PolarHBondContact O-N 3.15Å; R32-D35 VanDerWaalsContact O-N 3.08Å
33	K	67.2	Low	71.6	Confident	157 Å²	157	110.1 Å²	110.1	68%	0.683	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-20.1	174.9	-90.4	-174.1	176.2	-168.2	0	113.2	K29 R30 K31 D35 L38	K29-K33 PolarHBondContact O-N 3.31Å; R30-K33 WeakPolarHBondContact O-CB 3.23Å; R30-K33 PolarHBondContact O-N 2.97Å; K31-K33 VanDerWaalsContact C-N 3.29Å; K31-K33 PolarHBondContact O-N 3.48Å; K33-D35 VanDerWaalsContact C-N 3.26Å; K33-L38 HydrophobicContact CB-CD2 4.48Å; K33-L38 HydrophobicContact CG-CD2 3.88Å
34	S	68.1	Low	72.5	Confident	97 Å²	97	100.2 Å²	100.2	68%	0.678	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-9.1	173.8	59.1	0	0	0	0	113.8	K31 R32 V36	K31-S34 PolarHBondContact O-N 2.87Å; K31-S34 PolarHBondContact O-OG 3.05Å; R32-S34 PolarHBondContact O-N 3.03Å; S34-V36 PolarHBondContact O-N 3.43Å
35	D	69.5	Low	73.5	Confident	73 Å²	73	100.1 Å²	100.1	39%	0.39	48%	0.484	S	S	.	.			trans	-70.4	124.3	-179.1	-68.3	-23.8	0	0	0	110.1	R32 K33 E37 L38	R32-D35 WeakPolarHBondContact O-CB 3.4Å; R32-D35 PolarHBondContact O-N 3.15Å; R32-D35 VanDerWaalsContact O-N 3.08Å; K33-D35 VanDerWaalsContact C-N 3.26Å; D35-E37 PolarHBondContact O-N 3.48Å; D35-E37 VanDerWaalsContact O-N 3.13Å; D35-L38 WeakPolarHBondContact O-CB 3.37Å; D35-L38 PolarHBondContact O-N 3.25Å
36	V	70.3	Confident	74.2	Confident	101 Å²	101	102.7 Å²	102.7	61%	0.612	49%	0.489	S	S	*	.	H	α-helix	trans	-55.4	-32	178.8	178.2	0	0	0	0	111.5	S34 L38 S39 R40	S34-V36 PolarHBondContact O-N 3.43Å; V36-L38 VanDerWaalsContact C-N 3.31Å; V36-L38 PolarHBondContact O-N 2.92Å; V36-S39 WeakPolarHBondContact O-CB 3.32Å; V36-S39 PolarHBondContact O-N 3.34Å; V36-R40 PolarHBondContact O-N 2.95Å
37	E	65.7	Low	74.7	Confident	118 Å²	118	99.3 Å²	99.3	55%	0.551	48%	0.476	S	S	*	.	H	α-helix	trans	-62.2	-35.9	175.3	-66.9	-176	171.3	0	0	112.9	R18 D35 S39 R40 R41	R18-E37 IonicContact CZ-OE2 2.88Å; R18-E37 IonicContact NH1-OE1 3.9Å; R18-E37 PolarHBondContact NH1-OE1 3.36Å; R18-E37 IonicContact NH1-OE2 3.07Å; R18-E37 PolarHBondContact NH1-OE2 2.81Å; D35-E37 PolarHBondContact O-N 3.48Å; D35-E37 VanDerWaalsContact O-N 3.13Å; E37-S39 VanDerWaalsContact C-N 3.29Å; E37-S39 PolarHBondContact O-N 2.99Å; E37-R40 PolarHBondContact O-N 3.27Å; E37-R40 VanDerWaalsContact O-N 3.16Å; E37-R41 PolarHBondContact O-N 3Å
38	L	65.6	Low	75.3	Confident	63 Å²	63	96.7 Å²	96.7	33%	0.33	46%	0.457	S	S	.	.	H	α-helix	trans	-68.1	-34.4	178.4	-150.9	89.8	0	0	0	110.8	K33 D35 V36 R40 R41	K33-L38 HydrophobicContact CB-CD2 4.48Å; K33-L38 HydrophobicContact CG-CD2 3.88Å; D35-L38 WeakPolarHBondContact O-CB 3.37Å; D35-L38 PolarHBondContact O-N 3.25Å; V36-L38 VanDerWaalsContact C-N 3.31Å; V36-L38 PolarHBondContact O-N 2.92Å; L38-R40 PolarHBondContact O-N 2.97Å; L38-R41 VanDerWaalsContact O-CB 3.25Å; L38-R41 WeakPolarHBondContact O-CB 3.33Å; L38-R41 PolarHBondContact O-N 3.49Å
39	S	63.2	Low	76.1	Confident	109 Å²	109	95.7 Å²	95.7	76%	0.762	45%	0.452	S	S	*	.	H	α-helix	trans	-67.2	-20.6	174.7	-171	0	0	0	0	113.2	V36 E37	V36-S39 WeakPolarHBondContact O-CB 3.32Å; V36-S39 PolarHBondContact O-N 3.34Å; E37-S39 VanDerWaalsContact C-N 3.29Å; E37-S39 PolarHBondContact O-N 2.99Å
40	R	67.5	Low	76.9	Confident	186 Å²	186	92 Å²	92	70%	0.702	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	8.8	175.7	-65.2	-177.8	179	171.7	-1.8	112.9	V36 E37 L38	V36-R40 PolarHBondContact O-N 2.95Å; E37-R40 PolarHBondContact O-N 3.27Å; E37-R40 VanDerWaalsContact O-N 3.16Å; L38-R40 PolarHBondContact O-N 2.97Å
41	R	71.3	Confident	77.7	Confident	83 Å²	83	85.8 Å²	85.8	31%	0.313	42%	0.421	S	S	.	.			trans	-76.1	125	175.5	-179	-179.6	173.5	169.8	-1.7	108.7	A16 E37 L38 E43 K341	A16-R41 HydrophobicContact CB-CG 4.48Å; A16-R41 VanDerWaalsContact CB-CZ 3.45Å; A16-R41 VanDerWaalsContact CB-NH2 3.29Å; E37-R41 PolarHBondContact O-N 3Å; L38-R41 VanDerWaalsContact O-CB 3.25Å; L38-R41 WeakPolarHBondContact O-CB 3.33Å; L38-R41 PolarHBondContact O-N 3.49Å; R41-E43 HydrophobicContact CG-CG 4.34Å; R41-E43 IonicContact CZ-OE1 3.86Å; R41-E43 IonicContact NE-OE1 3.14Å; R41-E43 PolarHBondContact NE-OE1 3.48Å; R41-E43 IonicContact NH1-OE1 3.85Å; R41-E43 IonicContact NH2-OE1 2.68Å; R41-E43 PolarHBondContact NH2-OE1 3.28Å; R41-K341 VanDerWaalsContact NH2-NZ 3.17Å
42	I	76.9	Confident	78.4	Confident	37 Å²	37	82 Å²	82	19%	0.19	41%	0.409	C	S	.	.			trans	-104	124.6	171.7	-62.3	152.3	0	0	0	106.1	M1 L44 L363	M1-I42 HydrophobicContact CB-CD1 4.44Å; M1-I42 HydrophobicContact SD-CD1 4.28Å; I42-L44 HydrophobicContact CG2-CD2 4.17Å; I42-L363 HydrophobicContact CD1-CD1 3.81Å; I42-L363 HydrophobicContact CD1-CD2 4.3Å; I42-L363 HydrophobicContact CD1-CG 4.47Å; I42-L363 HydrophobicContact CG1-CD1 4.06Å; I42-L363 HydrophobicContact CG2-CD1 3.97Å
43	E	81.9	Confident	79.7	Confident	105 Å²	105	77.1 Å²	77.1	49%	0.491	39%	0.391	S	S	.	.			trans	-108.7	116.3	167.4	-68.6	-173.4	159.4	0	0	107.1	R41	R41-E43 HydrophobicContact CG-CG 4.34Å; R41-E43 IonicContact CZ-OE1 3.86Å; R41-E43 IonicContact NE-OE1 3.14Å; R41-E43 PolarHBondContact NE-OE1 3.48Å; R41-E43 IonicContact NH1-OE1 3.85Å; R41-E43 IonicContact NH2-OE1 2.68Å; R41-E43 PolarHBondContact NH2-OE1 3.28Å
44	L	87	Confident	81	Confident	18 Å²	18	69.6 Å²	69.6	9%	0.094	36%	0.358	C	S	.	.	S	Bend	trans	-72.4	-52	179.6	-62.6	173.1	0	0	0	111	L14 I42 L84 L332 C357 L360	L14-L44 HydrophobicContact CB-CD1 4.47Å; L14-L44 HydrophobicContact CD1-CD1 3.79Å; I42-L44 HydrophobicContact CG2-CD2 4.17Å; L44-L84 WeakPolarHBondContact O-CD2 3.35Å; L44-L332 HydrophobicContact CD1-CD1 4.18Å; L44-C357 WeakPolarHBondContact CD2-SG 3.45Å; L44-L360 HydrophobicContact CD1-CD1 4.03Å; L44-L360 HydrophobicContact CD2-CD1 3.52Å; L44-L360 HydrophobicContact CD2-CG 4.44Å; L44-L360 HydrophobicContact CG-CD1 4.39Å
45	I	91.3	Very high	82.3	Confident	6 Å²	6	65.9 Å²	65.9	3%	0.031	33%	0.331	C	S	.	.	S	Bend	trans	-116.8	127.7	178.6	-61.7	165.4	0	0	0	106.4	E47 L48 L66 Y79 L81 M334 W356	I45-E47 PolarHBondContact O-N 2.97Å; I45-L48 HydrophobicContact CB-CB 4.08Å; I45-L48 HydrophobicContact CB-CD1 4.28Å; I45-L48 HydrophobicContact CB-CD2 4.45Å; I45-L48 HydrophobicContact CB-CG 4.49Å; I45-L48 HydrophobicContact CD1-CD1 4.11Å; I45-L48 HydrophobicContact CD1-CD2 4.31Å; I45-L48 HydrophobicContact CG2-CB 4.22Å; I45-L48 HydrophobicContact CG2-CD1 4.08Å; I45-L66 HydrophobicContact CD1-CD2 4.06Å; I45-Y79 HydrophobicContact CG2-CD1 3.59Å; I45-Y79 HydrophobicContact CG2-CE1 4.22Å; I45-Y79 HydrophobicContact CG2-CG 4.14Å; I45-L81 HydrophobicContact CD1-CD2 3.48Å; I45-L81 VanDerWaalsContact CD1-CD2 3.48Å; I45-L81 HydrophobicContact CG1-CD2 4.32Å; I45-M334 HydrophobicContact CD1-CE 3.78Å; I45-W356 HydrophobicContact CD1-CH2 4.32Å; I45-W356 HydrophobicContact CD1-CZ3 4.43Å; I45-W356 HydrophobicContact CG1-CZ3 4.3Å
46	Q	89.6	Confident	83.6	Confident	106 Å²	106	64.9 Å²	64.9	50%	0.495	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	131.7	177.3	-178.5	176.7	-9.1	0	0	109.8	L48 L84	Q46-L48 PolarHBondContact O-N 3.5Å; Q46-L84 PolarHBondContact N-O 2.99Å
47	E	88.5	Confident	84.8	Confident	106 Å²	106	60.1 Å²	60.1	50%	0.495	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	37.4	174.2	-65.8	166.5	-154.6	0	0	113.7	I45 E49 Y79	I45-E47 PolarHBondContact O-N 2.97Å; E47-E49 PolarHBondContact O-N 3.41Å; E47-Y79 PolarHBondContact O-OH 3.47Å; E47-Y79 VanDerWaalsContact O-OH 3.12Å
48	L	92.1	Very high	86.2	Confident	21 Å²	21	55.5 Å²	55.5	11%	0.11	27%	0.274	C	S	.	.			trans	-71.3	62.1	172.3	-166.9	73.4	0	0	0	111.7	I45 Q46 L66 Y79 M334 I342 T344	I45-L48 HydrophobicContact CB-CB 4.08Å; I45-L48 HydrophobicContact CB-CD1 4.28Å; I45-L48 HydrophobicContact CB-CD2 4.45Å; I45-L48 HydrophobicContact CB-CG 4.49Å; I45-L48 HydrophobicContact CD1-CD1 4.11Å; I45-L48 HydrophobicContact CD1-CD2 4.31Å; I45-L48 HydrophobicContact CG2-CB 4.22Å; I45-L48 HydrophobicContact CG2-CD1 4.08Å; Q46-L48 PolarHBondContact O-N 3.5Å; L48-L66 HydrophobicContact CD1-CD2 3.82Å; L48-Y79 HydrophobicContact CD1-CD1 4.32Å; L48-Y79 HydrophobicContact CD1-CD2 3.99Å; L48-Y79 HydrophobicContact CD1-CE1 4.16Å; L48-Y79 HydrophobicContact CD1-CE2 3.81Å; L48-Y79 HydrophobicContact CD1-CG 4.24Å; L48-M334 HydrophobicContact CD2-CE 3.8Å; L48-M334 HydrophobicContact CD2-SD 4.48Å; L48-I342 HydrophobicContact CD1-CD1 3.79Å; L48-I342 HydrophobicContact CD2-CB 3.99Å; L48-I342 HydrophobicContact CD2-CD1 4.49Å; L48-I342 HydrophobicContact CD2-CG2 4.14Å; L48-I342 HydrophobicContact CG-CB 4Å; L48-I342 HydrophobicContact CG-CD1 3.8Å; L48-I342 HydrophobicContact CG-CG1 4.38Å; L48-I342 PolarHBondContact O-N 2.97Å; L48-T344 HydrophobicContact CD2-CG2 3.88Å
49	E	91.2	Very high	87.7	Confident	78 Å²	78	53 Å²	53	36%	0.364	26%	0.261	S	S	.	.	B	Isolated β-bridge	trans	-144	153.2	-178.9	65.4	-176.5	-170.8	0	0	111.8	E47 K77 P340 K341	E47-E49 PolarHBondContact O-N 3.41Å; E49-K77 PolarHBondContact O-NZ 3.25Å; E49-P340 CarbonylContact C-O 3.55Å; E49-P340 WeakPolarHBondContact CA-O 3.35Å; E49-P340 WeakPolarHBondContact CB-O 3.27Å; E49-K341 HydrophobicContact CB-CG 4.17Å; E49-K341 VanDerWaalsContact OE2-CE 3.31Å; E49-K341 WeakPolarHBondContact OE2-CE 3.42Å
50	M	91.8	Very high	89.2	Confident	2 Å²	2	48 Å²	48	1%	0.01	23%	0.226	C	C	.	.			trans	-108.1	153.5	169.1	-72.1	-60	171.7	0	0	109.6	D52 T54 A68 R75 K77 P340	M50-D52 PolarHBondContact O-N 3.46Å; M50-T54 HydrophobicContact CB-CG2 3.81Å; M50-T54 HydrophobicContact CG-CG2 3.2Å; M50-A68 HydrophobicContact CE-CB 3.36Å; M50-A68 VanDerWaalsContact CE-O 3.24Å; M50-A68 WeakPolarHBondContact CE-O 3.45Å; M50-R75 HydrophobicContact SD-CG 4.23Å; M50-K77 HydrophobicContact CE-CB 3.71Å; M50-K77 HydrophobicContact CE-CD 3.63Å; M50-K77 HydrophobicContact CE-CG 3.66Å; M50-K77 HydrophobicContact SD-CD 3.69Å; M50-K77 HydrophobicContact SD-CG 4.06Å; M50-P340 PolarHBondContact N-O 3.24Å; M50-P340 VanDerWaalsContact O-CA 3.23Å; M50-P340 WeakPolarHBondContact O-CA 3.43Å; M50-P340 WeakPolarHBondContact O-CB 3.42Å
51	P	91	Very high	90.5	Very high	68 Å²	68	42.2 Å²	42.2	44%	0.442	21%	0.212	S	C	.	.	S	Bend	trans	-60.7	-29.7	179.4	22.1	-33.9	0	0	0	114	Y72	P51-Y72 HydrophobicContact CB-CD1 3.95Å; P51-Y72 HydrophobicContact CG-CD1 3.95Å; P51-Y72 HydrophobicContact CG-CG 4.49Å
52	D	91.2	Very high	91.5	Very high	81 Å²	81	40.3 Å²	40.3	43%	0.433	21%	0.208	S	C	.	.	S	Bend	trans	-128	-72.5	-177.3	172.4	53.5	0	0	0	110.9	M50 S339 P340	M50-D52 PolarHBondContact O-N 3.46Å; D52-S339 CarbonylContact O-C 3.6Å; D52-S339 VanDerWaalsContact O-C 3.29Å; D52-P340 VanDerWaalsContact O-CA 3.26Å; D52-P340 WeakPolarHBondContact O-CA 3.23Å
53	S	93.5	Very high	92.3	Very high	4 Å²	4	39.2 Å²	39.2	3%	0.028	21%	0.207	C	C	.	.			trans	-150.2	160	-175.8	54.6	0	0	0	0	111.6	G70 R71	S53-G70 WeakPolarHBondContact O-CA 3.42Å; S53-R71 PolarHBondContact O-N 3.48Å; S53-R71 WeakPolarHBondContact OG-CD 3.42Å; S53-R71 VanDerWaalsContact OG-CG 3.29Å; S53-R71 WeakPolarHBondContact OG-CG 3.45Å
54	T	94.6	Very high	92.9	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	126.7	179	45.4	0	0	0	0	109.9	M50 L69 N322 A336 S337 I342	M50-T54 HydrophobicContact CB-CG2 3.81Å; M50-T54 HydrophobicContact CG-CG2 3.2Å; T54-L69 WeakPolarHBondContact CA-O 3.46Å; T54-N322 PolarHBondContact O-ND2 3.12Å; T54-A336 WeakPolarHBondContact OG1-CA 3.27Å; T54-S337 PolarHBondContact N-O 3.23Å; T54-S337 VanDerWaalsContact N-O 3.08Å; T54-S337 PolarHBondContact OG1-N 2.94Å; T54-S337 PolarHBondContact OG1-O 3.24Å; T54-S337 VanDerWaalsContact OG1-O 3.04Å; T54-I342 HydrophobicContact CG2-CD1 4.05Å; T54-I342 HydrophobicContact CG2-CG1 3.64Å
55	T	94.5	Very high	93.3	Very high	18 Å²	18	37.9 Å²	37.9	11%	0.11	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	-48.9	-179.1	47.7	0	0	0	0	112.2	L69 R71 M95 P96 N322	T55-L69 PolarHBondContact N-O 3.16Å; T55-L69 WeakPolarHBondContact OG1-CB 3.35Å; T55-L69 PolarHBondContact OG1-O 3.24Å; T55-R71 HydrophobicContact CG2-CG 3.67Å; T55-M95 HydrophobicContact CG2-CE 3.46Å; T55-M95 VanDerWaalsContact CG2-CE 3.46Å; T55-P96 PolarHBondContact OG1-O 3.48Å; T55-N322 VanDerWaalsContact O-CB 3.27Å; T55-N322 WeakPolarHBondContact O-CB 3.36Å
56	Y	96.4	Very high	93.6	Very high	52 Å²	52	37.6 Å²	37.6	20%	0.204	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	148.4	-173.3	-165.1	-102.6	0	0	0	111.3	T58 L69 Y97 K98 I99 S323	Y56-T58 HydrophobicContact CE1-CG2 4.45Å; Y56-L69 PolarHBondContact O-N 2.97Å; Y56-Y97 WeakPolarHBondContact CB-O 3.09Å; Y56-K98 HydrophobicContact CD1-CD 4.35Å; Y56-K98 HydrophobicContact CD2-CD 4.21Å; Y56-K98 HydrophobicContact CE1-CD 3.87Å; Y56-K98 HydrophobicContact CE2-CD 3.73Å; Y56-K98 VanDerWaalsContact CZ-CE 3.44Å; Y56-K98 WeakPolarHBondContact OH-CE 3.32Å; Y56-K98 PolarHBondContact OH-NZ 3.29Å; Y56-I99 HydrophobicContact CD1-CG2 3.73Å; Y56-I99 HydrophobicContact CE1-CG2 4.18Å; Y56-S323 WeakPolarHBondContact CD2-OG 3.48Å; Y56-S323 WeakPolarHBondContact CE2-OG 3.44Å
57	L	96.3	Very high	94	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	139.9	176.4	-68.1	168.1	0	0	0	109.3	F67 A68 M334 A336 I342	L57-F67 WeakPolarHBondContact CA-O 3.22Å; L57-A68 HydrophobicContact CD2-CB 3.53Å; L57-M334 HydrophobicContact CD1-CB 3.99Å; L57-A336 HydrophobicContact CD1-CB 3.87Å; L57-A336 VanDerWaalsContact CD1-N 3.33Å; L57-A336 HydrophobicContact CG-CB 3.91Å; L57-I342 HydrophobicContact CD1-CG2 3.67Å; L57-I342 HydrophobicContact CD2-CD1 3.68Å; L57-I342 HydrophobicContact CD2-CG1 4.36Å
58	T	96	Very high	94.4	Very high	22 Å²	22	27.5 Å²	27.5	14%	0.135	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	154.2	170.7	-170.4	0	0	0	0	109.2	Y56 F67 I99	Y56-T58 HydrophobicContact CE1-CG2 4.45Å; T58-F67 HydrophobicContact CG2-CB 3.9Å; T58-F67 HydrophobicContact CG2-CD2 4.31Å; T58-F67 PolarHBondContact N-O 3.04Å; T58-F67 VanDerWaalsContact N-O 3.16Å; T58-F67 PolarHBondContact O-N 3.45Å; T58-I99 HydrophobicContact CG2-CB 4.42Å; T58-I99 HydrophobicContact CG2-CG1 4.39Å; T58-I99 HydrophobicContact CG2-CG2 3.42Å; T58-I99 VanDerWaalsContact CG2-CG2 3.42Å
59	C	95.6	Very high	94.6	Very high	9 Å²	9	26.5 Å²	26.5	6%	0.061	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	161.3	165.4	-66.3	0	0	0	0	111	Y65 L66 Y325 F327	C59-Y65 CarbonylContact C-O 3.56Å; C59-Y65 WeakPolarHBondContact CA-O 3.46Å; C59-Y65 VanDerWaalsContact CB-O 3.31Å; C59-Y65 WeakPolarHBondContact CB-O 3.45Å; C59-L66 WeakPolarHBondContact SG-CD1 3.37Å; C59-Y325 HydrophobicContact CB-CE1 4Å; C59-Y325 HydrophobicContact CB-CE2 4.24Å; C59-Y325 VanDerWaalsContact CB-OH 3.26Å; C59-Y325 WeakPolarHBondContact CB-OH 3.49Å; C59-Y325 WeakPolarHBondContact SG-CE1 3.48Å; C59-Y325 VanDerWaalsContact SG-CZ 3.55Å; C59-F327 WeakPolarHBondContact SG-CE1 3.48Å
60	S	95.7	Very high	94.8	Very high	4 Å²	4	22.8 Å²	22.8	3%	0.028	13%	0.128	C	C	.	.			trans	-62.8	151.7	164.4	52.1	0	0	0	0	111.3	D62 G63 Y65 D104	S60-D62 VanDerWaalsContact CB-OD1 3.24Å; S60-D62 WeakPolarHBondContact CB-OD1 3.27Å; S60-D62 PolarHBondContact O-N 3.09Å; S60-D62 PolarHBondContact OG-OD1 3.07Å; S60-G63 PolarHBondContact O-N 3.42Å; S60-Y65 PolarHBondContact N-O 2.89Å; S60-Y65 WeakPolarHBondContact OG-CA 3.4Å; S60-Y65 WeakPolarHBondContact OG-CB 3.29Å; S60-Y65 PolarHBondContact OG-N 3.46Å; S60-Y65 PolarHBondContact OG-O 3.19Å; S60-D104 WeakPolarHBondContact CB-O 3.47Å
61	P	93.8	Very high	94.9	Very high	65 Å²	65	27.4 Å²	27.4	42%	0.422	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-30.6	178.7	-27.6	34.6	0	0	0	114.7	G63 D104	P61-G63 PolarHBondContact O-N 3.13Å; P61-D104 WeakPolarHBondContact CD-O 3.16Å
62	D	93.3	Very high	95	Very high	43 Å²	43	30.6 Å²	30.6	23%	0.23	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-10.9	175	67.3	1.7	0	0	0	114.2	S60 Q64 D104 N105	S60-D62 VanDerWaalsContact CB-OD1 3.24Å; S60-D62 WeakPolarHBondContact CB-OD1 3.27Å; S60-D62 PolarHBondContact O-N 3.09Å; S60-D62 PolarHBondContact OG-OD1 3.07Å; D62-Q64 HydrophobicContact CB-CG 4.33Å; D62-Q64 PolarHBondContact O-N 3.38Å; D62-Q64 PolarHBondContact OD1-N 3.1Å; D62-D104 WeakPolarHBondContact CB-O 3.41Å; D62-D104 PolarHBondContact N-O 3.47Å; D62-D104 VanDerWaalsContact N-O 3.17Å; D62-N105 PolarHBondContact OD2-OD1 2.9Å; D62-N105 VanDerWaalsContact OD2-OD1 3.13Å
63	G	92.9	Very high	95.2	Very high	15 Å²	15	32.9 Å²	32.9	16%	0.155	16%	0.156	C	C	.	.	S	Bend	trans	68.6	15.7	-177.1	0	0	0	0	0	114.8	S60 P61 L81	S60-G63 PolarHBondContact O-N 3.42Å; P61-G63 PolarHBondContact O-N 3.13Å; G63-L81 VanDerWaalsContact O-CD1 3.31Å; G63-L81 WeakPolarHBondContact O-CD1 3.43Å
64	Q	93.9	Very high	95.3	Very high	77 Å²	77	34 Å²	34	36%	0.36	16%	0.163	S	C	.	.	S	Bend	trans	-98.2	-23.2	-178.9	-61.6	-173	-1	0	0	113.7	D62 L81 F355	D62-Q64 HydrophobicContact CB-CG 4.33Å; D62-Q64 PolarHBondContact O-N 3.38Å; D62-Q64 PolarHBondContact OD1-N 3.1Å; Q64-L81 WeakPolarHBondContact O-CB 3.38Å; Q64-L81 WeakPolarHBondContact O-CG 3.27Å; Q64-L81 PolarHBondContact O-N 2.95Å; Q64-F355 HydrophobicContact CG-CZ 4.25Å
65	Y	96.9	Very high	95.3	Very high	18 Å²	18	35.6 Å²	35.6	7%	0.071	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	129.3	-177	-55.9	-80	0	0	0	111.2	C59 S60 Y79 E80 K87 N105 Y106	C59-Y65 CarbonylContact C-O 3.56Å; C59-Y65 WeakPolarHBondContact CA-O 3.46Å; C59-Y65 VanDerWaalsContact CB-O 3.31Å; C59-Y65 WeakPolarHBondContact CB-O 3.45Å; S60-Y65 PolarHBondContact N-O 2.89Å; S60-Y65 WeakPolarHBondContact OG-CA 3.4Å; S60-Y65 WeakPolarHBondContact OG-CB 3.29Å; S60-Y65 PolarHBondContact OG-N 3.46Å; S60-Y65 PolarHBondContact OG-O 3.19Å; Y65-Y79 CarbonylContact C-O 3.55Å; Y65-Y79 VanDerWaalsContact CA-O 3.29Å; Y65-Y79 WeakPolarHBondContact CA-O 3.22Å; Y65-E80 HydrophobicContact CD1-CB 4.25Å; Y65-E80 HydrophobicContact CD1-CG 4.42Å; Y65-E80 HydrophobicContact CE1-CB 4.12Å; Y65-E80 HydrophobicContact CE1-CG 3.89Å; Y65-E80 WeakPolarHBondContact CE1-OE1 3.41Å; Y65-E80 PolarHBondContact OH-OE1 3.13Å; Y65-K87 HydrophobicContact CD1-CD 4.12Å; Y65-K87 HydrophobicContact CE1-CD 3.72Å; Y65-K87 PolarHBondContact OH-NZ 2.78Å; Y65-N105 HydrophobicContact CD2-CB 4.48Å; Y65-N105 HydrophobicContact CE2-CB 4.13Å; Y65-Y106 AromaticContact CD1-CD1 3.8Å; Y65-Y106 HydrophobicContact CD1-CD1 3.8Å; Y65-Y106 HydrophobicContact CD1-CG 4.25Å; Y65-Y106 AromaticContact CD2-CD1 4Å; Y65-Y106 HydrophobicContact CD2-CD1 4Å; Y65-Y106 AromaticContact CE1-CD1 3.44Å; Y65-Y106 HydrophobicContact CE1-CD1 3.44Å; Y65-Y106 VanDerWaalsContact CE1-CD1 3.44Å; Y65-Y106 AromaticContact CE1-CE1 3.91Å; Y65-Y106 HydrophobicContact CE1-CE1 3.91Å; Y65-Y106 HydrophobicContact CE1-CG 4.29Å; Y65-Y106 AromaticContact CE2-CD1 3.66Å; Y65-Y106 HydrophobicContact CE2-CD1 3.66Å; Y65-Y106 HydrophobicContact CE2-CE1 4.37Å; Y65-Y106 HydrophobicContact CG-CD1 4.06Å; Y65-Y106 HydrophobicContact CG-CG 4.4Å; Y65-Y106 AromaticContact CZ-CD1 3.34Å; Y65-Y106 AromaticContact CZ-CE1 3.73Å
66	L	97	Very high	95.4	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	127.4	173.8	172.5	72.4	0	0	0	109.3	I45 L48 C59 C78 Y79 L81 M334	I45-L66 HydrophobicContact CD1-CD2 4.06Å; L48-L66 HydrophobicContact CD1-CD2 3.82Å; C59-L66 WeakPolarHBondContact SG-CD1 3.37Å; L66-C78 CarbonylContact O-C 3.55Å; L66-C78 WeakPolarHBondContact O-CA 3.46Å; L66-Y79 HydrophobicContact CD2-CD2 4.39Å; L66-Y79 PolarHBondContact N-O 2.7Å; L66-Y79 PolarHBondContact O-N 3.04Å; L66-L81 HydrophobicContact CB-CD1 4.3Å; L66-L81 HydrophobicContact CB-CD2 3.94Å; L66-L81 HydrophobicContact CB-CG 4.25Å; L66-M334 HydrophobicContact CD1-SD 4.19Å; L66-M334 HydrophobicContact CD2-CE 4.01Å; L66-M334 HydrophobicContact CD2-SD 3.58Å; L66-M334 VanDerWaalsContact CD2-SD 3.58Å
67	F	97.3	Very high	95.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	136.6	173.4	-68.5	-82.9	0	0	0	110.9	L57 T58 V76 K77 C78 F88 I99 C101 F109	L57-F67 WeakPolarHBondContact CA-O 3.22Å; T58-F67 HydrophobicContact CG2-CB 3.9Å; T58-F67 HydrophobicContact CG2-CD2 4.31Å; T58-F67 PolarHBondContact N-O 3.04Å; T58-F67 VanDerWaalsContact N-O 3.16Å; T58-F67 PolarHBondContact O-N 3.45Å; F67-V76 HydrophobicContact CD1-CG1 4.01Å; F67-K77 WeakPolarHBondContact CA-O 3.38Å; F67-C78 HydrophobicContact CD1-CB 3.93Å; F67-C78 HydrophobicContact CE1-CB 3.8Å; F67-F88 HydrophobicContact CE1-CZ 4.16Å; F67-I99 HydrophobicContact CB-CD1 3.83Å; F67-I99 HydrophobicContact CD1-CD1 3.65Å; F67-I99 HydrophobicContact CD2-CD1 4.27Å; F67-I99 HydrophobicContact CE1-CD1 4.2Å; F67-I99 HydrophobicContact CG-CD1 3.66Å; F67-C101 VanDerWaalsContact CE2-SG 3.56Å; F67-F109 AromaticContact CE1-CD1 3.93Å; F67-F109 HydrophobicContact CE1-CD1 3.93Å; F67-F109 AromaticContact CE1-CE1 3.95Å; F67-F109 HydrophobicContact CE1-CE1 3.95Å; F67-F109 HydrophobicContact CE1-CG 4.35Å; F67-F109 HydrophobicContact CE1-CZ 4.36Å; F67-F109 AromaticContact CZ-CD1 3.94Å; F67-F109 HydrophobicContact CZ-CD1 3.94Å; F67-F109 HydrophobicContact CZ-CE1 4.34Å; F67-F109 HydrophobicContact CZ-CG 4.39Å
68	A	96.9	Very high	95.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	130.4	174.1	0	0	0	0	0	110.4	M50 L57 K77 Y79 I342	M50-A68 HydrophobicContact CE-CB 3.36Å; M50-A68 VanDerWaalsContact CE-O 3.24Å; M50-A68 WeakPolarHBondContact CE-O 3.45Å; L57-A68 HydrophobicContact CD2-CB 3.53Å; A68-K77 PolarHBondContact N-O 3.26Å; A68-K77 PolarHBondContact O-N 2.92Å; A68-Y79 HydrophobicContact CB-CE2 4.09Å; A68-I342 HydrophobicContact CB-CD1 3.96Å
69	L	97.2	Very high	95.5	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	135.3	176.2	-60.8	-171.1	0	0	0	110.5	T54 T55 Y56 V76 P96 I99 L111	T54-L69 WeakPolarHBondContact CA-O 3.46Å; T55-L69 PolarHBondContact N-O 3.16Å; T55-L69 WeakPolarHBondContact OG1-CB 3.35Å; T55-L69 PolarHBondContact OG1-O 3.24Å; Y56-L69 PolarHBondContact O-N 2.97Å; L69-V76 HydrophobicContact CD2-CB 4.16Å; L69-V76 HydrophobicContact CD2-CG1 3.99Å; L69-V76 HydrophobicContact CD2-CG2 3.53Å; L69-P96 HydrophobicContact CB-CG 4.28Å; L69-P96 HydrophobicContact CD1-CB 3.93Å; L69-P96 HydrophobicContact CD1-CG 4.24Å; L69-P96 HydrophobicContact CD2-CB 4.17Å; L69-P96 HydrophobicContact CD2-CG 4.01Å; L69-P96 HydrophobicContact CG-CG 4.42Å; L69-I99 HydrophobicContact CD1-CB 4.28Å; L69-I99 HydrophobicContact CD1-CG2 3.98Å; L69-I99 HydrophobicContact CD2-CB 4.4Å; L69-I99 HydrophobicContact CD2-CG2 4.26Å; L69-I99 HydrophobicContact CG-CG2 4.04Å; L69-L111 HydrophobicContact CD2-CD2 4.13Å
70	G	95.1	Very high	95.5	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	148.9	-177.4	0	0	0	0	0	114	S53 R75 M95	S53-G70 WeakPolarHBondContact O-CA 3.42Å; G70-R75 PolarHBondContact N-O 2.69Å; G70-R75 PolarHBondContact O-N 2.95Å; G70-M95 WeakPolarHBondContact O-CE 3.4Å
71	R	93.5	Very high	95.5	Very high	99 Å²	99	33 Å²	33	37%	0.374	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-51.4	-177.4	-65.3	-166.4	-177.1	154.5	0.3	115.3	S53 T55 K73 M95 E338	S53-R71 PolarHBondContact O-N 3.48Å; S53-R71 WeakPolarHBondContact OG-CD 3.42Å; S53-R71 VanDerWaalsContact OG-CG 3.29Å; S53-R71 WeakPolarHBondContact OG-CG 3.45Å; T55-R71 HydrophobicContact CG2-CG 3.67Å; R71-K73 PolarHBondContact O-N 2.89Å; R71-M95 VanDerWaalsContact CA-SD 3.53Å; R71-M95 HydrophobicContact CB-CE 4.06Å; R71-M95 HydrophobicContact CB-SD 4.12Å; R71-M95 HydrophobicContact CG-CE 3.53Å; R71-M95 HydrophobicContact CG-SD 4.1Å; R71-E338 IonicContact CZ-OE1 2.71Å; R71-E338 IonicContact NH1-OE1 2.83Å; R71-E338 PolarHBondContact NH1-OE1 3.17Å; R71-E338 IonicContact NH2-OE1 3.7Å; R71-E338 PolarHBondContact NH2-OE1 3.03Å
72	Y	93.9	Very high	95.5	Very high	135 Å²	135	33.1 Å²	33.1	53%	0.529	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	120.4	-172.9	175.5	-95.1	0	0	0	113	P51 R75	P51-Y72 HydrophobicContact CB-CD1 3.95Å; P51-Y72 HydrophobicContact CG-CD1 3.95Å; P51-Y72 HydrophobicContact CG-CG 4.49Å; Y72-R75 PolarHBondContact O-NE 3.36Å; Y72-R75 VanDerWaalsContact O-NE 3.15Å; Y72-R75 PolarHBondContact O-NH2 3.12Å; Y72-R75 VanDerWaalsContact O-NH2 3.08Å
73	K	94.7	Very high	95.5	Very high	129 Å²	129	35.8 Å²	35.8	56%	0.561	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.4	86.4	-159.3	-69.1	-177	171.8	-173	0	107.5	R71 R75	R71-K73 PolarHBondContact O-N 2.89Å; K73-R75 WeakPolarHBondContact O-CB 3.47Å; K73-R75 PolarHBondContact O-N 3.33Å; K73-R75 VanDerWaalsContact O-N 3.15Å; K73-R75 PolarHBondContact O-NE 3.18Å
74	P	95.5	Very high	95.5	Very high	28 Å²	28	38.2 Å²	38.2	18%	0.182	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-36.7	122.4	-171.6	-36	37.7	0	0	0	111.1	C91 L92 C94 M95	P74-C91 CarbonylContact O-C 3.55Å; P74-C91 VanDerWaalsContact O-CA 3.29Å; P74-C91 WeakPolarHBondContact O-CA 3.42Å; P74-L92 HydrophobicContact CB-CB 4.17Å; P74-L92 PolarHBondContact O-N 2.87Å; P74-C94 VanDerWaalsContact CB-O 3.25Å; P74-C94 WeakPolarHBondContact CB-O 3.4Å; P74-M95 HydrophobicContact CB-SD 4.38Å; P74-M95 HydrophobicContact CG-CB 4.42Å; P74-M95 HydrophobicContact CG-SD 4.26Å
75	R	95.1	Very high	95.5	Very high	32 Å²	32	36.3 Å²	36.3	12%	0.121	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	155.7	-171.4	68.1	-177.2	70.7	-159.9	9.9	113.3	M50 G70 Y72 K73 D89 R90	M50-R75 HydrophobicContact SD-CG 4.23Å; G70-R75 PolarHBondContact N-O 2.69Å; G70-R75 PolarHBondContact O-N 2.95Å; Y72-R75 PolarHBondContact O-NE 3.36Å; Y72-R75 VanDerWaalsContact O-NE 3.15Å; Y72-R75 PolarHBondContact O-NH2 3.12Å; Y72-R75 VanDerWaalsContact O-NH2 3.08Å; K73-R75 WeakPolarHBondContact O-CB 3.47Å; K73-R75 PolarHBondContact O-N 3.33Å; K73-R75 VanDerWaalsContact O-N 3.15Å; K73-R75 PolarHBondContact O-NE 3.18Å; R75-D89 WeakPolarHBondContact CD-OD1 3.4Å; R75-D89 IonicContact CZ-OD2 3.93Å; R75-D89 IonicContact NH1-OD2 2.91Å; R75-D89 PolarHBondContact NH1-OD2 2.99Å; R75-R90 CarbonylContact C-O 3.6Å; R75-R90 WeakPolarHBondContact CA-O 3.22Å; R75-R90 VanDerWaalsContact CB-O 3.23Å; R75-R90 WeakPolarHBondContact CB-O 3.46Å
76	V	96.3	Very high	95.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	118.6	171.2	-173.7	0	0	0	0	108.2	F67 L69 R90 L92 I99 F109 L111	F67-V76 HydrophobicContact CD1-CG1 4.01Å; L69-V76 HydrophobicContact CD2-CB 4.16Å; L69-V76 HydrophobicContact CD2-CG1 3.99Å; L69-V76 HydrophobicContact CD2-CG2 3.53Å; V76-R90 PolarHBondContact N-O 3.16Å; V76-R90 PolarHBondContact O-N 2.8Å; V76-L92 HydrophobicContact CG2-CD1 3.8Å; V76-L92 HydrophobicContact CG2-CD2 4.46Å; V76-L92 HydrophobicContact CG2-CG 4.28Å; V76-I99 HydrophobicContact CG1-CD1 4.28Å; V76-F109 HydrophobicContact CG1-CE2 4.4Å; V76-L111 HydrophobicContact CG2-CD1 3.6Å; V76-L111 HydrophobicContact CG2-CD2 4.02Å; V76-L111 HydrophobicContact CG2-CG 4.49Å
77	K	96.7	Very high	95.3	Very high	19 Å²	19	41.3 Å²	41.3	8%	0.083	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	134.1	167.2	-66.2	-173.9	174.7	-175.1	0	109.3	E49 M50 F67 A68 Y79 M86 F88 D89	E49-K77 PolarHBondContact O-NZ 3.25Å; M50-K77 HydrophobicContact CE-CB 3.71Å; M50-K77 HydrophobicContact CE-CD 3.63Å; M50-K77 HydrophobicContact CE-CG 3.66Å; M50-K77 HydrophobicContact SD-CD 3.69Å; M50-K77 HydrophobicContact SD-CG 4.06Å; F67-K77 WeakPolarHBondContact CA-O 3.38Å; A68-K77 PolarHBondContact N-O 3.26Å; A68-K77 PolarHBondContact O-N 2.92Å; K77-Y79 HydrophobicContact CB-CE2 3.75Å; K77-Y79 HydrophobicContact CD-CE2 4.49Å; K77-Y79 VanDerWaalsContact CD-OH 3.26Å; K77-Y79 WeakPolarHBondContact CD-OH 3.36Å; K77-M86 HydrophobicContact CB-SD 4.49Å; K77-M86 HydrophobicContact CD-CE 3.63Å; K77-M86 HydrophobicContact CD-SD 3.91Å; K77-M86 HydrophobicContact CG-CE 4.47Å; K77-M86 HydrophobicContact CG-SD 4.1Å; K77-F88 WeakPolarHBondContact CA-O 3.38Å; K77-D89 WeakPolarHBondContact CE-OD2 3.45Å; K77-D89 HydrophobicContact CG-CB 4.17Å
78	C	96.8	Very high	95.3	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	128	169.5	-177.3	0	0	0	0	108.2	L66 F67 K87 F88	L66-C78 CarbonylContact O-C 3.55Å; L66-C78 WeakPolarHBondContact O-CA 3.46Å; F67-C78 HydrophobicContact CD1-CB 3.93Å; F67-C78 HydrophobicContact CE1-CB 3.8Å; C78-K87 WeakPolarHBondContact O-CB 3.22Å; C78-K87 PolarHBondContact O-N 2.66Å; C78-F88 HydrophobicContact CB-CD1 3.82Å; C78-F88 HydrophobicContact CB-CD2 4.17Å; C78-F88 HydrophobicContact CB-CE1 3.38Å; C78-F88 HydrophobicContact CB-CE2 3.79Å; C78-F88 HydrophobicContact CB-CG 4.21Å; C78-F88 HydrophobicContact CB-CZ 3.38Å; C78-F88 PolarHBondContact N-O 3.34Å; C78-F88 PolarHBondContact O-N 3.25Å
79	Y	97	Very high	95.2	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	136.7	175.4	-59	-91.7	0	0	0	109	I45 E47 L48 Y65 L66 A68 K77 S85 M86	I45-Y79 HydrophobicContact CG2-CD1 3.59Å; I45-Y79 HydrophobicContact CG2-CE1 4.22Å; I45-Y79 HydrophobicContact CG2-CG 4.14Å; E47-Y79 PolarHBondContact O-OH 3.47Å; E47-Y79 VanDerWaalsContact O-OH 3.12Å; L48-Y79 HydrophobicContact CD1-CD1 4.32Å; L48-Y79 HydrophobicContact CD1-CD2 3.99Å; L48-Y79 HydrophobicContact CD1-CE1 4.16Å; L48-Y79 HydrophobicContact CD1-CE2 3.81Å; L48-Y79 HydrophobicContact CD1-CG 4.24Å; Y65-Y79 CarbonylContact C-O 3.55Å; Y65-Y79 VanDerWaalsContact CA-O 3.29Å; Y65-Y79 WeakPolarHBondContact CA-O 3.22Å; L66-Y79 HydrophobicContact CD2-CD2 4.39Å; L66-Y79 PolarHBondContact N-O 2.7Å; L66-Y79 PolarHBondContact O-N 3.04Å; A68-Y79 HydrophobicContact CB-CE2 4.09Å; K77-Y79 HydrophobicContact CB-CE2 3.75Å; K77-Y79 HydrophobicContact CD-CE2 4.49Å; K77-Y79 VanDerWaalsContact CD-OH 3.26Å; K77-Y79 WeakPolarHBondContact CD-OH 3.36Å; Y79-S85 WeakPolarHBondContact CA-O 3.48Å; Y79-M86 HydrophobicContact CD1-CB 3.91Å; Y79-M86 HydrophobicContact CD1-CG 4.29Å; Y79-M86 HydrophobicContact CE1-CB 3.9Å; Y79-M86 HydrophobicContact CE1-CE 4.08Å; Y79-M86 HydrophobicContact CE1-CG 4.13Å
80	E	96.6	Very high	95.1	Very high	32 Å²	32	47.7 Å²	47.7	15%	0.15	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	113.5	172.9	-179.1	162.8	-123.6	0	0	108	Y65 S82 N83 L84 S85 K87	Y65-E80 HydrophobicContact CD1-CB 4.25Å; Y65-E80 HydrophobicContact CD1-CG 4.42Å; Y65-E80 HydrophobicContact CE1-CB 4.12Å; Y65-E80 HydrophobicContact CE1-CG 3.89Å; Y65-E80 WeakPolarHBondContact CE1-OE1 3.41Å; Y65-E80 PolarHBondContact OH-OE1 3.13Å; E80-S82 VanDerWaalsContact C-N 3.34Å; E80-S82 WeakPolarHBondContact CG-OG 3.25Å; E80-S82 PolarHBondContact O-N 3.12Å; E80-N83 HydrophobicContact CB-CB 4.41Å; E80-N83 VanDerWaalsContact CD-ND2 3.34Å; E80-N83 HydrophobicContact CG-CB 4.16Å; E80-N83 CarbonylContact O-C 3.6Å; E80-N83 PolarHBondContact O-N 3.06Å; E80-N83 PolarHBondContact OE2-ND2 2.91Å; E80-L84 PolarHBondContact O-N 3.06Å; E80-S85 PolarHBondContact N-O 3.01Å; E80-S85 PolarHBondContact O-N 3.01Å; E80-K87 HydrophobicContact CB-CB 4.33Å; E80-K87 HydrophobicContact CB-CD 4.39Å; E80-K87 IonicContact OE1-NZ 3.6Å; E80-K87 PolarHBondContact OE1-NZ 2.96Å; E80-K87 IonicContact OE2-NZ 2.89Å
81	L	95	Very high	95.1	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-30.2	-170.5	-63.4	172.2	0	0	0	111.8	I45 G63 Q64 L66 N83 L84 F327 W356	I45-L81 HydrophobicContact CD1-CD2 3.48Å; I45-L81 VanDerWaalsContact CD1-CD2 3.48Å; I45-L81 HydrophobicContact CG1-CD2 4.32Å; G63-L81 VanDerWaalsContact O-CD1 3.31Å; G63-L81 WeakPolarHBondContact O-CD1 3.43Å; Q64-L81 WeakPolarHBondContact O-CB 3.38Å; Q64-L81 WeakPolarHBondContact O-CG 3.27Å; Q64-L81 PolarHBondContact O-N 2.95Å; L66-L81 HydrophobicContact CB-CD1 4.3Å; L66-L81 HydrophobicContact CB-CD2 3.94Å; L66-L81 HydrophobicContact CB-CG 4.25Å; L81-N83 VanDerWaalsContact C-N 3.31Å; L81-N83 PolarHBondContact O-N 3.43Å; L81-L84 VanDerWaalsContact O-CD2 3.24Å; L81-L84 WeakPolarHBondContact O-CD2 3.2Å; L81-L84 PolarHBondContact O-N 3.31Å; L81-F327 HydrophobicContact CD1-CE1 3.8Å; L81-F327 HydrophobicContact CD1-CZ 4.38Å; L81-W356 HydrophobicContact CB-CB 4.31Å; L81-W356 HydrophobicContact CB-CD2 3.88Å; L81-W356 HydrophobicContact CB-CE3 4.45Å; L81-W356 HydrophobicContact CB-CG 3.78Å; L81-W356 HydrophobicContact CD1-CZ2 4.4Å; L81-W356 HydrophobicContact CD2-CD2 4.38Å; L81-W356 HydrophobicContact CD2-CH2 4.24Å; L81-W356 HydrophobicContact CD2-CZ2 4.05Å; L81-W356 HydrophobicContact CD2-CZ3 4.47Å; L81-W356 WeakPolarHBondContact O-CB 3.45Å
82	S	93.3	Very high	95.2	Very high	68 Å²	68	47.5 Å²	47.5	48%	0.476	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-36.3	172.8	53.9	0	0	0	0	112.8	E80	E80-S82 VanDerWaalsContact C-N 3.34Å; E80-S82 WeakPolarHBondContact CG-OG 3.25Å; E80-S82 PolarHBondContact O-N 3.12Å
83	N	93.4	Very high	95.1	Very high	100 Å²	100	48 Å²	48	54%	0.535	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	0.4	180	-71.3	-25.2	0	0	0	113.3	E80 L81 S85	E80-N83 HydrophobicContact CB-CB 4.41Å; E80-N83 VanDerWaalsContact CD-ND2 3.34Å; E80-N83 HydrophobicContact CG-CB 4.16Å; E80-N83 CarbonylContact O-C 3.6Å; E80-N83 PolarHBondContact O-N 3.06Å; E80-N83 PolarHBondContact OE2-ND2 2.91Å; L81-N83 VanDerWaalsContact C-N 3.31Å; L81-N83 PolarHBondContact O-N 3.43Å; N83-S85 WeakPolarHBondContact O-CB 3.38Å; N83-S85 PolarHBondContact O-N 2.8Å; N83-S85 PolarHBondContact O-OG 2.78Å
84	L	93.3	Very high	95.1	Very high	65 Å²	65	43.1 Å²	43.1	34%	0.34	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.1	31.4	-179.8	-56.3	174.8	0	0	0	114.1	L44 Q46 E80 L81 W356	L44-L84 WeakPolarHBondContact O-CD2 3.35Å; Q46-L84 PolarHBondContact N-O 2.99Å; E80-L84 PolarHBondContact O-N 3.06Å; L81-L84 VanDerWaalsContact O-CD2 3.24Å; L81-L84 WeakPolarHBondContact O-CD2 3.2Å; L81-L84 PolarHBondContact O-N 3.31Å; L84-W356 HydrophobicContact CD2-CE3 3.56Å; L84-W356 HydrophobicContact CD2-CZ3 3.99Å
85	S	94.3	Very high	95.1	Very high	37 Å²	37	42.7 Å²	42.7	26%	0.259	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	166.6	-171.8	53.2	0	0	0	0	112.1	Y79 E80 N83	Y79-S85 WeakPolarHBondContact CA-O 3.48Å; E80-S85 PolarHBondContact N-O 3.01Å; E80-S85 PolarHBondContact O-N 3.01Å; N83-S85 WeakPolarHBondContact O-CB 3.38Å; N83-S85 PolarHBondContact O-N 2.8Å; N83-S85 PolarHBondContact O-OG 2.78Å
86	M	95.1	Very high	95.1	Very high	56 Å²	56	41.2 Å²	41.2	28%	0.276	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	128.4	179	-167.3	-174.2	-45.5	0	0	110.7	K77 Y79 D89	K77-M86 HydrophobicContact CB-SD 4.49Å; K77-M86 HydrophobicContact CD-CE 3.63Å; K77-M86 HydrophobicContact CD-SD 3.91Å; K77-M86 HydrophobicContact CG-CE 4.47Å; K77-M86 HydrophobicContact CG-SD 4.1Å; Y79-M86 HydrophobicContact CD1-CB 3.91Å; Y79-M86 HydrophobicContact CD1-CG 4.29Å; Y79-M86 HydrophobicContact CE1-CB 3.9Å; Y79-M86 HydrophobicContact CE1-CE 4.08Å; Y79-M86 HydrophobicContact CE1-CG 4.13Å; M86-D89 HydrophobicContact SD-CB 3.84Å
87	K	95.4	Very high	94.9	Very high	67 Å²	67	45.9 Å²	45.9	29%	0.291	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-46.4	175.8	-169.1	164.9	-164.3	148.6	0	111.9	Y65 C78 E80 Y106	Y65-K87 HydrophobicContact CD1-CD 4.12Å; Y65-K87 HydrophobicContact CE1-CD 3.72Å; Y65-K87 PolarHBondContact OH-NZ 2.78Å; C78-K87 WeakPolarHBondContact O-CB 3.22Å; C78-K87 PolarHBondContact O-N 2.66Å; E80-K87 HydrophobicContact CB-CB 4.33Å; E80-K87 HydrophobicContact CB-CD 4.39Å; E80-K87 IonicContact OE1-NZ 3.6Å; E80-K87 PolarHBondContact OE1-NZ 2.96Å; E80-K87 IonicContact OE2-NZ 2.89Å; K87-Y106 HydrophobicContact CD-CD1 4.25Å; K87-Y106 HydrophobicContact CD-CE1 4.06Å; K87-Y106 HydrophobicContact CD-CE2 4.36Å; K87-Y106 HydrophobicContact CD-CG 4.48Å; K87-Y106 VanDerWaalsContact CE-CE1 3.41Å; K87-Y106 WeakPolarHBondContact CE-OH 3.36Å
88	F	95.5	Very high	94.9	Very high	35 Å²	35	46.9 Å²	46.9	15%	0.154	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	156.1	173.9	64.5	-100.6	0	0	0	111.8	F67 K77 C78 R90 Y106 F109	F67-F88 HydrophobicContact CE1-CZ 4.16Å; K77-F88 WeakPolarHBondContact CA-O 3.38Å; C78-F88 HydrophobicContact CB-CD1 3.82Å; C78-F88 HydrophobicContact CB-CD2 4.17Å; C78-F88 HydrophobicContact CB-CE1 3.38Å; C78-F88 HydrophobicContact CB-CE2 3.79Å; C78-F88 HydrophobicContact CB-CG 4.21Å; C78-F88 HydrophobicContact CB-CZ 3.38Å; C78-F88 PolarHBondContact N-O 3.34Å; C78-F88 PolarHBondContact O-N 3.25Å; F88-R90 HydrophobicContact CD2-CB 4.46Å; F88-R90 HydrophobicContact CD2-CG 3.69Å; F88-R90 HydrophobicContact CE2-CG 3.97Å; F88-Y106 AromaticContact CE1-CD2 3.83Å; F88-Y106 HydrophobicContact CE1-CD2 3.83Å; F88-Y106 HydrophobicContact CE1-CE2 4.41Å; F88-F109 HydrophobicContact CE2-CZ 4.38Å; F88-F109 AromaticContact CZ-CE1 3.96Å; F88-F109 HydrophobicContact CZ-CE1 3.96Å; F88-F109 HydrophobicContact CZ-CZ 4.12Å
89	D	95.4	Very high	94.9	Very high	62 Å²	62	47 Å²	47	33%	0.332	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	121.7	166.8	-170.8	3.6	0	0	0	108.1	R75 K77 M86	R75-D89 WeakPolarHBondContact CD-OD1 3.4Å; R75-D89 IonicContact CZ-OD2 3.93Å; R75-D89 IonicContact NH1-OD2 2.91Å; R75-D89 PolarHBondContact NH1-OD2 2.99Å; K77-D89 WeakPolarHBondContact CE-OD2 3.45Å; K77-D89 HydrophobicContact CG-CB 4.17Å; M86-D89 HydrophobicContact SD-CB 3.84Å
90	R	95.3	Very high	94.8	Very high	37 Å²	37	47.8 Å²	47.8	14%	0.14	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	126.8	176.7	-72.7	174.7	-169.7	-174.8	1.1	109.1	R75 V76 F88 H121 A122 A123 G125	R75-R90 CarbonylContact C-O 3.6Å; R75-R90 WeakPolarHBondContact CA-O 3.22Å; R75-R90 VanDerWaalsContact CB-O 3.23Å; R75-R90 WeakPolarHBondContact CB-O 3.46Å; V76-R90 PolarHBondContact N-O 3.16Å; V76-R90 PolarHBondContact O-N 2.8Å; F88-R90 HydrophobicContact CD2-CB 4.46Å; F88-R90 HydrophobicContact CD2-CG 3.69Å; F88-R90 HydrophobicContact CE2-CG 3.97Å; R90-H121 PolarHBondContact NH1-ND1 3.35Å; R90-A122 PolarHBondContact NH1-O 3.23Å; R90-A122 PolarHBondContact NH2-O 3.4Å; R90-A123 PolarHBondContact NH2-O 2.86Å; R90-G125 PolarHBondContact NH1-O 3.47Å
91	C	95.4	Very high	94.8	Very high	81 Å²	81	46.9 Å²	46.9	55%	0.547	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	146	167.1	-63.2	0	0	0	0	109.9	P74	P74-C91 CarbonylContact O-C 3.55Å; P74-C91 VanDerWaalsContact O-CA 3.29Å; P74-C91 WeakPolarHBondContact O-CA 3.42Å
92	L	94.6	Very high	94.9	Very high	14 Å²	14	48 Å²	48	7%	0.073	26%	0.256	C	S	.	.			trans	-117.8	163.3	177.6	-52.1	175	0	0	0	109.2	P74 V76 P96 L111	P74-L92 HydrophobicContact CB-CB 4.17Å; P74-L92 PolarHBondContact O-N 2.87Å; V76-L92 HydrophobicContact CG2-CD1 3.8Å; V76-L92 HydrophobicContact CG2-CD2 4.46Å; V76-L92 HydrophobicContact CG2-CG 4.28Å; L92-P96 HydrophobicContact CD1-CB 3.74Å; L92-P96 HydrophobicContact CD1-CG 3.6Å; L92-L111 HydrophobicContact CD1-CD1 3.52Å; L92-L111 HydrophobicContact CD2-CD1 3.84Å; L92-L111 HydrophobicContact CG-CD1 4.31Å
93	D	93.2	Very high	95	Very high	145 Å²	145	46.5 Å²	46.5	78%	0.775	25%	0.245	S	C	*	.	S	Bend	trans	-78.7	-40.4	177.2	-62.2	-33.1	0	0	0	111.9
94	C	93.7	Very high	95	Very high	27 Å²	27	46.4 Å²	46.4	18%	0.182	24%	0.244	C	C	.	.	S	Bend	trans	-115.4	157.6	-177.9	-61.7	0	0	0	0	111.1	P74 P96 E113	P74-C94 VanDerWaalsContact CB-O 3.25Å; P74-C94 WeakPolarHBondContact CB-O 3.4Å; C94-P96 WeakPolarHBondContact O-CD 3.21Å; C94-E113 HydrophobicContact CB-CB 4.01Å; C94-E113 WeakPolarHBondContact CB-OE2 3.42Å
95	M	95.3	Very high	95.1	Very high	20 Å²	20	46.6 Å²	46.6	10%	0.099	25%	0.245	C	C	.	.			trans	-69.6	124.9	-177.3	-175.6	62.5	-148.3	0	0	111.9	T55 G70 R71 P74 Y97 E113 E114	T55-M95 HydrophobicContact CG2-CE 3.46Å; T55-M95 VanDerWaalsContact CG2-CE 3.46Å; G70-M95 WeakPolarHBondContact O-CE 3.4Å; R71-M95 VanDerWaalsContact CA-SD 3.53Å; R71-M95 HydrophobicContact CB-CE 4.06Å; R71-M95 HydrophobicContact CB-SD 4.12Å; R71-M95 HydrophobicContact CG-CE 3.53Å; R71-M95 HydrophobicContact CG-SD 4.1Å; P74-M95 HydrophobicContact CB-SD 4.38Å; P74-M95 HydrophobicContact CG-CB 4.42Å; P74-M95 HydrophobicContact CG-SD 4.26Å; M95-Y97 HydrophobicContact CG-CE1 4.45Å; M95-E113 CarbonylContact O-C 3.49Å; M95-E113 VanDerWaalsContact O-CA 3.27Å; M95-E113 WeakPolarHBondContact O-CA 3.32Å; M95-E114 HydrophobicContact CB-CB 4.35Å; M95-E114 VanDerWaalsContact CB-CD 3.46Å; M95-E114 HydrophobicContact CB-CG 3.87Å; M95-E114 PolarHBondContact O-N 3.21Å
96	P	95.7	Very high	95.1	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	134.9	178.5	36.8	-37.8	0	0	0	111.9	T55 L69 L92 C94	T55-P96 PolarHBondContact OG1-O 3.48Å; L69-P96 HydrophobicContact CB-CG 4.28Å; L69-P96 HydrophobicContact CD1-CB 3.93Å; L69-P96 HydrophobicContact CD1-CG 4.24Å; L69-P96 HydrophobicContact CD2-CB 4.17Å; L69-P96 HydrophobicContact CD2-CG 4.01Å; L69-P96 HydrophobicContact CG-CG 4.42Å; L92-P96 HydrophobicContact CD1-CB 3.74Å; L92-P96 HydrophobicContact CD1-CG 3.6Å; C94-P96 WeakPolarHBondContact O-CD 3.21Å
97	Y	92.5	Very high	95.1	Very high	99 Å²	99	46.5 Å²	46.5	39%	0.388	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	-40.6	179.6	-61.2	-58.4	0	0	0	113.5	Y56 M95 L112 E114	Y56-Y97 WeakPolarHBondContact CB-O 3.09Å; M95-Y97 HydrophobicContact CG-CE1 4.45Å; Y97-L112 PolarHBondContact N-O 3.34Å; Y97-E114 HydrophobicContact CD2-CG 4.29Å; Y97-E114 HydrophobicContact CE1-CG 4.02Å; Y97-E114 WeakPolarHBondContact CE1-OE1 3.17Å; Y97-E114 HydrophobicContact CE2-CB 4.22Å; Y97-E114 HydrophobicContact CE2-CG 3.25Å; Y97-E114 WeakPolarHBondContact OH-CG 3.3Å; Y97-E114 PolarHBondContact OH-OE1 3.49Å
98	K	95.9	Very high	95.1	Very high	39 Å²	39	49.2 Å²	49.2	17%	0.17	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	142.7	-173.8	-168.5	78.1	176.8	-132.5	0	109.2	Y56 L112 D138 L139	Y56-K98 HydrophobicContact CD1-CD 4.35Å; Y56-K98 HydrophobicContact CD2-CD 4.21Å; Y56-K98 HydrophobicContact CE1-CD 3.87Å; Y56-K98 HydrophobicContact CE2-CD 3.73Å; Y56-K98 VanDerWaalsContact CZ-CE 3.44Å; Y56-K98 WeakPolarHBondContact OH-CE 3.32Å; Y56-K98 PolarHBondContact OH-NZ 3.29Å; K98-L112 HydrophobicContact CB-CB 4.13Å; K98-L112 HydrophobicContact CB-CD2 4.46Å; K98-L112 PolarHBondContact O-N 3.18Å; K98-D138 WeakPolarHBondContact CD-OD1 3.33Å; K98-D138 WeakPolarHBondContact CE-OD1 3.19Å; K98-D138 IonicContact NZ-OD1 2.95Å; K98-D138 PolarHBondContact NZ-OD1 3.04Å; K98-D138 IonicContact NZ-OD2 3.12Å; K98-L139 HydrophobicContact CB-CB 4.36Å; K98-L139 HydrophobicContact CG-CB 3.99Å
99	I	96.7	Very high	95.2	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.01	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	138.8	174.7	175.4	170.4	0	0	0	109.1	Y56 T58 F67 L69 V76 F109 A110 L111	Y56-I99 HydrophobicContact CD1-CG2 3.73Å; Y56-I99 HydrophobicContact CE1-CG2 4.18Å; T58-I99 HydrophobicContact CG2-CB 4.42Å; T58-I99 HydrophobicContact CG2-CG1 4.39Å; T58-I99 HydrophobicContact CG2-CG2 3.42Å; T58-I99 VanDerWaalsContact CG2-CG2 3.42Å; F67-I99 HydrophobicContact CB-CD1 3.83Å; F67-I99 HydrophobicContact CD1-CD1 3.65Å; F67-I99 HydrophobicContact CD2-CD1 4.27Å; F67-I99 HydrophobicContact CE1-CD1 4.2Å; F67-I99 HydrophobicContact CG-CD1 3.66Å; L69-I99 HydrophobicContact CD1-CB 4.28Å; L69-I99 HydrophobicContact CD1-CG2 3.98Å; L69-I99 HydrophobicContact CD2-CB 4.4Å; L69-I99 HydrophobicContact CD2-CG2 4.26Å; L69-I99 HydrophobicContact CG-CG2 4.04Å; V76-I99 HydrophobicContact CG1-CD1 4.28Å; I99-F109 HydrophobicContact CD1-CB 4.26Å; I99-F109 HydrophobicContact CD1-CD2 3.63Å; I99-F109 HydrophobicContact CD1-CE2 4.19Å; I99-F109 HydrophobicContact CD1-CG 4.09Å; I99-F109 HydrophobicContact CG1-CB 4.33Å; I99-F109 HydrophobicContact CG1-CD2 4.17Å; I99-A110 WeakPolarHBondContact CA-O 3.46Å; I99-L111 HydrophobicContact CB-CD2 3.61Å; I99-L111 HydrophobicContact CD1-CD2 3.67Å; I99-L111 HydrophobicContact CG1-CD2 3.64Å
100	V	96.3	Very high	95.3	Very high	17 Å²	17	44.6 Å²	44.6	10%	0.103	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	129.2	174.6	177.2	0	0	0	0	108.9	F109 A110 L139	V100-F109 CarbonylContact O-C 3.5Å; V100-F109 WeakPolarHBondContact O-CA 3.49Å; V100-F109 WeakPolarHBondContact O-CB 3.48Å; V100-A110 PolarHBondContact N-O 3.21Å; V100-A110 PolarHBondContact O-N 3.46Å; V100-L139 HydrophobicContact CB-CD2 4.17Å; V100-L139 HydrophobicContact CB-CG 4.47Å; V100-L139 HydrophobicContact CG2-CB 4.02Å; V100-L139 HydrophobicContact CG2-CD2 3.89Å; V100-L139 HydrophobicContact CG2-CG 3.85Å; V100-L139 WeakPolarHBondContact CG2-O 3.45Å
101	C	96.2	Very high	95.4	Very high	13 Å²	13	42.9 Å²	42.9	9%	0.088	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	126.7	173.7	-61	0	0	0	0	109.3	F67	F67-C101 VanDerWaalsContact CE2-SG 3.56Å
102	L	96	Very high	95.4	Very high	25 Å²	25	39 Å²	39	13%	0.131	20%	0.199	C	C	.	.	S	Bend	trans	-92.2	-25.9	178.3	-57.6	175.1	0	0	0	111.8	K108 A110 V120 Y141 L148 L162	L102-K108 HydrophobicContact CB-CB 4.01Å; L102-K108 HydrophobicContact CD1-CB 4.4Å; L102-K108 PolarHBondContact N-O 3.47Å; L102-A110 HydrophobicContact CD1-CB 4.26Å; L102-A110 HydrophobicContact CD2-CB 4.24Å; L102-A110 HydrophobicContact CG-CB 4.36Å; L102-V120 HydrophobicContact CD1-CG1 3.86Å; L102-Y141 HydrophobicContact CB-CE1 4.43Å; L102-Y141 HydrophobicContact CD2-CD1 3.94Å; L102-Y141 HydrophobicContact CD2-CD2 3.59Å; L102-Y141 HydrophobicContact CD2-CE1 4.25Å; L102-Y141 HydrophobicContact CD2-CE2 3.94Å; L102-Y141 HydrophobicContact CD2-CG 3.59Å; L102-Y141 WeakPolarHBondContact O-CE1 3.28Å; L102-L148 HydrophobicContact CD2-CD1 4.24Å; L102-L162 HydrophobicContact CD1-CD1 3.8Å; L102-L162 HydrophobicContact CD2-CD1 3.78Å; L102-L162 HydrophobicContact CG-CD1 4.4Å
103	S	95.2	Very high	95.5	Very high	35 Å²	35	38.4 Å²	38.4	25%	0.245	20%	0.195	C	C	.	.	S	Bend	trans	-109.7	161.2	174.5	180	0	0	0	0	109.4	N105 S107 K108	S103-N105 PolarHBondContact O-N 2.99Å; S103-S107 VanDerWaalsContact CB-OG 3.23Å; S103-S107 WeakPolarHBondContact CB-OG 3.27Å; S103-S107 PolarHBondContact OG-OG 2.97Å; S103-K108 PolarHBondContact N-O 3.48Å
104	D	94.5	Very high	95.5	Very high	99 Å²	99	35 Å²	35	53%	0.529	17%	0.174	S	C	.	.	S	Bend	trans	-63.1	-22	172.8	-59.2	-33.6	0	0	0	112.6	S60 P61 D62	S60-D104 WeakPolarHBondContact CB-O 3.47Å; P61-D104 WeakPolarHBondContact CD-O 3.16Å; D62-D104 WeakPolarHBondContact CB-O 3.41Å; D62-D104 PolarHBondContact N-O 3.47Å; D62-D104 VanDerWaalsContact N-O 3.17Å
105	N	94.2	Very high	95.4	Very high	68 Å²	68	39.4 Å²	39.4	36%	0.364	19%	0.193	S	C	.	.	S	Bend	trans	-111.7	179.5	178.5	-55.8	11	0	0	0	110.6	D62 Y65 S103 S107	D62-N105 PolarHBondContact OD2-OD1 2.9Å; D62-N105 VanDerWaalsContact OD2-OD1 3.13Å; Y65-N105 HydrophobicContact CD2-CB 4.48Å; Y65-N105 HydrophobicContact CE2-CB 4.13Å; S103-N105 PolarHBondContact O-N 2.99Å; N105-S107 PolarHBondContact O-N 3.13Å
106	Y	94.1	Very high	95.4	Very high	56 Å²	56	42.5 Å²	42.5	22%	0.22	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-4.8	174.9	77.5	-81.9	0	0	0	116	Y65 K87 F88 K108 A123	Y65-Y106 AromaticContact CD1-CD1 3.8Å; Y65-Y106 HydrophobicContact CD1-CD1 3.8Å; Y65-Y106 HydrophobicContact CD1-CG 4.25Å; Y65-Y106 AromaticContact CD2-CD1 4Å; Y65-Y106 HydrophobicContact CD2-CD1 4Å; Y65-Y106 AromaticContact CE1-CD1 3.44Å; Y65-Y106 HydrophobicContact CE1-CD1 3.44Å; Y65-Y106 VanDerWaalsContact CE1-CD1 3.44Å; Y65-Y106 AromaticContact CE1-CE1 3.91Å; Y65-Y106 HydrophobicContact CE1-CE1 3.91Å; Y65-Y106 HydrophobicContact CE1-CG 4.29Å; Y65-Y106 AromaticContact CE2-CD1 3.66Å; Y65-Y106 HydrophobicContact CE2-CD1 3.66Å; Y65-Y106 HydrophobicContact CE2-CE1 4.37Å; Y65-Y106 HydrophobicContact CG-CD1 4.06Å; Y65-Y106 HydrophobicContact CG-CG 4.4Å; Y65-Y106 AromaticContact CZ-CD1 3.34Å; Y65-Y106 AromaticContact CZ-CE1 3.73Å; K87-Y106 HydrophobicContact CD-CD1 4.25Å; K87-Y106 HydrophobicContact CD-CE1 4.06Å; K87-Y106 HydrophobicContact CD-CE2 4.36Å; K87-Y106 HydrophobicContact CD-CG 4.48Å; K87-Y106 VanDerWaalsContact CE-CE1 3.41Å; K87-Y106 WeakPolarHBondContact CE-OH 3.36Å; F88-Y106 AromaticContact CE1-CD2 3.83Å; F88-Y106 HydrophobicContact CE1-CD2 3.83Å; F88-Y106 HydrophobicContact CE1-CE2 4.41Å; Y106-K108 VanDerWaalsContact C-N 3.28Å; Y106-K108 PolarHBondContact O-N 3.4Å; Y106-A123 HydrophobicContact CE2-CB 4.31Å
107	S	95.3	Very high	95.4	Very high	35 Å²	35	45.9 Å²	45.9	25%	0.245	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-33.4	-166.4	74.4	0	0	0	0	113.7	S103 N105 A122 A123	S103-S107 VanDerWaalsContact CB-OG 3.23Å; S103-S107 WeakPolarHBondContact CB-OG 3.27Å; S103-S107 PolarHBondContact OG-OG 2.97Å; N105-S107 PolarHBondContact O-N 3.13Å; S107-A122 CarbonylContact O-C 3.56Å; S107-A122 WeakPolarHBondContact O-CA 3.5Å; S107-A123 PolarHBondContact O-N 3.29Å
108	K	96.1	Very high	95.7	Very high	124 Å²	124	41.1 Å²	41.1	54%	0.539	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	128.6	-179.7	-60.6	-179.4	-171.4	178.1	0	109.9	L102 S103 Y106 H121	L102-K108 HydrophobicContact CB-CB 4.01Å; L102-K108 HydrophobicContact CD1-CB 4.4Å; L102-K108 PolarHBondContact N-O 3.47Å; S103-K108 PolarHBondContact N-O 3.48Å; Y106-K108 VanDerWaalsContact C-N 3.28Å; Y106-K108 PolarHBondContact O-N 3.4Å; K108-H121 WeakPolarHBondContact CA-O 3.36Å
109	F	97.1	Very high	95.7	Very high	1 Å²	1	39.8 Å²	39.8	0%	0.004	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	153.3	176.7	58.7	-89.3	0	0	0	110.3	F67 V76 F88 I99 V100 L111 H121	F67-F109 AromaticContact CE1-CD1 3.93Å; F67-F109 HydrophobicContact CE1-CD1 3.93Å; F67-F109 AromaticContact CE1-CE1 3.95Å; F67-F109 HydrophobicContact CE1-CE1 3.95Å; F67-F109 HydrophobicContact CE1-CG 4.35Å; F67-F109 HydrophobicContact CE1-CZ 4.36Å; F67-F109 AromaticContact CZ-CD1 3.94Å; F67-F109 HydrophobicContact CZ-CD1 3.94Å; F67-F109 HydrophobicContact CZ-CE1 4.34Å; F67-F109 HydrophobicContact CZ-CG 4.39Å; V76-F109 HydrophobicContact CG1-CE2 4.4Å; F88-F109 HydrophobicContact CE2-CZ 4.38Å; F88-F109 AromaticContact CZ-CE1 3.96Å; F88-F109 HydrophobicContact CZ-CE1 3.96Å; F88-F109 HydrophobicContact CZ-CZ 4.12Å; I99-F109 HydrophobicContact CD1-CB 4.26Å; I99-F109 HydrophobicContact CD1-CD2 3.63Å; I99-F109 HydrophobicContact CD1-CE2 4.19Å; I99-F109 HydrophobicContact CD1-CG 4.09Å; I99-F109 HydrophobicContact CG1-CB 4.33Å; I99-F109 HydrophobicContact CG1-CD2 4.17Å; V100-F109 CarbonylContact O-C 3.5Å; V100-F109 WeakPolarHBondContact O-CA 3.49Å; V100-F109 WeakPolarHBondContact O-CB 3.48Å; F109-L111 HydrophobicContact CD2-CD2 3.94Å; F109-L111 HydrophobicContact CD2-CG 4.07Å; F109-L111 HydrophobicContact CE2-CD1 4.16Å; F109-L111 HydrophobicContact CE2-CD2 4.07Å; F109-L111 HydrophobicContact CE2-CG 4.06Å; F109-H121 HydrophobicContact CD1-CB 4.14Å; F109-H121 HydrophobicContact CD2-CB 3.96Å; F109-H121 HydrophobicContact CE1-CB 3.7Å; F109-H121 HydrophobicContact CE2-CB 3.52Å; F109-H121 AromaticContact CE2-CD2 3.42Å; F109-H121 VanDerWaalsContact CE2-CD2 3.42Å; F109-H121 WeakPolarHBondContact CE2-CD2 3.23Å; F109-H121 AromaticContact CE2-CG 3.57Å; F109-H121 HydrophobicContact CG-CB 4.26Å; F109-H121 HydrophobicContact CZ-CB 3.38Å; F109-H121 AromaticContact CZ-CD2 3.99Å; F109-H121 AromaticContact CZ-CG 3.66Å; F109-H121 PolarHBondContact N-O 2.95Å; F109-H121 PolarHBondContact O-N 3.5Å
110	A	97.3	Very high	95.7	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	140.6	176	0	0	0	0	0	110	I99 V100 L102 E119 V120 L139 L148	I99-A110 WeakPolarHBondContact CA-O 3.46Å; V100-A110 PolarHBondContact N-O 3.21Å; V100-A110 PolarHBondContact O-N 3.46Å; L102-A110 HydrophobicContact CD1-CB 4.26Å; L102-A110 HydrophobicContact CD2-CB 4.24Å; L102-A110 HydrophobicContact CG-CB 4.36Å; A110-E119 CarbonylContact C-O 3.17Å; A110-E119 WeakPolarHBondContact CA-O 3.45Å; A110-V120 HydrophobicContact CB-CG2 4.26Å; A110-L139 HydrophobicContact CB-CD2 4.01Å; A110-L148 HydrophobicContact CB-CD1 4.12Å; A110-L148 HydrophobicContact CB-CD2 4.03Å
111	L	97.4	Very high	95.7	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	132.9	177.1	-58.9	178.3	0	0	0	109.2	L69 V76 L92 I99 F109 E113 V118 E119 H121	L69-L111 HydrophobicContact CD2-CD2 4.13Å; V76-L111 HydrophobicContact CG2-CD1 3.6Å; V76-L111 HydrophobicContact CG2-CD2 4.02Å; V76-L111 HydrophobicContact CG2-CG 4.49Å; L92-L111 HydrophobicContact CD1-CD1 3.52Å; L92-L111 HydrophobicContact CD2-CD1 3.84Å; L92-L111 HydrophobicContact CG-CD1 4.31Å; I99-L111 HydrophobicContact CB-CD2 3.61Å; I99-L111 HydrophobicContact CD1-CD2 3.67Å; I99-L111 HydrophobicContact CG1-CD2 3.64Å; F109-L111 HydrophobicContact CD2-CD2 3.94Å; F109-L111 HydrophobicContact CD2-CG 4.07Å; F109-L111 HydrophobicContact CE2-CD1 4.16Å; F109-L111 HydrophobicContact CE2-CD2 4.07Å; F109-L111 HydrophobicContact CE2-CG 4.06Å; L111-E113 HydrophobicContact CB-CG 4.48Å; L111-V118 CarbonylContact O-C 3.54Å; L111-V118 VanDerWaalsContact O-CA 3.31Å; L111-V118 WeakPolarHBondContact O-CA 3.48Å; L111-V118 WeakPolarHBondContact O-CG1 3.27Å; L111-E119 HydrophobicContact CB-CB 4.41Å; L111-E119 PolarHBondContact N-O 3.22Å; L111-E119 PolarHBondContact O-N 3.42Å; L111-H121 VanDerWaalsContact CD1-CD2 3.46Å; L111-H121 WeakPolarHBondContact CD1-CD2 3.46Å; L111-H121 WeakPolarHBondContact CD1-NE2 3.21Å
112	L	97	Very high	95.7	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	121	165.2	179.8	63.9	0	0	0	108.5	Y97 K98 V118 L139 V150	Y97-L112 PolarHBondContact N-O 3.34Å; K98-L112 HydrophobicContact CB-CB 4.13Å; K98-L112 HydrophobicContact CB-CD2 4.46Å; K98-L112 PolarHBondContact O-N 3.18Å; L112-V118 HydrophobicContact CD1-CG2 3.88Å; L112-L139 HydrophobicContact CB-CB 4.16Å; L112-L139 HydrophobicContact CB-CD2 4.17Å; L112-L139 HydrophobicContact CD2-CB 4.38Å; L112-V150 HydrophobicContact CD1-CG1 4.13Å
113	E	95.9	Very high	95.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	172.1	-177	-56.5	-174.1	154.5	0	0	112.3	C94 M95 L111 W117 E119 K129	C94-E113 HydrophobicContact CB-CB 4.01Å; C94-E113 WeakPolarHBondContact CB-OE2 3.42Å; M95-E113 CarbonylContact O-C 3.49Å; M95-E113 VanDerWaalsContact O-CA 3.27Å; M95-E113 WeakPolarHBondContact O-CA 3.32Å; L111-E113 HydrophobicContact CB-CG 4.48Å; E113-W117 HydrophobicContact CB-CB 4.13Å; E113-W117 PolarHBondContact N-O 3.47Å; E113-E119 VanDerWaalsContact OE1-OE2 3.12Å; E113-K129 IonicContact OE1-NZ 2.89Å; E113-K129 WeakPolarHBondContact OE2-CE 3.41Å; E113-K129 IonicContact OE2-NZ 3.44Å; E113-K129 PolarHBondContact OE2-NZ 3.18Å
114	E	92.8	Very high	95.5	Very high	73 Å²	73	44 Å²	44	34%	0.341	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-56.2	160.3	164	-82.8	-177.1	-173.5	0	0	113	M95 Y97 R116 W117	M95-E114 HydrophobicContact CB-CB 4.35Å; M95-E114 VanDerWaalsContact CB-CD 3.46Å; M95-E114 HydrophobicContact CB-CG 3.87Å; M95-E114 PolarHBondContact O-N 3.21Å; Y97-E114 HydrophobicContact CD2-CG 4.29Å; Y97-E114 HydrophobicContact CE1-CG 4.02Å; Y97-E114 WeakPolarHBondContact CE1-OE1 3.17Å; Y97-E114 HydrophobicContact CE2-CB 4.22Å; Y97-E114 HydrophobicContact CE2-CG 3.25Å; Y97-E114 WeakPolarHBondContact OH-CG 3.3Å; Y97-E114 PolarHBondContact OH-OE1 3.49Å; E114-R116 PolarHBondContact O-N 3.28Å; E114-R116 VanDerWaalsContact O-N 3.13Å; E114-W117 PolarHBondContact O-N 3.35Å
115	E	92.5	Very high	95.4	Very high	121 Å²	121	40.1 Å²	40.1	57%	0.565	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	60.1	24.6	173.6	-50.5	-161.1	154.4	0	0	117.2	R131	E115-R131 PolarHBondContact O-NE 3.46Å; E115-R131 PolarHBondContact O-NH2 2.91Å
116	R	94.8	Very high	95.4	Very high	84 Å²	84	41.8 Å²	41.8	32%	0.317	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	76.2	17.7	176.2	-43.5	171.4	-81.6	178.3	-7.6	114.4	E114 R131 V132 P133 Q135	E114-R116 PolarHBondContact O-N 3.28Å; E114-R116 VanDerWaalsContact O-N 3.13Å; R116-R131 HydrophobicContact CB-CG 4.1Å; R116-R131 WeakPolarHBondContact O-CA 3.33Å; R116-R131 WeakPolarHBondContact O-CG 3.47Å; R116-V132 VanDerWaalsContact CB-O 3.28Å; R116-V132 WeakPolarHBondContact CB-O 3.35Å; R116-V132 WeakPolarHBondContact CD-O 3.49Å; R116-V132 PolarHBondContact O-N 2.9Å; R116-P133 WeakPolarHBondContact CD-O 3.43Å; R116-P133 PolarHBondContact NH1-O 3.04Å; R116-Q135 HydrophobicContact CG-CB 4.45Å
117	W	96.5	Very high	95.4	Very high	71 Å²	71	45.6 Å²	45.6	27%	0.269	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	140.5	177.4	-68.6	111.4	0	0	0	111.5	E113 E114 K129 R131	E113-W117 HydrophobicContact CB-CB 4.13Å; E113-W117 PolarHBondContact N-O 3.47Å; E114-W117 PolarHBondContact O-N 3.35Å; W117-K129 HydrophobicContact CD2-CG 4.4Å; W117-K129 HydrophobicContact CE3-CD 4.2Å; W117-K129 HydrophobicContact CE3-CG 3.7Å; W117-K129 HydrophobicContact CZ3-CG 4.22Å; W117-R131 HydrophobicContact CD2-CB 4.38Å; W117-R131 HydrophobicContact CD2-CG 4.2Å; W117-R131 HydrophobicContact CE3-CB 3.81Å; W117-R131 HydrophobicContact CE3-CG 4.13Å; W117-R131 HydrophobicContact CH2-CB 4.02Å; W117-R131 HydrophobicContact CH2-CG 4.36Å; W117-R131 HydrophobicContact CZ2-CG 4.41Å; W117-R131 HydrophobicContact CZ3-CB 3.63Å; W117-R131 HydrophobicContact CZ3-CG 4.23Å
118	V	96.9	Very high	95.4	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	123	168.8	-179.4	0	0	0	0	107.1	L111 L112 K129 F130 V132 L148 V150	L111-V118 CarbonylContact O-C 3.54Å; L111-V118 VanDerWaalsContact O-CA 3.31Å; L111-V118 WeakPolarHBondContact O-CA 3.48Å; L111-V118 WeakPolarHBondContact O-CG1 3.27Å; L112-V118 HydrophobicContact CD1-CG2 3.88Å; V118-K129 WeakPolarHBondContact O-CA 3.27Å; V118-F130 HydrophobicContact CB-CD1 4.28Å; V118-F130 HydrophobicContact CB-CD2 4.3Å; V118-F130 HydrophobicContact CB-CE1 3.79Å; V118-F130 HydrophobicContact CB-CE2 3.8Å; V118-F130 HydrophobicContact CB-CZ 3.53Å; V118-F130 HydrophobicContact CG1-CE1 3.62Å; V118-F130 HydrophobicContact CG1-CE2 4.25Å; V118-F130 HydrophobicContact CG1-CZ 3.48Å; V118-F130 VanDerWaalsContact CG1-CZ 3.48Å; V118-F130 HydrophobicContact CG2-CE2 4.09Å; V118-F130 HydrophobicContact CG2-CZ 4.13Å; V118-F130 PolarHBondContact N-O 3.05Å; V118-F130 PolarHBondContact O-N 3.38Å; V118-V132 HydrophobicContact CG2-CG2 3.86Å; V118-L148 HydrophobicContact CG1-CD2 3.91Å; V118-V150 HydrophobicContact CG2-CG2 4.09Å
119	E	96.3	Very high	95.3	Very high	10 Å²	10	43.5 Å²	43.5	5%	0.047	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	125.5	-177.1	-169.1	165.7	149.5	0	0	109.7	A110 L111 E113 H121 H126 K129	A110-E119 CarbonylContact C-O 3.17Å; A110-E119 WeakPolarHBondContact CA-O 3.45Å; L111-E119 HydrophobicContact CB-CB 4.41Å; L111-E119 PolarHBondContact N-O 3.22Å; L111-E119 PolarHBondContact O-N 3.42Å; E113-E119 VanDerWaalsContact OE1-OE2 3.12Å; E119-H121 IonicContact OE1-CE1 2.64Å; E119-H121 PolarHBondContact OE1-CE1 3.39Å; E119-H121 IonicContact OE1-NE2 2.88Å; E119-H121 PolarHBondContact OE1-NE2 3.02Å; E119-H121 VanDerWaalsContact OE1-NE2 3.12Å; E119-H126 IonicContact OE1-CD2 2.95Å; E119-H126 PolarHBondContact OE1-CD2 3.29Å; E119-H126 VanDerWaalsContact OE1-CD2 3.25Å; E119-H126 IonicContact OE1-CG 2.55Å; E119-K129 IonicContact OE2-NZ 3.6Å; E119-K129 PolarHBondContact OE2-NZ 3.14Å
120	V	96.8	Very high	95.3	Very high	10 Å²	10	44.4 Å²	44.4	6%	0.061	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	124.7	178	-177.5	0	0	0	0	108.9	L102 A110 H127 F128 F130 L162	L102-V120 HydrophobicContact CD1-CG1 3.86Å; A110-V120 HydrophobicContact CB-CG2 4.26Å; V120-H127 WeakPolarHBondContact O-CB 3.45Å; V120-H127 PolarHBondContact O-N 3.28Å; V120-F128 HydrophobicContact CB-CD1 3.7Å; V120-F128 HydrophobicContact CB-CE1 3.42Å; V120-F128 VanDerWaalsContact CB-CE1 3.42Å; V120-F128 HydrophobicContact CB-CG 4.48Å; V120-F128 HydrophobicContact CB-CZ 3.94Å; V120-F128 HydrophobicContact CG1-CD1 4.18Å; V120-F128 HydrophobicContact CG1-CE1 3.67Å; V120-F128 HydrophobicContact CG1-CZ 4.41Å; V120-F128 HydrophobicContact CG2-CD1 4.25Å; V120-F128 HydrophobicContact CG2-CE1 3.62Å; V120-F128 HydrophobicContact CG2-CE2 4.18Å; V120-F128 HydrophobicContact CG2-CZ 3.58Å; V120-F128 PolarHBondContact N-O 2.97Å; V120-F128 PolarHBondContact O-N 3.47Å; V120-F130 HydrophobicContact CG2-CE1 4.2Å; V120-L162 HydrophobicContact CG2-CD2 4.48Å
121	H	96.7	Very high	95.2	Very high	6 Å²	6	49.5 Å²	49.5	3%	0.028	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	147.3	179.9	-71.4	-86.8	0	0	0	111.7	R90 K108 F109 L111 E119 G125 H126	R90-H121 PolarHBondContact NH1-ND1 3.35Å; K108-H121 WeakPolarHBondContact CA-O 3.36Å; F109-H121 HydrophobicContact CD1-CB 4.14Å; F109-H121 HydrophobicContact CD2-CB 3.96Å; F109-H121 HydrophobicContact CE1-CB 3.7Å; F109-H121 HydrophobicContact CE2-CB 3.52Å; F109-H121 AromaticContact CE2-CD2 3.42Å; F109-H121 VanDerWaalsContact CE2-CD2 3.42Å; F109-H121 WeakPolarHBondContact CE2-CD2 3.23Å; F109-H121 AromaticContact CE2-CG 3.57Å; F109-H121 HydrophobicContact CG-CB 4.26Å; F109-H121 HydrophobicContact CZ-CB 3.38Å; F109-H121 AromaticContact CZ-CD2 3.99Å; F109-H121 AromaticContact CZ-CG 3.66Å; F109-H121 PolarHBondContact N-O 2.95Å; F109-H121 PolarHBondContact O-N 3.5Å; L111-H121 VanDerWaalsContact CD1-CD2 3.46Å; L111-H121 WeakPolarHBondContact CD1-CD2 3.46Å; L111-H121 WeakPolarHBondContact CD1-NE2 3.21Å; E119-H121 IonicContact OE1-CE1 2.64Å; E119-H121 PolarHBondContact OE1-CE1 3.39Å; E119-H121 IonicContact OE1-NE2 2.88Å; E119-H121 PolarHBondContact OE1-NE2 3.02Å; E119-H121 VanDerWaalsContact OE1-NE2 3.12Å; H121-G125 WeakPolarHBondContact CA-O 3.38Å; H121-G125 PolarHBondContact ND1-O 2.92Å; H121-H126 WeakPolarHBondContact ND1-CA 3.42Å; H121-H126 PolarHBondContact ND1-N 2.91Å
122	A	95.7	Very high	95.1	Very high	26 Å²	26	49.7 Å²	49.7	22%	0.215	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	177.4	164.1	0	0	0	0	0	110.4	R90 S107 G124 G125 H127	R90-A122 PolarHBondContact NH1-O 3.23Å; R90-A122 PolarHBondContact NH2-O 3.4Å; S107-A122 CarbonylContact O-C 3.56Å; S107-A122 WeakPolarHBondContact O-CA 3.5Å; A122-G124 PolarHBondContact O-N 3Å; A122-G125 PolarHBondContact N-O 3.31Å; A122-G125 PolarHBondContact O-N 3.48Å; A122-G125 VanDerWaalsContact O-O 3.1Å; A122-H127 HydrophobicContact CB-CB 4.39Å
123	A	94.3	Very high	95	Very high	55 Å²	55	53.2 Å²	53.2	46%	0.455	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-32.8	175.4	0	0	0	0	0	112.4	R90 Y106 S107	R90-A123 PolarHBondContact NH2-O 2.86Å; Y106-A123 HydrophobicContact CE2-CB 4.31Å; S107-A123 PolarHBondContact O-N 3.29Å
124	G	92.7	Very high	94.9	Very high	85 Å²	85	56.7 Å²	56.7	88%	0.876	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-14.1	178	0	0	0	0	0	115.6	A122	A122-G124 PolarHBondContact O-N 3Å
125	G	92.7	Very high	95	Very high	16 Å²	16	56.2 Å²	56.2	17%	0.165	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	140.7	-154.4	-176	0	0	0	0	0	113.2	R90 H121 A122 H127	R90-G125 PolarHBondContact NH1-O 3.47Å; H121-G125 WeakPolarHBondContact CA-O 3.38Å; H121-G125 PolarHBondContact ND1-O 2.92Å; A122-G125 PolarHBondContact N-O 3.31Å; A122-G125 PolarHBondContact O-N 3.48Å; A122-G125 VanDerWaalsContact O-O 3.1Å; G125-H127 PolarHBondContact O-N 3.07Å
126	H	94.1	Very high	95.1	Very high	104 Å²	104	50.7 Å²	50.7	48%	0.481	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	129.4	166.8	163.2	-74.5	0	0	0	109.7	E119 H121 K129	E119-H126 IonicContact OE1-CD2 2.95Å; E119-H126 PolarHBondContact OE1-CD2 3.29Å; E119-H126 VanDerWaalsContact OE1-CD2 3.25Å; E119-H126 IonicContact OE1-CG 2.55Å; H121-H126 WeakPolarHBondContact ND1-CA 3.42Å; H121-H126 PolarHBondContact ND1-N 2.91Å; H126-K129 WeakPolarHBondContact NE2-CB 3.47Å
127	H	94.6	Very high	95	Very high	135 Å²	135	49.5 Å²	49.5	63%	0.625	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.3	-58.8	173	-171.2	-89.7	0	0	0	110.6	V120 A122 G125	V120-H127 WeakPolarHBondContact O-CB 3.45Å; V120-H127 PolarHBondContact O-N 3.28Å; A122-H127 HydrophobicContact CB-CB 4.39Å; G125-H127 PolarHBondContact O-N 3.07Å
128	F	94.8	Very high	95	Very high	61 Å²	61	46.6 Å²	46.6	27%	0.268	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	157	177.4	76	-77.5	0	0	0	111.7	V120 F130 M160 L162	V120-F128 HydrophobicContact CB-CD1 3.7Å; V120-F128 HydrophobicContact CB-CE1 3.42Å; V120-F128 VanDerWaalsContact CB-CE1 3.42Å; V120-F128 HydrophobicContact CB-CG 4.48Å; V120-F128 HydrophobicContact CB-CZ 3.94Å; V120-F128 HydrophobicContact CG1-CD1 4.18Å; V120-F128 HydrophobicContact CG1-CE1 3.67Å; V120-F128 HydrophobicContact CG1-CZ 4.41Å; V120-F128 HydrophobicContact CG2-CD1 4.25Å; V120-F128 HydrophobicContact CG2-CE1 3.62Å; V120-F128 HydrophobicContact CG2-CE2 4.18Å; V120-F128 HydrophobicContact CG2-CZ 3.58Å; V120-F128 PolarHBondContact N-O 2.97Å; V120-F128 PolarHBondContact O-N 3.47Å; F128-F130 AromaticContact CD2-CD1 3.89Å; F128-F130 HydrophobicContact CD2-CD1 3.89Å; F128-F130 AromaticContact CE2-CD1 3.39Å; F128-F130 HydrophobicContact CE2-CD1 3.39Å; F128-F130 AromaticContact CE2-CE1 3.8Å; F128-F130 HydrophobicContact CE2-CE1 3.8Å; F128-F130 HydrophobicContact CE2-CG 4.43Å; F128-F130 HydrophobicContact CZ-CD1 4.34Å; F128-F130 HydrophobicContact CZ-CE1 4.33Å; F128-M160 HydrophobicContact CE2-CE 4.4Å; F128-L162 HydrophobicContact CZ-CD2 3.84Å
129	K	95	Very high	94.9	Very high	54 Å²	54	46.7 Å²	46.7	24%	0.235	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	134.9	-178.7	-175.6	171.6	-163.2	140.6	0	108.9	E113 W117 V118 E119 H126	E113-K129 IonicContact OE1-NZ 2.89Å; E113-K129 WeakPolarHBondContact OE2-CE 3.41Å; E113-K129 IonicContact OE2-NZ 3.44Å; E113-K129 PolarHBondContact OE2-NZ 3.18Å; W117-K129 HydrophobicContact CD2-CG 4.4Å; W117-K129 HydrophobicContact CE3-CD 4.2Å; W117-K129 HydrophobicContact CE3-CG 3.7Å; W117-K129 HydrophobicContact CZ3-CG 4.22Å; V118-K129 WeakPolarHBondContact O-CA 3.27Å; E119-K129 IonicContact OE2-NZ 3.6Å; E119-K129 PolarHBondContact OE2-NZ 3.14Å; H126-K129 WeakPolarHBondContact NE2-CB 3.47Å
130	F	95.8	Very high	94.9	Very high	21 Å²	21	47.7 Å²	47.7	9%	0.092	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	159	179.4	67.5	-89.3	0	0	0	110.9	V118 V120 F128 V132 L148 M160 F167	V118-F130 HydrophobicContact CB-CD1 4.28Å; V118-F130 HydrophobicContact CB-CD2 4.3Å; V118-F130 HydrophobicContact CB-CE1 3.79Å; V118-F130 HydrophobicContact CB-CE2 3.8Å; V118-F130 HydrophobicContact CB-CZ 3.53Å; V118-F130 HydrophobicContact CG1-CE1 3.62Å; V118-F130 HydrophobicContact CG1-CE2 4.25Å; V118-F130 HydrophobicContact CG1-CZ 3.48Å; V118-F130 VanDerWaalsContact CG1-CZ 3.48Å; V118-F130 HydrophobicContact CG2-CE2 4.09Å; V118-F130 HydrophobicContact CG2-CZ 4.13Å; V118-F130 PolarHBondContact N-O 3.05Å; V118-F130 PolarHBondContact O-N 3.38Å; V120-F130 HydrophobicContact CG2-CE1 4.2Å; F128-F130 AromaticContact CD2-CD1 3.89Å; F128-F130 HydrophobicContact CD2-CD1 3.89Å; F128-F130 AromaticContact CE2-CD1 3.39Å; F128-F130 HydrophobicContact CE2-CD1 3.39Å; F128-F130 AromaticContact CE2-CE1 3.8Å; F128-F130 HydrophobicContact CE2-CE1 3.8Å; F128-F130 HydrophobicContact CE2-CG 4.43Å; F128-F130 HydrophobicContact CZ-CD1 4.34Å; F128-F130 HydrophobicContact CZ-CE1 4.33Å; F130-V132 HydrophobicContact CD2-CG2 4.4Å; F130-V132 HydrophobicContact CE2-CG2 4.03Å; F130-L148 HydrophobicContact CZ-CD2 4.11Å; F130-M160 HydrophobicContact CE1-CG 4.2Å; F130-M160 HydrophobicContact CE2-CB 4.26Å; F130-M160 HydrophobicContact CE2-CG 4.16Å; F130-M160 HydrophobicContact CZ-CB 4.01Å; F130-M160 HydrophobicContact CZ-CG 3.81Å; F130-F167 HydrophobicContact CD2-CE1 4.29Å; F130-F167 HydrophobicContact CD2-CE2 4.39Å; F130-F167 AromaticContact CD2-CZ 3.59Å; F130-F167 HydrophobicContact CD2-CZ 3.59Å; F130-F167 HydrophobicContact CE2-CE1 4.01Å; F130-F167 AromaticContact CE2-CZ 3.77Å; F130-F167 HydrophobicContact CE2-CZ 3.77Å
131	R	95.3	Very high	94.9	Very high	107 Å²	107	48.3 Å²	48.3	40%	0.404	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	138.1	-176	-156.1	178.4	-169.2	172.1	11	111.3	E115 R116 W117	E115-R131 PolarHBondContact O-NE 3.46Å; E115-R131 PolarHBondContact O-NH2 2.91Å; R116-R131 HydrophobicContact CB-CG 4.1Å; R116-R131 WeakPolarHBondContact O-CA 3.33Å; R116-R131 WeakPolarHBondContact O-CG 3.47Å; W117-R131 HydrophobicContact CD2-CB 4.38Å; W117-R131 HydrophobicContact CD2-CG 4.2Å; W117-R131 HydrophobicContact CE3-CB 3.81Å; W117-R131 HydrophobicContact CE3-CG 4.13Å; W117-R131 HydrophobicContact CH2-CB 4.02Å; W117-R131 HydrophobicContact CH2-CG 4.36Å; W117-R131 HydrophobicContact CZ2-CG 4.41Å; W117-R131 HydrophobicContact CZ3-CB 3.63Å; W117-R131 HydrophobicContact CZ3-CG 4.23Å
132	V	95.3	Very high	94.8	Very high	3 Å²	3	48.1 Å²	48.1	2%	0.018	27%	0.27	C	S	.	.			trans	-95.8	146.6	174.9	-177.2	0	0	0	0	109.5	R116 V118 F130 K134 V150 Y158	R116-V132 VanDerWaalsContact CB-O 3.28Å; R116-V132 WeakPolarHBondContact CB-O 3.35Å; R116-V132 WeakPolarHBondContact CD-O 3.49Å; R116-V132 PolarHBondContact O-N 2.9Å; V118-V132 HydrophobicContact CG2-CG2 3.86Å; F130-V132 HydrophobicContact CD2-CG2 4.4Å; F130-V132 HydrophobicContact CE2-CG2 4.03Å; V132-K134 VanDerWaalsContact C-N 3.32Å; V132-K134 PolarHBondContact O-N 3Å; V132-V150 HydrophobicContact CG1-CG1 4.44Å; V132-V150 HydrophobicContact CG2-CB 4.46Å; V132-V150 HydrophobicContact CG2-CG1 4.23Å; V132-V150 HydrophobicContact CG2-CG2 4.28Å; V132-Y158 HydrophobicContact CG1-CD1 4.42Å; V132-Y158 HydrophobicContact CG1-CD2 3.05Å; V132-Y158 HydrophobicContact CG1-CE2 3.44Å; V132-Y158 VanDerWaalsContact CG1-CE2 3.44Å; V132-Y158 HydrophobicContact CG1-CG 3.6Å
133	P	95	Very high	94.7	Very high	75 Å²	75	49.1 Å²	49.1	49%	0.487	27%	0.274	S	S	.	.	S	Bend	trans	-61.5	-37	-174.9	-25.4	34.3	0	0	0	114.1	R116 Y158	R116-P133 WeakPolarHBondContact CD-O 3.43Å; R116-P133 PolarHBondContact NH1-O 3.04Å; P133-Y158 HydrophobicContact CB-CE1 4.27Å; P133-Y158 HydrophobicContact CG-CD1 4.32Å; P133-Y158 HydrophobicContact CG-CE1 3.72Å
134	K	93.9	Very high	94.6	Very high	73 Å²	73	53.7 Å²	53.7	32%	0.317	28%	0.281	S	S	.	.	S	Bend	trans	-123	161.4	-179.3	-67.1	178.6	179	176.9	0	110.2	V132 G136 S152 R154 H156 Y158	V132-K134 VanDerWaalsContact C-N 3.32Å; V132-K134 PolarHBondContact O-N 3Å; K134-G136 PolarHBondContact O-N 3.38Å; K134-S152 WeakPolarHBondContact CB-OG 3.4Å; K134-R154 HydrophobicContact CD-CB 3.83Å; K134-R154 HydrophobicContact CD-CG 3.72Å; K134-H156 PolarHBondContact NZ-CD2 3.44Å; K134-Y158 HydrophobicContact CB-CE2 4.18Å; K134-Y158 WeakPolarHBondContact CG-OH 3.27Å
135	Q	94.8	Very high	94.6	Very high	64 Å²	64	51.8 Å²	51.8	30%	0.299	25%	0.252	S	S	.	.			trans	-56.8	128.2	179.8	-171.2	58.6	35.5	0	0	110.9	R116 S152 S153	R116-Q135 HydrophobicContact CG-CB 4.45Å; Q135-S152 CarbonylContact O-C 3.29Å; Q135-S152 WeakPolarHBondContact O-CA 3.38Å; Q135-S152 PolarHBondContact O-OG 2.86Å; Q135-S153 PolarHBondContact O-N 3.21Å
136	G	94.5	Very high	94.6	Very high	4 Å²	4	53 Å²	53	4%	0.041	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	140.9	171.3	0	0	0	0	0	110.2	K134 A151	K134-G136 PolarHBondContact O-N 3.38Å; G136-A151 CarbonylContact C-O 3.58Å; G136-A151 VanDerWaalsContact CA-O 3.3Å; G136-A151 WeakPolarHBondContact CA-O 3.24Å
137	V	94.1	Very high	94.7	Very high	60 Å²	60	48.1 Å²	48.1	36%	0.364	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	-43.9	178.9	-177.1	0	0	0	0	110.4	A151 T184	V137-A151 PolarHBondContact N-O 3Å; V137-T184 VanDerWaalsContact CG1-O 3.26Å; V137-T184 WeakPolarHBondContact CG1-O 3.49Å
138	D	95.6	Very high	94.8	Very high	10 Å²	10	41.7 Å²	41.7	5%	0.053	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	159.9	-179.8	-156	10.8	0	0	0	111.1	K98 A151 V185 C186	K98-D138 WeakPolarHBondContact CD-OD1 3.33Å; K98-D138 WeakPolarHBondContact CE-OD1 3.19Å; K98-D138 IonicContact NZ-OD1 2.95Å; K98-D138 PolarHBondContact NZ-OD1 3.04Å; K98-D138 IonicContact NZ-OD2 3.12Å; D138-A151 HydrophobicContact CB-CB 4.42Å; D138-A151 PolarHBondContact O-N 2.86Å; D138-V185 WeakPolarHBondContact OD2-CA 3.49Å; D138-V185 WeakPolarHBondContact OD2-CG1 3.34Å; D138-C186 HydrophobicContact CB-CB 4.07Å; D138-C186 PolarHBondContact OD2-N 3.37Å
139	L	95.8	Very high	94.9	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.01	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	131.9	-173	-170.9	73	0	0	0	109.2	K98 V100 A110 L112 L148 F149 V150	K98-L139 HydrophobicContact CB-CB 4.36Å; K98-L139 HydrophobicContact CG-CB 3.99Å; V100-L139 HydrophobicContact CB-CD2 4.17Å; V100-L139 HydrophobicContact CB-CG 4.47Å; V100-L139 HydrophobicContact CG2-CB 4.02Å; V100-L139 HydrophobicContact CG2-CD2 3.89Å; V100-L139 HydrophobicContact CG2-CG 3.85Å; V100-L139 WeakPolarHBondContact CG2-O 3.45Å; A110-L139 HydrophobicContact CB-CD2 4.01Å; L112-L139 HydrophobicContact CB-CB 4.16Å; L112-L139 HydrophobicContact CB-CD2 4.17Å; L112-L139 HydrophobicContact CD2-CB 4.38Å; L139-L148 HydrophobicContact CD1-CD1 3.82Å; L139-L148 HydrophobicContact CD1-CD2 4.04Å; L139-L148 HydrophobicContact CD1-CG 3.82Å; L139-L148 HydrophobicContact CD2-CD1 4.38Å; L139-L148 HydrophobicContact CG-CD1 4.02Å; L139-F149 WeakPolarHBondContact CA-O 3.38Å; L139-V150 HydrophobicContact CD1-CB 4.49Å; L139-V150 HydrophobicContact CD1-CG2 3.71Å
140	D	95.7	Very high	95	Very high	31 Å²	31	36.2 Å²	36.2	17%	0.166	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	165.6	169.9	-151.5	-8	0	0	0	112	F149 S187 F188	D140-F149 PolarHBondContact N-O 3.15Å; D140-F149 PolarHBondContact O-N 3.01Å; D140-S187 VanDerWaalsContact OD2-CA 3.27Å; D140-S187 WeakPolarHBondContact OD2-CA 3.39Å; D140-F188 HydrophobicContact CB-CB 4.48Å; D140-F188 WeakPolarHBondContact OD2-CB 3.49Å; D140-F188 PolarHBondContact OD2-N 3.4Å
141	Y	96.3	Very high	95	Very high	23 Å²	23	35.2 Å²	35.2	9%	0.09	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	132.6	-170.3	173.9	-114.6	0	0	0	112.7	L102 P143 D147 L148 L162	L102-Y141 HydrophobicContact CB-CE1 4.43Å; L102-Y141 HydrophobicContact CD2-CD1 3.94Å; L102-Y141 HydrophobicContact CD2-CD2 3.59Å; L102-Y141 HydrophobicContact CD2-CE1 4.25Å; L102-Y141 HydrophobicContact CD2-CE2 3.94Å; L102-Y141 HydrophobicContact CD2-CG 3.59Å; L102-Y141 WeakPolarHBondContact O-CE1 3.28Å; Y141-P143 HydrophobicContact CE1-CB 3.93Å; Y141-D147 WeakPolarHBondContact CD2-O 3.45Å; Y141-L148 HydrophobicContact CD2-CD1 4.44Å; Y141-L162 HydrophobicContact CD2-CD1 4.23Å; Y141-L162 HydrophobicContact CE2-CD1 3.88Å
142	C	95.2	Very high	95	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.007	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	114.5	168.7	174.8	0	0	0	0	110.4	Y144 T145 C146 D147 F149 F188	C142-Y144 VanDerWaalsContact C-N 3.28Å; C142-Y144 PolarHBondContact O-N 2.76Å; C142-T145 PolarHBondContact SG-OG1 3.44Å; C142-T145 VanDerWaalsContact SG-OG1 3.34Å; C142-C146 WeakPolarHBondContact O-CA 3.25Å; C142-C146 PolarHBondContact O-N 2.98Å; C142-D147 PolarHBondContact N-O 2.86Å; C142-D147 PolarHBondContact O-N 3.14Å; C142-F149 HydrophobicContact CB-CE2 3.72Å; C142-F149 HydrophobicContact CB-CZ 4.32Å; C142-F188 HydrophobicContact CB-CD1 4.2Å; C142-F188 HydrophobicContact CB-CD2 4.43Å; C142-F188 HydrophobicContact CB-CE1 3.87Å; C142-F188 HydrophobicContact CB-CE2 4.11Å; C142-F188 HydrophobicContact CB-CG 4.47Å; C142-F188 HydrophobicContact CB-CZ 3.82Å; C142-F188 WeakPolarHBondContact SG-CZ 3.32Å
143	P	92.7	Very high	94.9	Very high	47 Å²	47	32.7 Å²	32.7	31%	0.305	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-21.2	178.8	28.8	-34.4	0	0	0	113.6	Y141	Y141-P143 HydrophobicContact CE1-CB 3.93Å
144	Y	92.6	Very high	94.8	Very high	151 Å²	151	34.5 Å²	34.5	59%	0.592	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-39.7	-175.3	-47.7	-60.9	0	0	0	113	C142 F188 R190	C142-Y144 VanDerWaalsContact C-N 3.28Å; C142-Y144 PolarHBondContact O-N 2.76Å; Y144-F188 HydrophobicContact CD2-CE1 4.4Å; Y144-F188 HydrophobicContact CD2-CZ 4.1Å; Y144-F188 HydrophobicContact CE2-CE1 4.26Å; Y144-F188 HydrophobicContact CE2-CZ 4.16Å; Y144-R190 HydrophobicContact CE2-CB 4.47Å; Y144-R190 VanDerWaalsContact CE2-O 3.27Å; Y144-R190 WeakPolarHBondContact CE2-O 3.48Å; Y144-R190 PolarHBondContact OH-O 3.27Å
145	T	91.9	Very high	94.8	Very high	46 Å²	46	32 Å²	32	28%	0.282	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-4.4	179.6	57.8	0	0	0	0	113	C142 D147	C142-T145 PolarHBondContact SG-OG1 3.44Å; C142-T145 VanDerWaalsContact SG-OG1 3.34Å; T145-D147 PolarHBondContact O-N 3.15Å; T145-D147 VanDerWaalsContact OG1-CG 3.28Å; T145-D147 PolarHBondContact OG1-OD2 2.78Å
146	C	94	Very high	94.8	Very high	42 Å²	42	30.9 Å²	30.9	28%	0.284	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	28.3	-172.7	-60.8	0	0	0	0	113.7	C142 L162	C142-C146 WeakPolarHBondContact O-CA 3.25Å; C142-C146 PolarHBondContact O-N 2.98Å; C146-L162 WeakPolarHBondContact O-CB 3.19Å; C146-L162 PolarHBondContact O-N 3.38Å
147	D	95.3	Very high	94.9	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	126.2	178.2	-70	-26.7	0	0	0	110.8	Y141 C142 T145 F149 R159 K168	Y141-D147 WeakPolarHBondContact CD2-O 3.45Å; C142-D147 PolarHBondContact N-O 2.86Å; C142-D147 PolarHBondContact O-N 3.14Å; T145-D147 PolarHBondContact O-N 3.15Å; T145-D147 VanDerWaalsContact OG1-CG 3.28Å; T145-D147 PolarHBondContact OG1-OD2 2.78Å; D147-F149 HydrophobicContact CB-CE1 4.29Å; D147-F149 HydrophobicContact CB-CE2 4.36Å; D147-F149 HydrophobicContact CB-CZ 3.94Å; D147-R159 IonicContact OD2-CZ 3.26Å; D147-R159 IonicContact OD2-NE 3.04Å; D147-R159 IonicContact OD2-NH2 2.81Å; D147-R159 PolarHBondContact OD2-NH2 2.92Å; D147-K168 WeakPolarHBondContact OD1-CD 3.5Å; D147-K168 WeakPolarHBondContact OD1-CE 3.2Å; D147-K168 IonicContact OD1-NZ 3.25Å; D147-K168 PolarHBondContact OD1-NZ 3.26Å; D147-K168 IonicContact OD2-NZ 3.91Å; D147-K168 PolarHBondContact OD2-NZ 2.89Å
148	L	97	Very high	95	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	122.5	168.6	-172	70.1	0	0	0	109.4	L102 A110 V118 F130 L139 Y141 M160 L162	L102-L148 HydrophobicContact CD2-CD1 4.24Å; A110-L148 HydrophobicContact CB-CD1 4.12Å; A110-L148 HydrophobicContact CB-CD2 4.03Å; V118-L148 HydrophobicContact CG1-CD2 3.91Å; F130-L148 HydrophobicContact CZ-CD2 4.11Å; L139-L148 HydrophobicContact CD1-CD1 3.82Å; L139-L148 HydrophobicContact CD1-CD2 4.04Å; L139-L148 HydrophobicContact CD1-CG 3.82Å; L139-L148 HydrophobicContact CD2-CD1 4.38Å; L139-L148 HydrophobicContact CG-CD1 4.02Å; Y141-L148 HydrophobicContact CD2-CD1 4.44Å; L148-M160 HydrophobicContact CB-CB 4.39Å; L148-M160 PolarHBondContact N-O 3.46Å; L148-M160 PolarHBondContact O-N 3.27Å; L148-L162 HydrophobicContact CB-CD1 4.23Å; L148-L162 HydrophobicContact CB-CD2 4.35Å; L148-L162 HydrophobicContact CB-CG 4.2Å; L148-L162 HydrophobicContact CD2-CD2 4.42Å
149	F	97.1	Very high	95	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	121.6	178.8	-58.8	-71.6	0	0	0	110.2	L139 D140 C142 D147 I157 R159 F188 L195 T209	L139-F149 WeakPolarHBondContact CA-O 3.38Å; D140-F149 PolarHBondContact N-O 3.15Å; D140-F149 PolarHBondContact O-N 3.01Å; C142-F149 HydrophobicContact CB-CE2 3.72Å; C142-F149 HydrophobicContact CB-CZ 4.32Å; D147-F149 HydrophobicContact CB-CE1 4.29Å; D147-F149 HydrophobicContact CB-CE2 4.36Å; D147-F149 HydrophobicContact CB-CZ 3.94Å; F149-I157 HydrophobicContact CB-CG2 3.97Å; F149-I157 HydrophobicContact CD1-CG2 4.2Å; F149-R159 HydrophobicContact CD1-CG 3.65Å; F149-R159 HydrophobicContact CE1-CG 3.64Å; F149-F188 HydrophobicContact CE2-CD2 4.24Å; F149-L195 HydrophobicContact CB-CD1 4.21Å; F149-L195 HydrophobicContact CB-CD2 4.25Å; F149-L195 HydrophobicContact CD1-CD1 4.4Å; F149-L195 HydrophobicContact CD1-CD2 3.52Å; F149-L195 HydrophobicContact CD2-CD1 3.61Å; F149-L195 HydrophobicContact CD2-CD2 4.26Å; F149-L195 HydrophobicContact CE1-CD2 3.87Å; F149-L195 HydrophobicContact CE2-CD1 4.03Å; F149-L195 HydrophobicContact CG-CD1 3.82Å; F149-L195 HydrophobicContact CG-CD2 3.76Å; F149-L195 HydrophobicContact CG-CG 4.43Å; F149-L195 HydrophobicContact CZ-CD2 4.38Å; F149-T209 HydrophobicContact CE1-CG2 4.48Å; F149-T209 HydrophobicContact CE2-CG2 4.12Å; F149-T209 HydrophobicContact CZ-CG2 3.6Å
150	V	97.1	Very high	95	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	105.7	173.9	-171.7	0	0	0	0	108.3	L112 V118 V132 L139 S152 I157 Y158	L112-V150 HydrophobicContact CD1-CG1 4.13Å; V118-V150 HydrophobicContact CG2-CG2 4.09Å; V132-V150 HydrophobicContact CG1-CG1 4.44Å; V132-V150 HydrophobicContact CG2-CB 4.46Å; V132-V150 HydrophobicContact CG2-CG1 4.23Å; V132-V150 HydrophobicContact CG2-CG2 4.28Å; L139-V150 HydrophobicContact CD1-CB 4.49Å; L139-V150 HydrophobicContact CD1-CG2 3.71Å; V150-S152 PolarHBondContact O-N 2.86Å; V150-I157 WeakPolarHBondContact O-CA 3.32Å; V150-Y158 PolarHBondContact N-O 3.33Å; V150-Y158 PolarHBondContact O-N 2.76Å
151	A	96.1	Very high	95	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	127.2	173.9	0	0	0	0	0	109.8	G136 V137 D138 L183 C186	G136-A151 CarbonylContact C-O 3.58Å; G136-A151 VanDerWaalsContact CA-O 3.3Å; G136-A151 WeakPolarHBondContact CA-O 3.24Å; V137-A151 PolarHBondContact N-O 3Å; D138-A151 HydrophobicContact CB-CB 4.42Å; D138-A151 PolarHBondContact O-N 2.86Å; A151-L183 HydrophobicContact CB-CB 4.28Å; A151-L183 HydrophobicContact CB-CD1 4.49Å; A151-C186 HydrophobicContact CB-CB 3.67Å
152	S	94.3	Very high	95	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	156.5	178.8	-169	0	0	0	0	112.3	K134 Q135 V150 R154 H156 L183	K134-S152 WeakPolarHBondContact CB-OG 3.4Å; Q135-S152 CarbonylContact O-C 3.29Å; Q135-S152 WeakPolarHBondContact O-CA 3.38Å; Q135-S152 PolarHBondContact O-OG 2.86Å; V150-S152 PolarHBondContact O-N 2.86Å; S152-R154 PolarHBondContact O-N 3.12Å; S152-R154 VanDerWaalsContact O-O 3.09Å; S152-H156 WeakPolarHBondContact CB-O 3.44Å; S152-H156 PolarHBondContact N-O 3.25Å; S152-L183 WeakPolarHBondContact O-CB 3.15Å; S152-L183 PolarHBondContact O-N 3.01Å
153	S	93.2	Very high	94.9	Very high	58 Å²	58	33.2 Å²	33.2	41%	0.406	17%	0.173	S	C	.	.	S	Bend	trans	-61.7	3.1	167.8	176.8	0	0	0	0	114.1	Q135 G182	Q135-S153 PolarHBondContact O-N 3.21Å; S153-G182 WeakPolarHBondContact O-CA 3.24Å
154	R	93.4	Very high	95	Very high	112 Å²	112	37 Å²	37	42%	0.423	19%	0.187	S	C	.	.	S	Bend	trans	-120.1	-148.9	173.8	-63.8	-61.4	-170.5	169.4	1.1	109.8	K134 S152 S180 L183	K134-R154 HydrophobicContact CD-CB 3.83Å; K134-R154 HydrophobicContact CD-CG 3.72Å; S152-R154 PolarHBondContact O-N 3.12Å; S152-R154 VanDerWaalsContact O-O 3.09Å; R154-S180 PolarHBondContact NH1-O 3Å; R154-L183 PolarHBondContact O-N 2.95Å
155	N	93.8	Very high	95	Very high	20 Å²	20	32 Å²	32	11%	0.107	18%	0.181	C	C	.	.	S	Bend	trans	-89.9	4.3	-175.2	63.9	-29.5	0	0	0	115	V172 S173 L176	N155-V172 WeakPolarHBondContact O-CA 3.44Å; N155-S173 PolarHBondContact O-N 3.16Å; N155-L176 HydrophobicContact CB-CB 3.52Å
156	H	94.7	Very high	95.2	Very high	42 Å²	42	38 Å²	38	19%	0.194	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	140.5	-176.1	-57.9	-62.9	0	0	0	112.3	K134 S152 Y158 L171	K134-H156 PolarHBondContact NZ-CD2 3.44Å; S152-H156 WeakPolarHBondContact CB-O 3.44Å; S152-H156 PolarHBondContact N-O 3.25Å; H156-Y158 HydrophobicContact CB-CE1 4.26Å; H156-Y158 HydrophobicContact CB-CE2 4.26Å; H156-L171 CarbonylContact C-O 3.58Å; H156-L171 WeakPolarHBondContact CA-O 3.48Å
157	I	96.5	Very high	95.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	117.3	161.1	-56.7	171.1	0	0	0	107.3	F149 V150 S170 L171 L183 L195 W207	F149-I157 HydrophobicContact CB-CG2 3.97Å; F149-I157 HydrophobicContact CD1-CG2 4.2Å; V150-I157 WeakPolarHBondContact O-CA 3.32Å; I157-S170 WeakPolarHBondContact O-CA 3.23Å; I157-S170 WeakPolarHBondContact O-CB 3.34Å; I157-L171 HydrophobicContact CB-CB 4.21Å; I157-L171 PolarHBondContact N-O 2.89Å; I157-L171 PolarHBondContact O-N 3.47Å; I157-L183 HydrophobicContact CD1-CD1 3.99Å; I157-L183 HydrophobicContact CG1-CD1 3.38Å; I157-L195 HydrophobicContact CD1-CD2 3.87Å; I157-L195 HydrophobicContact CG2-CD2 4.06Å; I157-W207 HydrophobicContact CD1-CE3 3.82Å; I157-W207 HydrophobicContact CD1-CH2 3.78Å; I157-W207 HydrophobicContact CD1-CZ3 3.35Å
158	Y	96.8	Very high	95.2	Very high	23 Å²	23	44 Å²	44	9%	0.09	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	133	178.3	-60.2	-75.7	0	0	0	109.6	V132 P133 K134 V150 H156	V132-Y158 HydrophobicContact CG1-CD1 4.42Å; V132-Y158 HydrophobicContact CG1-CD2 3.05Å; V132-Y158 HydrophobicContact CG1-CE2 3.44Å; V132-Y158 VanDerWaalsContact CG1-CE2 3.44Å; V132-Y158 HydrophobicContact CG1-CG 3.6Å; P133-Y158 HydrophobicContact CB-CE1 4.27Å; P133-Y158 HydrophobicContact CG-CD1 4.32Å; P133-Y158 HydrophobicContact CG-CE1 3.72Å; K134-Y158 HydrophobicContact CB-CE2 4.18Å; K134-Y158 WeakPolarHBondContact CG-OH 3.27Å; V150-Y158 PolarHBondContact N-O 3.33Å; V150-Y158 PolarHBondContact O-N 2.76Å; H156-Y158 HydrophobicContact CB-CE1 4.26Å; H156-Y158 HydrophobicContact CB-CE2 4.26Å
159	R	95.9	Very high	95.1	Very high	9 Å²	9	49.1 Å²	49.1	3%	0.034	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	114.4	-179.4	-68.3	179.5	63.9	175.6	7.2	109	D147 F149 F167 K168 T169 L171 T209 S212	D147-R159 IonicContact OD2-CZ 3.26Å; D147-R159 IonicContact OD2-NE 3.04Å; D147-R159 IonicContact OD2-NH2 2.81Å; D147-R159 PolarHBondContact OD2-NH2 2.92Å; F149-R159 HydrophobicContact CD1-CG 3.65Å; F149-R159 HydrophobicContact CE1-CG 3.64Å; R159-F167 CarbonylContact O-C 3.53Å; R159-F167 WeakPolarHBondContact O-CA 3.48Å; R159-K168 HydrophobicContact CB-CB 3.86Å; R159-K168 PolarHBondContact O-N 3.29Å; R159-T169 WeakPolarHBondContact CD-O 3.24Å; R159-L171 HydrophobicContact CG-CG 4.47Å; R159-T209 PolarHBondContact NH2-O 3.13Å; R159-S212 PolarHBondContact NH1-OG 3.49Å
160	M	96	Very high	95	Very high	11 Å²	11	51.5 Å²	51.5	5%	0.054	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	116.2	173.6	-176.5	66.4	176.4	0	0	108.6	F128 F130 L148 L162 G165 R166 F167	F128-M160 HydrophobicContact CE2-CE 4.4Å; F130-M160 HydrophobicContact CE1-CG 4.2Å; F130-M160 HydrophobicContact CE2-CB 4.26Å; F130-M160 HydrophobicContact CE2-CG 4.16Å; F130-M160 HydrophobicContact CZ-CB 4.01Å; F130-M160 HydrophobicContact CZ-CG 3.81Å; L148-M160 HydrophobicContact CB-CB 4.39Å; L148-M160 PolarHBondContact N-O 3.46Å; L148-M160 PolarHBondContact O-N 3.27Å; M160-L162 HydrophobicContact CG-CD2 4.29Å; M160-L162 PolarHBondContact O-N 2.95Å; M160-G165 WeakPolarHBondContact CE-O 3.27Å; M160-R166 VanDerWaalsContact SD-C 3.55Å; M160-F167 HydrophobicContact CB-CD1 4.15Å; M160-F167 HydrophobicContact CB-CE1 4.03Å; M160-F167 HydrophobicContact CG-CE1 4.46Å; M160-F167 HydrophobicContact SD-CD1 3.87Å; M160-F167 HydrophobicContact SD-CD2 4.1Å; M160-F167 HydrophobicContact SD-CE1 3.92Å; M160-F167 HydrophobicContact SD-CE2 4.16Å; M160-F167 HydrophobicContact SD-CG 3.98Å; M160-F167 HydrophobicContact SD-CZ 4.08Å
161	D	96	Very high	94.9	Very high	6 Å²	6	51.7 Å²	51.7	3%	0.032	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	115.3	171.3	-167.9	-29.7	0	0	0	108.5	S163 E164 G165 R166 K168	D161-S163 VanDerWaalsContact C-N 3.29Å; D161-S163 WeakPolarHBondContact OD1-CA 3.29Å; D161-S163 WeakPolarHBondContact OD1-CB 3.34Å; D161-S163 PolarHBondContact OD1-N 3.12Å; D161-S163 PolarHBondContact OD1-OG 2.69Å; D161-E164 HydrophobicContact CB-CB 4.49Å; D161-E164 PolarHBondContact OD1-N 3.39Å; D161-G165 VanDerWaalsContact O-CA 3.25Å; D161-G165 WeakPolarHBondContact O-CA 3.3Å; D161-G165 PolarHBondContact O-N 3.24Å; D161-R166 PolarHBondContact N-O 3.44Å; D161-R166 PolarHBondContact O-N 3.18Å; D161-K168 HydrophobicContact CB-CD 4.35Å; D161-K168 HydrophobicContact CB-CG 4.4Å; D161-K168 WeakPolarHBondContact OD2-CE 3.4Å; D161-K168 IonicContact OD2-NZ 3.84Å; D161-K168 PolarHBondContact OD2-NZ 3.15Å
162	L	95.3	Very high	94.8	Very high	42 Å²	42	54.2 Å²	54.2	22%	0.22	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-17	-179.1	-61.5	179.3	0	0	0	112.6	L102 V120 F128 Y141 C146 L148 M160	L102-L162 HydrophobicContact CD1-CD1 3.8Å; L102-L162 HydrophobicContact CD2-CD1 3.78Å; L102-L162 HydrophobicContact CG-CD1 4.4Å; V120-L162 HydrophobicContact CG2-CD2 4.48Å; F128-L162 HydrophobicContact CZ-CD2 3.84Å; Y141-L162 HydrophobicContact CD2-CD1 4.23Å; Y141-L162 HydrophobicContact CE2-CD1 3.88Å; C146-L162 WeakPolarHBondContact O-CB 3.19Å; C146-L162 PolarHBondContact O-N 3.38Å; L148-L162 HydrophobicContact CB-CD1 4.23Å; L148-L162 HydrophobicContact CB-CD2 4.35Å; L148-L162 HydrophobicContact CB-CG 4.2Å; L148-L162 HydrophobicContact CD2-CD2 4.42Å; M160-L162 HydrophobicContact CG-CD2 4.29Å; M160-L162 PolarHBondContact O-N 2.95Å
163	S	93.4	Very high	94.7	Very high	88 Å²	88	54.2 Å²	54.2	62%	0.615	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-44.8	177.6	72	0	0	0	0	111.6	D161	D161-S163 VanDerWaalsContact C-N 3.29Å; D161-S163 WeakPolarHBondContact OD1-CA 3.29Å; D161-S163 WeakPolarHBondContact OD1-CB 3.34Å; D161-S163 PolarHBondContact OD1-N 3.12Å; D161-S163 PolarHBondContact OD1-OG 2.69Å
164	E	94.2	Very high	94.5	Very high	127 Å²	127	58.3 Å²	58.3	59%	0.593	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-21	177.4	-63.2	-169.7	171.6	0	0	113.3	D161 R166	D161-E164 HydrophobicContact CB-CB 4.49Å; D161-E164 PolarHBondContact OD1-N 3.39Å; E164-R166 HydrophobicContact CB-CB 4.41Å; E164-R166 HydrophobicContact CB-CG 4.36Å
165	G	93.9	Very high	94.1	Very high	45 Å²	45	57.9 Å²	57.9	46%	0.464	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	31.5	-173.8	0	0	0	0	0	113	M160 D161	M160-G165 WeakPolarHBondContact CE-O 3.27Å; D161-G165 VanDerWaalsContact O-CA 3.25Å; D161-G165 WeakPolarHBondContact O-CA 3.3Å; D161-G165 PolarHBondContact O-N 3.24Å
166	R	95	Very high	93.8	Very high	172 Å²	172	57.1 Å²	57.1	65%	0.649	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.5	149.2	-175.1	-65.9	179.4	179.6	-176.4	-0.3	111.7	M160 D161 E164 K168	M160-R166 VanDerWaalsContact SD-C 3.55Å; D161-R166 PolarHBondContact N-O 3.44Å; D161-R166 PolarHBondContact O-N 3.18Å; E164-R166 HydrophobicContact CB-CB 4.41Å; E164-R166 HydrophobicContact CB-CG 4.36Å; R166-K168 PolarHBondContact O-N 2.99Å
167	F	95.6	Very high	93.2	Very high	99 Å²	99	60.4 Å²	60.4	43%	0.434	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	124.4	169	-74.3	-72.8	0	0	0	110.3	F130 R159 M160	F130-F167 HydrophobicContact CD2-CE1 4.29Å; F130-F167 HydrophobicContact CD2-CE2 4.39Å; F130-F167 AromaticContact CD2-CZ 3.59Å; F130-F167 HydrophobicContact CD2-CZ 3.59Å; F130-F167 HydrophobicContact CE2-CE1 4.01Å; F130-F167 AromaticContact CE2-CZ 3.77Å; F130-F167 HydrophobicContact CE2-CZ 3.77Å; R159-F167 CarbonylContact O-C 3.53Å; R159-F167 WeakPolarHBondContact O-CA 3.48Å; M160-F167 HydrophobicContact CB-CD1 4.15Å; M160-F167 HydrophobicContact CB-CE1 4.03Å; M160-F167 HydrophobicContact CG-CE1 4.46Å; M160-F167 HydrophobicContact SD-CD1 3.87Å; M160-F167 HydrophobicContact SD-CD2 4.1Å; M160-F167 HydrophobicContact SD-CE1 3.92Å; M160-F167 HydrophobicContact SD-CE2 4.16Å; M160-F167 HydrophobicContact SD-CG 3.98Å; M160-F167 HydrophobicContact SD-CZ 4.08Å
168	K	94.5	Very high	92.6	Very high	70 Å²	70	68.4 Å²	68.4	30%	0.304	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	171.6	164.7	-75.5	178.3	179.3	156.1	0	109.8	D147 R159 D161 R166 S170	D147-K168 WeakPolarHBondContact OD1-CD 3.5Å; D147-K168 WeakPolarHBondContact OD1-CE 3.2Å; D147-K168 IonicContact OD1-NZ 3.25Å; D147-K168 PolarHBondContact OD1-NZ 3.26Å; D147-K168 IonicContact OD2-NZ 3.91Å; D147-K168 PolarHBondContact OD2-NZ 2.89Å; R159-K168 HydrophobicContact CB-CB 3.86Å; R159-K168 PolarHBondContact O-N 3.29Å; D161-K168 HydrophobicContact CB-CD 4.35Å; D161-K168 HydrophobicContact CB-CG 4.4Å; D161-K168 WeakPolarHBondContact OD2-CE 3.4Å; D161-K168 IonicContact OD2-NZ 3.84Å; D161-K168 PolarHBondContact OD2-NZ 3.15Å; R166-K168 PolarHBondContact O-N 2.99Å; K168-S170 PolarHBondContact O-N 3.43Å
169	T	94.8	Very high	92	Very high	107 Å²	107	69.2 Å²	69.2	66%	0.656	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54.9	128.9	172.7	46.6	0	0	0	0	110.2	R159	R159-T169 WeakPolarHBondContact CD-O 3.24Å
170	S	94.9	Very high	91.6	Very high	50 Å²	50	73.3 Å²	73.3	35%	0.35	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	142.7	178	48.4	0	0	0	0	110.4	I157 K168	I157-S170 WeakPolarHBondContact O-CA 3.23Å; I157-S170 WeakPolarHBondContact O-CB 3.34Å; K168-S170 PolarHBondContact O-N 3.43Å
171	L	94.7	Very high	91.3	Very high	5 Å²	5	76.2 Å²	76.2	3%	0.026	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	136.4	171.8	-54.7	168.8	0	0	0	108.2	H156 I157 R159 L195 W207	H156-L171 CarbonylContact C-O 3.58Å; H156-L171 WeakPolarHBondContact CA-O 3.48Å; I157-L171 HydrophobicContact CB-CB 4.21Å; I157-L171 PolarHBondContact N-O 2.89Å; I157-L171 PolarHBondContact O-N 3.47Å; R159-L171 HydrophobicContact CG-CG 4.47Å; L171-L195 HydrophobicContact CD1-CD2 3.61Å; L171-W207 HydrophobicContact CB-CD2 4.3Å; L171-W207 HydrophobicContact CB-CG 4.29Å; L171-W207 HydrophobicContact CD1-CB 3.92Å; L171-W207 HydrophobicContact CD1-CD2 4.25Å; L171-W207 HydrophobicContact CD1-CG 3.96Å; L171-W207 HydrophobicContact CD2-CB 4.39Å; L171-W207 HydrophobicContact CD2-CG 4.3Å; L171-W207 HydrophobicContact CG-CG 4.41Å
172	V	93.6	Very high	91.2	Very high	52 Å²	52	76.1 Å²	76.1	32%	0.315	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	128	-178.8	-168.8	0	0	0	0	108.9	N155 Q174	N155-V172 WeakPolarHBondContact O-CA 3.44Å; V172-Q174 PolarHBondContact O-N 3.45Å
173	S	92.4	Very high	91.1	Very high	0 Å²	0	74.3 Å²	74.3	0%	0	39%	0.393	C	S	.	.			trans	-81.2	113.8	165.8	169.3	0	0	0	0	108.8	N155 R175 L176 E177 D205	N155-S173 PolarHBondContact O-N 3.16Å; S173-R175 PolarHBondContact O-N 3.26Å; S173-L176 PolarHBondContact O-N 3.28Å; S173-L176 PolarHBondContact OG-N 3.21Å; S173-E177 PolarHBondContact O-N 2.9Å; S173-D205 WeakPolarHBondContact CB-OD2 3.29Å; S173-D205 PolarHBondContact OG-OD2 3.38Å
174	Q	89.7	Confident	91.2	Very high	144 Å²	144	71.4 Å²	71.4	67%	0.673	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-63.3	-32.5	176.5	-66.6	177.8	-9.5	0	0	111.5	V172 L176 E177	V172-Q174 PolarHBondContact O-N 3.45Å; Q174-L176 VanDerWaalsContact C-N 3.27Å; Q174-L176 PolarHBondContact O-N 3.03Å; Q174-E177 VanDerWaalsContact O-CB 3.27Å; Q174-E177 WeakPolarHBondContact O-CB 3.4Å; Q174-E177 PolarHBondContact O-N 2.88Å
175	R	85.1	Confident	91.2	Very high	104 Å²	104	65.9 Å²	65.9	39%	0.392	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-68.8	-26.6	-179.6	-64.2	-179.8	179.4	171.7	-13.7	113.2	S173 D205 L218	S173-R175 PolarHBondContact O-N 3.26Å; R175-D205 WeakPolarHBondContact CD-OD1 3.45Å; R175-D205 IonicContact CZ-OD1 3.4Å; R175-D205 IonicContact NE-OD1 3.55Å; R175-D205 IonicContact NH1-OD1 2.75Å; R175-D205 PolarHBondContact NH1-OD1 3.4Å; R175-L218 PolarHBondContact NH1-O 3.48Å
176	L	87.1	Confident	91.3	Very high	3 Å²	3	63.9 Å²	63.9	2%	0.016	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-92.8	-4.1	177.9	-68.5	169.6	0	0	0	112.7	N155 S173 Q174 N178 S179 H181 L183 I201	N155-L176 HydrophobicContact CB-CB 3.52Å; S173-L176 PolarHBondContact O-N 3.28Å; S173-L176 PolarHBondContact OG-N 3.21Å; Q174-L176 VanDerWaalsContact C-N 3.27Å; Q174-L176 PolarHBondContact O-N 3.03Å; L176-N178 PolarHBondContact O-N 3.15Å; L176-S179 PolarHBondContact O-N 2.99Å; L176-S179 VanDerWaalsContact O-N 3.1Å; L176-H181 HydrophobicContact CD2-CB 3.72Å; L176-L183 HydrophobicContact CD1-CD2 3.73Å; L176-L183 HydrophobicContact CD1-CG 3.89Å; L176-I201 HydrophobicContact CD2-CD1 3.54Å; L176-I201 HydrophobicContact CD2-CG1 3.93Å
177	E	82.4	Confident	91.2	Very high	111 Å²	111	56.9 Å²	56.9	52%	0.519	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	128.1	177.3	-159	165.9	-169.4	0	0	109.5	S173 Q174 S179	S173-E177 PolarHBondContact O-N 2.9Å; Q174-E177 VanDerWaalsContact O-CB 3.27Å; Q174-E177 WeakPolarHBondContact O-CB 3.4Å; Q174-E177 PolarHBondContact O-N 2.88Å; E177-S179 PolarHBondContact O-N 3.39Å
178	N	83.3	Confident	91.2	Very high	169 Å²	169	52.7 Å²	52.7	90%	0.904	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	68	5.5	-172.9	-49	-43.4	0	0	0	116.6	L176	L176-N178 PolarHBondContact O-N 3.15Å
179	S	85.3	Confident	91.2	Very high	39 Å²	39	50.4 Å²	50.4	27%	0.273	28%	0.275	S	S	.	.			trans	-91.8	149.7	173.8	-163.2	0	0	0	0	112.1	L176 E177 H181	L176-S179 PolarHBondContact O-N 2.99Å; L176-S179 VanDerWaalsContact O-N 3.1Å; E177-S179 PolarHBondContact O-N 3.39Å; S179-H181 PolarHBondContact O-N 3.4Å; S179-H181 WeakPolarHBondContact OG-CB 3.41Å; S179-H181 PolarHBondContact OG-CD2 3.37Å; S179-H181 PolarHBondContact OG-N 2.8Å
180	S	86.7	Confident	91	Very high	95 Å²	95	50.6 Å²	50.6	66%	0.664	26%	0.264	S	S	*	.	S	Bend	trans	-72.9	-13.1	168.9	59	0	0	0	0	112.4	R154	R154-S180 PolarHBondContact NH1-O 3Å
181	H	90.2	Very high	90.8	Very high	72 Å²	72	53.8 Å²	53.8	33%	0.333	28%	0.277	S	S	.	.			trans	-71.5	164.4	-179.9	-69.3	-57	0	0	0	113.5	L176 S179 T200 I201	L176-H181 HydrophobicContact CD2-CB 3.72Å; S179-H181 PolarHBondContact O-N 3.4Å; S179-H181 WeakPolarHBondContact OG-CB 3.41Å; S179-H181 PolarHBondContact OG-CD2 3.37Å; S179-H181 PolarHBondContact OG-N 2.8Å; H181-T200 WeakPolarHBondContact CA-OG1 3.38Å; H181-T200 WeakPolarHBondContact CB-OG1 3.31Å; H181-T200 PolarHBondContact ND1-OG1 2.98Å; H181-I201 HydrophobicContact CB-CD1 3.85Å; H181-I201 HydrophobicContact CB-CG1 3.48Å; H181-I201 VanDerWaalsContact CB-CG1 3.48Å; H181-I201 WeakPolarHBondContact CD2-CG1 3.08Å; H181-I201 VanDerWaalsContact CG-CG1 3.44Å
182	G	92.5	Very high	90.5	Very high	5 Å²	5	56.2 Å²	56.2	5%	0.052	29%	0.286	C	S	.	.			trans	-142.4	171.9	-173.6	0	0	0	0	0	113.6	S153 S199 T200	S153-G182 WeakPolarHBondContact O-CA 3.24Å; G182-S199 CarbonylContact O-C 3.53Å; G182-S199 WeakPolarHBondContact O-CA 3.24Å; G182-T200 PolarHBondContact N-OG1 3.24Å; G182-T200 PolarHBondContact O-N 3.39Å; G182-T200 PolarHBondContact O-OG1 2.84Å
183	L	94.5	Very high	90.4	Very high	3 Å²	3	53.9 Å²	53.9	2%	0.016	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	143.7	169	-61.1	163.5	0	0	0	110.4	A151 S152 R154 I157 L176 A198	A151-L183 HydrophobicContact CB-CB 4.28Å; A151-L183 HydrophobicContact CB-CD1 4.49Å; S152-L183 WeakPolarHBondContact O-CB 3.15Å; S152-L183 PolarHBondContact O-N 3.01Å; R154-L183 PolarHBondContact O-N 2.95Å; I157-L183 HydrophobicContact CD1-CD1 3.99Å; I157-L183 HydrophobicContact CG1-CD1 3.38Å; L176-L183 HydrophobicContact CD1-CD2 3.73Å; L176-L183 HydrophobicContact CD1-CG 3.89Å; L183-A198 CarbonylContact C-O 3.53Å; L183-A198 WeakPolarHBondContact CA-O 3.31Å; L183-A198 WeakPolarHBondContact CD2-O 3.42Å
184	T	94.4	Very high	90.4	Very high	28 Å²	28	55.3 Å²	55.3	17%	0.172	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	-39.1	-178.5	49.3	0	0	0	0	112.3	V137 A198 T200 V239	V137-T184 VanDerWaalsContact CG1-O 3.26Å; V137-T184 WeakPolarHBondContact CG1-O 3.49Å; T184-A198 PolarHBondContact N-O 2.82Å; T184-A198 PolarHBondContact OG1-O 3.12Å; T184-T200 HydrophobicContact CG2-CG2 3.4Å; T184-V239 VanDerWaalsContact CB-O 3.24Å; T184-V239 WeakPolarHBondContact CB-O 3.31Å; T184-V239 PolarHBondContact OG1-O 3.45Å
185	V	94.8	Very high	90.7	Very high	11 Å²	11	48.5 Å²	48.5	7%	0.067	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	142.1	-174.3	-174.5	0	0	0	0	109.2	D138 G197 A198 T240 M242	D138-V185 WeakPolarHBondContact OD2-CA 3.49Å; D138-V185 WeakPolarHBondContact OD2-CG1 3.34Å; V185-G197 WeakPolarHBondContact O-CA 3.32Å; V185-A198 HydrophobicContact CB-CB 3.97Å; V185-A198 HydrophobicContact CG2-CB 4.37Å; V185-A198 PolarHBondContact O-N 3.49Å; V185-T240 WeakPolarHBondContact CG2-O 3.01Å; V185-M242 HydrophobicContact CG1-CB 4.18Å
186	C	95	Very high	91.2	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.02	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	122.7	170.3	-155.9	0	0	0	0	107.6	D138 A151 F196	D138-C186 HydrophobicContact CB-CB 4.07Å; D138-C186 PolarHBondContact OD2-N 3.37Å; A151-C186 HydrophobicContact CB-CB 3.67Å; C186-F196 WeakPolarHBondContact CA-O 3.33Å
187	S	94.7	Very high	91.6	Very high	25 Å²	25	43.4 Å²	43.4	18%	0.175	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	126.9	173.2	-164	0	0	0	0	111.4	D140 F196 F244	D140-S187 VanDerWaalsContact OD2-CA 3.27Å; D140-S187 WeakPolarHBondContact OD2-CA 3.39Å; S187-F196 PolarHBondContact N-O 2.87Å; S187-F196 PolarHBondContact O-N 3.06Å; S187-F244 VanDerWaalsContact OG-CE2 3.31Å; S187-F244 WeakPolarHBondContact OG-CE2 3.34Å
188	F	95.2	Very high	92.2	Very high	10 Å²	10	38.1 Å²	38.1	4%	0.044	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	122.5	-178	173.1	-105.6	0	0	0	109.5	D140 C142 Y144 F149 R190 L195 T209	D140-F188 HydrophobicContact CB-CB 4.48Å; D140-F188 WeakPolarHBondContact OD2-CB 3.49Å; D140-F188 PolarHBondContact OD2-N 3.4Å; C142-F188 HydrophobicContact CB-CD1 4.2Å; C142-F188 HydrophobicContact CB-CD2 4.43Å; C142-F188 HydrophobicContact CB-CE1 3.87Å; C142-F188 HydrophobicContact CB-CE2 4.11Å; C142-F188 HydrophobicContact CB-CG 4.47Å; C142-F188 HydrophobicContact CB-CZ 3.82Å; C142-F188 WeakPolarHBondContact SG-CZ 3.32Å; Y144-F188 HydrophobicContact CD2-CE1 4.4Å; Y144-F188 HydrophobicContact CD2-CZ 4.1Å; Y144-F188 HydrophobicContact CE2-CE1 4.26Å; Y144-F188 HydrophobicContact CE2-CZ 4.16Å; F149-F188 HydrophobicContact CE2-CD2 4.24Å; F188-R190 HydrophobicContact CD1-CG 4.23Å; F188-R190 HydrophobicContact CE1-CB 4.5Å; F188-R190 HydrophobicContact CE1-CG 4.05Å; F188-L195 HydrophobicContact CB-CD1 3.79Å; F188-L195 HydrophobicContact CD2-CB 4.49Å; F188-L195 HydrophobicContact CD2-CD1 4.41Å; F188-T209 HydrophobicContact CD2-CG2 3.82Å; F188-T209 HydrophobicContact CE2-CG2 3.49Å; F188-T209 VanDerWaalsContact CE2-CG2 3.49Å
189	E	93.7	Very high	92.7	Very high	23 Å²	23	30.1 Å²	30.1	11%	0.107	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	118.5	178.2	-176.2	51.5	-150.7	0	0	110.9	N191 Y192 G193 L194 F196 F244	E189-N191 VanDerWaalsContact C-N 3.33Å; E189-N191 PolarHBondContact O-N 2.98Å; E189-N191 PolarHBondContact OE1-ND2 2.94Å; E189-Y192 HydrophobicContact CB-CE1 4.04Å; E189-Y192 HydrophobicContact CB-CE2 4.04Å; E189-Y192 HydrophobicContact CG-CD1 3.98Å; E189-Y192 HydrophobicContact CG-CE1 3.19Å; E189-Y192 HydrophobicContact CG-CE2 4.1Å; E189-Y192 VanDerWaalsContact CG-OH 3.31Å; E189-Y192 WeakPolarHBondContact CG-OH 3.14Å; E189-G193 WeakPolarHBondContact O-CA 3.44Å; E189-G193 PolarHBondContact O-N 2.93Å; E189-L194 PolarHBondContact N-O 3.36Å; E189-F196 HydrophobicContact CB-CE2 4.32Å; E189-F244 HydrophobicContact CB-CD1 4.38Å; E189-F244 HydrophobicContact CB-CD2 4.31Å; E189-F244 HydrophobicContact CB-CE1 4.34Å; E189-F244 HydrophobicContact CB-CE2 4.21Å; E189-F244 HydrophobicContact CB-CG 4.43Å; E189-F244 HydrophobicContact CB-CZ 4.29Å; E189-F244 HydrophobicContact CG-CD1 4.33Å; E189-F244 HydrophobicContact CG-CG 4.36Å; E189-F244 WeakPolarHBondContact OE2-CB 3.5Å; E189-F244 VanDerWaalsContact OE2-CD2 3.32Å; E189-F244 WeakPolarHBondContact OE2-CD2 3.31Å; E189-F244 VanDerWaalsContact OE2-CG 3.26Å; E189-F244 WeakPolarHBondContact OE2-CG 3.41Å
190	R	90.5	Very high	93	Very high	111 Å²	111	30 Å²	30	42%	0.419	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-27.1	-170.9	-63.5	-177.7	-178	-159.1	-0.6	113.7	Y144 F188	Y144-R190 HydrophobicContact CE2-CB 4.47Å; Y144-R190 VanDerWaalsContact CE2-O 3.27Å; Y144-R190 WeakPolarHBondContact CE2-O 3.48Å; Y144-R190 PolarHBondContact OH-O 3.27Å; F188-R190 HydrophobicContact CD1-CG 4.23Å; F188-R190 HydrophobicContact CE1-CB 4.5Å; F188-R190 HydrophobicContact CE1-CG 4.05Å
191	N	90.2	Very high	93.1	Very high	117 Å²	117	28 Å²	28	63%	0.626	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-37.3	-171.7	-73.5	-42.6	0	0	0	113.4	E189	E189-N191 VanDerWaalsContact C-N 3.33Å; E189-N191 PolarHBondContact O-N 2.98Å; E189-N191 PolarHBondContact OE1-ND2 2.94Å
192	Y	89.1	Confident	93	Very high	56 Å²	56	24.5 Å²	24.5	22%	0.22	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.9	-4.1	-177.4	47.2	-90.8	0	0	0	113.5	E189 L194 F196 S247 L264	E189-Y192 HydrophobicContact CB-CE1 4.04Å; E189-Y192 HydrophobicContact CB-CE2 4.04Å; E189-Y192 HydrophobicContact CG-CD1 3.98Å; E189-Y192 HydrophobicContact CG-CE1 3.19Å; E189-Y192 HydrophobicContact CG-CE2 4.1Å; E189-Y192 VanDerWaalsContact CG-OH 3.31Å; E189-Y192 WeakPolarHBondContact CG-OH 3.14Å; Y192-L194 HydrophobicContact CD2-CB 3.63Å; Y192-L194 HydrophobicContact CD2-CD1 3.42Å; Y192-L194 VanDerWaalsContact CD2-CD1 3.42Å; Y192-L194 HydrophobicContact CD2-CG 3.54Å; Y192-L194 HydrophobicContact CE2-CB 3.5Å; Y192-L194 HydrophobicContact CE2-CD1 3.37Å; Y192-L194 HydrophobicContact CE2-CG 3.75Å; Y192-F196 AromaticContact CE2-CE2 3.79Å; Y192-F196 HydrophobicContact CE2-CE2 3.79Å; Y192-F196 HydrophobicContact CE2-CZ 4.02Å; Y192-F196 WeakPolarHBondContact OH-CE2 3.42Å; Y192-S247 WeakPolarHBondContact CE1-O 3.46Å; Y192-L264 HydrophobicContact CE1-CD1 4.4Å; Y192-L264 HydrophobicContact CE2-CD1 4.32Å; Y192-L264 WeakPolarHBondContact OH-CD1 3.35Å
193	G	91.1	Very high	93	Very high	2 Å²	2	24.6 Å²	24.6	2%	0.021	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.3	26.8	170.6	0	0	0	0	0	114.5	E189 T209	E189-G193 WeakPolarHBondContact O-CA 3.44Å; E189-G193 PolarHBondContact O-N 2.93Å; G193-T209 WeakPolarHBondContact O-CB 3.38Å; G193-T209 WeakPolarHBondContact O-CG2 3.42Å; G193-T209 PolarHBondContact O-N 3.35Å; G193-T209 VanDerWaalsContact O-N 3.13Å; G193-T209 PolarHBondContact O-OG1 3.08Å
194	L	93.5	Very high	93	Very high	31 Å²	31	24.5 Å²	24.5	16%	0.162	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	137.2	169.4	-72.4	166.5	0	0	0	109.9	E189 Y192 F196 W207 D208 V215	E189-L194 PolarHBondContact N-O 3.36Å; Y192-L194 HydrophobicContact CD2-CB 3.63Å; Y192-L194 HydrophobicContact CD2-CD1 3.42Å; Y192-L194 VanDerWaalsContact CD2-CD1 3.42Å; Y192-L194 HydrophobicContact CD2-CG 3.54Å; Y192-L194 HydrophobicContact CE2-CB 3.5Å; Y192-L194 HydrophobicContact CE2-CD1 3.37Å; Y192-L194 HydrophobicContact CE2-CG 3.75Å; L194-F196 HydrophobicContact CB-CD2 4.39Å; L194-F196 HydrophobicContact CB-CE2 3.79Å; L194-F196 HydrophobicContact CB-CZ 4.2Å; L194-F196 HydrophobicContact CD1-CZ 4.27Å; L194-W207 CarbonylContact C-O 3.58Å; L194-W207 WeakPolarHBondContact CA-O 3.28Å; L194-D208 HydrophobicContact CD2-CB 4Å; L194-V215 HydrophobicContact CD2-CB 4.31Å
195	L	95.6	Very high	93	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	127	168.6	-176.3	73.1	0	0	0	109.1	F149 I157 L171 F188 G206 W207 T209	F149-L195 HydrophobicContact CB-CD1 4.21Å; F149-L195 HydrophobicContact CB-CD2 4.25Å; F149-L195 HydrophobicContact CD1-CD1 4.4Å; F149-L195 HydrophobicContact CD1-CD2 3.52Å; F149-L195 HydrophobicContact CD2-CD1 3.61Å; F149-L195 HydrophobicContact CD2-CD2 4.26Å; F149-L195 HydrophobicContact CE1-CD2 3.87Å; F149-L195 HydrophobicContact CE2-CD1 4.03Å; F149-L195 HydrophobicContact CG-CD1 3.82Å; F149-L195 HydrophobicContact CG-CD2 3.76Å; F149-L195 HydrophobicContact CG-CG 4.43Å; F149-L195 HydrophobicContact CZ-CD2 4.38Å; I157-L195 HydrophobicContact CD1-CD2 3.87Å; I157-L195 HydrophobicContact CG2-CD2 4.06Å; L171-L195 HydrophobicContact CD1-CD2 3.61Å; F188-L195 HydrophobicContact CB-CD1 3.79Å; F188-L195 HydrophobicContact CD2-CB 4.49Å; F188-L195 HydrophobicContact CD2-CD1 4.41Å; L195-G206 CarbonylContact O-C 3.59Å; L195-G206 VanDerWaalsContact O-CA 3.22Å; L195-G206 WeakPolarHBondContact O-CA 3.46Å; L195-W207 PolarHBondContact N-O 2.95Å; L195-W207 PolarHBondContact O-N 3.1Å; L195-T209 HydrophobicContact CB-CG2 4.16Å
196	F	95.6	Very high	93	Very high	1 Å²	1	22.7 Å²	22.7	0%	0.004	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	136.5	174.3	-64.7	-97	0	0	0	110.4	C186 S187 E189 Y192 L194 V204 D205 F216 M242 F244 L264	C186-F196 WeakPolarHBondContact CA-O 3.33Å; S187-F196 PolarHBondContact N-O 2.87Å; S187-F196 PolarHBondContact O-N 3.06Å; E189-F196 HydrophobicContact CB-CE2 4.32Å; Y192-F196 AromaticContact CE2-CE2 3.79Å; Y192-F196 HydrophobicContact CE2-CE2 3.79Å; Y192-F196 HydrophobicContact CE2-CZ 4.02Å; Y192-F196 WeakPolarHBondContact OH-CE2 3.42Å; L194-F196 HydrophobicContact CB-CD2 4.39Å; L194-F196 HydrophobicContact CB-CE2 3.79Å; L194-F196 HydrophobicContact CB-CZ 4.2Å; L194-F196 HydrophobicContact CD1-CZ 4.27Å; F196-V204 HydrophobicContact CB-CG1 4.19Å; F196-V204 HydrophobicContact CD1-CG1 4.1Å; F196-D205 CarbonylContact C-O 3.5Å; F196-D205 WeakPolarHBondContact CA-O 3.26Å; F196-F216 AromaticContact CD1-CD1 3.9Å; F196-F216 HydrophobicContact CD1-CD1 3.9Å; F196-F216 HydrophobicContact CD1-CE1 4.2Å; F196-F216 AromaticContact CE1-CD1 3.51Å; F196-F216 HydrophobicContact CE1-CD1 3.51Å; F196-F216 AromaticContact CE1-CE1 3.8Å; F196-F216 HydrophobicContact CE1-CE1 3.8Å; F196-F216 HydrophobicContact CE1-CG 4.06Å; F196-M242 HydrophobicContact CB-CE 3.26Å; F196-M242 HydrophobicContact CB-SD 3.95Å; F196-M242 HydrophobicContact CG-CE 4.3Å; F196-F244 HydrophobicContact CB-CZ 4.21Å; F196-F244 AromaticContact CD2-CE1 3.73Å; F196-F244 HydrophobicContact CD2-CE1 3.73Å; F196-F244 HydrophobicContact CD2-CE2 4.32Å; F196-F244 AromaticContact CD2-CZ 3.28Å; F196-F244 HydrophobicContact CD2-CZ 3.28Å; F196-F244 AromaticContact CE2-CE1 3.65Å; F196-F244 HydrophobicContact CE2-CE1 3.65Å; F196-F244 AromaticContact CE2-CZ 3.7Å; F196-F244 HydrophobicContact CE2-CZ 3.7Å; F196-F244 HydrophobicContact CG-CE1 4.33Å; F196-F244 AromaticContact CG-CZ 3.85Å; F196-F244 HydrophobicContact CG-CZ 3.85Å; F196-F244 HydrophobicContact CZ-CE1 4.21Å; F196-L264 HydrophobicContact CE1-CD2 3.63Å; F196-L264 HydrophobicContact CZ-CD1 4.05Å; F196-L264 HydrophobicContact CZ-CD2 3.65Å
197	G	95.2	Very high	93	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	118.8	174	0	0	0	0	0	109.6	V185 V204 D205	V185-G197 WeakPolarHBondContact O-CA 3.32Å; G197-V204 WeakPolarHBondContact O-CA 3.3Å; G197-D205 PolarHBondContact N-O 3.21Å; G197-D205 PolarHBondContact O-N 2.91Å
198	A	95	Very high	93	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	151.6	174.7	0	0	0	0	0	110.8	L183 T184 V185 V204 V239	L183-A198 CarbonylContact C-O 3.53Å; L183-A198 WeakPolarHBondContact CA-O 3.31Å; L183-A198 WeakPolarHBondContact CD2-O 3.42Å; T184-A198 PolarHBondContact N-O 2.82Å; T184-A198 PolarHBondContact OG1-O 3.12Å; V185-A198 HydrophobicContact CB-CB 3.97Å; V185-A198 HydrophobicContact CG2-CB 4.37Å; V185-A198 PolarHBondContact O-N 3.49Å; A198-V204 HydrophobicContact CB-CG2 4.12Å; A198-V239 HydrophobicContact CB-CB 3.8Å; A198-V239 HydrophobicContact CB-CG1 3.41Å; A198-V239 VanDerWaalsContact CB-CG1 3.41Å
199	S	93.5	Very high	92.8	Very high	1 Å²	1	23 Å²	23	1%	0.007	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	158.9	-175	66.3	0	0	0	0	113.4	G182 I201 G202 C203 V239	G182-S199 CarbonylContact O-C 3.53Å; G182-S199 WeakPolarHBondContact O-CA 3.24Å; S199-I201 PolarHBondContact O-N 3.17Å; S199-G202 PolarHBondContact O-N 3.33Å; S199-G202 VanDerWaalsContact O-N 3.08Å; S199-C203 PolarHBondContact N-O 3.06Å; S199-C203 WeakPolarHBondContact OG-CA 3.41Å; S199-C203 WeakPolarHBondContact OG-CB 3.22Å; S199-C203 PolarHBondContact OG-N 3.49Å; S199-C203 PolarHBondContact OG-O 3.18Å; S199-V239 PolarHBondContact O-N 3.36Å
200	T	92.3	Very high	92.6	Very high	35 Å²	35	31.1 Å²	31.1	22%	0.215	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-17.4	172.5	56.8	0	0	0	0	113.3	H181 G182 T184 G202 S236 A238	H181-T200 WeakPolarHBondContact CA-OG1 3.38Å; H181-T200 WeakPolarHBondContact CB-OG1 3.31Å; H181-T200 PolarHBondContact ND1-OG1 2.98Å; G182-T200 PolarHBondContact N-OG1 3.24Å; G182-T200 PolarHBondContact O-N 3.39Å; G182-T200 PolarHBondContact O-OG1 2.84Å; T184-T200 HydrophobicContact CG2-CG2 3.4Å; T200-G202 PolarHBondContact O-N 3.39Å; T200-S236 PolarHBondContact O-OG 3.48Å; T200-A238 WeakPolarHBondContact O-CA 3.03Å; T200-A238 WeakPolarHBondContact O-CB 3.23Å
201	I	89.6	Confident	92.7	Very high	53 Å²	53	29.3 Å²	29.3	27%	0.272	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-19.4	174.1	-58.5	-178.4	0	0	0	110.6	L176 H181 S199 C221	L176-I201 HydrophobicContact CD2-CD1 3.54Å; L176-I201 HydrophobicContact CD2-CG1 3.93Å; H181-I201 HydrophobicContact CB-CD1 3.85Å; H181-I201 HydrophobicContact CB-CG1 3.48Å; H181-I201 VanDerWaalsContact CB-CG1 3.48Å; H181-I201 WeakPolarHBondContact CD2-CG1 3.08Å; H181-I201 VanDerWaalsContact CG-CG1 3.44Å; S199-I201 PolarHBondContact O-N 3.17Å; I201-C221 PolarHBondContact O-SG 3.02Å
202	G	88.4	Confident	92.7	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.127	C	C	.	.	S	Bend	trans	90	21.8	-172.6	0	0	0	0	0	113.8	S199 T200 V220 C221 T237	S199-G202 PolarHBondContact O-N 3.33Å; S199-G202 VanDerWaalsContact O-N 3.08Å; T200-G202 PolarHBondContact O-N 3.39Å; G202-V220 VanDerWaalsContact O-CB 3.26Å; G202-V220 WeakPolarHBondContact O-CB 3.33Å; G202-V220 PolarHBondContact O-N 2.89Å; G202-C221 WeakPolarHBondContact CA-SG 3.39Å; G202-T237 WeakPolarHBondContact CA-O 3.46Å
203	C	91.3	Very high	92.9	Very high	6 Å²	6	29.2 Å²	29.2	4%	0.041	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	147.9	169.8	-59.3	0	0	0	0	110.5	S199 L218	S199-C203 PolarHBondContact N-O 3.06Å; S199-C203 WeakPolarHBondContact OG-CA 3.41Å; S199-C203 WeakPolarHBondContact OG-CB 3.22Å; S199-C203 PolarHBondContact OG-N 3.49Å; S199-C203 PolarHBondContact OG-O 3.18Å; C203-L218 CarbonylContact C-O 3.51Å; C203-L218 VanDerWaalsContact CA-O 3.25Å; C203-L218 WeakPolarHBondContact CA-O 3.43Å
204	V	94.3	Very high	93	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.012	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	121.7	167.1	-174.8	0	0	0	0	107.8	F196 G197 A198 G217 L218 V239 M242 V252	F196-V204 HydrophobicContact CB-CG1 4.19Å; F196-V204 HydrophobicContact CD1-CG1 4.1Å; G197-V204 WeakPolarHBondContact O-CA 3.3Å; A198-V204 HydrophobicContact CB-CG2 4.12Å; V204-G217 CarbonylContact O-C 3.52Å; V204-G217 WeakPolarHBondContact O-CA 3.48Å; V204-L218 HydrophobicContact CB-CB 4.1Å; V204-L218 HydrophobicContact CB-CD2 4.23Å; V204-L218 HydrophobicContact CG2-CD2 4.1Å; V204-L218 PolarHBondContact N-O 2.76Å; V204-L218 PolarHBondContact O-N 2.95Å; V204-V239 HydrophobicContact CG2-CG2 4.25Å; V204-M242 HydrophobicContact CG1-SD 3.82Å; V204-V252 HydrophobicContact CG2-CG1 4.38Å; V204-V252 HydrophobicContact CG2-CG2 4.41Å
205	D	94.3	Very high	93	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	148.9	176.9	-64.6	-16.1	0	0	0	108.7	S173 R175 F196 G197 W207 H214 F216	S173-D205 WeakPolarHBondContact CB-OD2 3.29Å; S173-D205 PolarHBondContact OG-OD2 3.38Å; R175-D205 WeakPolarHBondContact CD-OD1 3.45Å; R175-D205 IonicContact CZ-OD1 3.4Å; R175-D205 IonicContact NE-OD1 3.55Å; R175-D205 IonicContact NH1-OD1 2.75Å; R175-D205 PolarHBondContact NH1-OD1 3.4Å; F196-D205 CarbonylContact C-O 3.5Å; F196-D205 WeakPolarHBondContact CA-O 3.26Å; G197-D205 PolarHBondContact N-O 3.21Å; G197-D205 PolarHBondContact O-N 2.91Å; D205-W207 HydrophobicContact CB-CH2 3.6Å; D205-W207 HydrophobicContact CB-CZ2 3.93Å; D205-W207 HydrophobicContact CB-CZ3 4.05Å; D205-H214 IonicContact OD1-NE2 2.75Å; D205-F216 CarbonylContact C-O 3.59Å; D205-F216 WeakPolarHBondContact CA-O 3.26Å
206	G	95.1	Very high	92.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	132.9	179.7	0	0	0	0	0	112.2	L195 V215 F216	L195-G206 CarbonylContact O-C 3.59Å; L195-G206 VanDerWaalsContact O-CA 3.22Å; L195-G206 WeakPolarHBondContact O-CA 3.46Å; G206-V215 PolarHBondContact O-N 2.86Å; G206-F216 PolarHBondContact N-O 3.02Å; G206-F216 PolarHBondContact O-N 2.55Å; G206-F216 VanDerWaalsContact O-N 3.07Å
207	W	95.7	Very high	92.6	Very high	4 Å²	4	37.1 Å²	37.1	2%	0.015	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	137.7	178.9	-59.7	-93.6	0	0	0	110.7	I157 L171 L194 L195 D205 E213	I157-W207 HydrophobicContact CD1-CE3 3.82Å; I157-W207 HydrophobicContact CD1-CH2 3.78Å; I157-W207 HydrophobicContact CD1-CZ3 3.35Å; L171-W207 HydrophobicContact CB-CD2 4.3Å; L171-W207 HydrophobicContact CB-CG 4.29Å; L171-W207 HydrophobicContact CD1-CB 3.92Å; L171-W207 HydrophobicContact CD1-CD2 4.25Å; L171-W207 HydrophobicContact CD1-CG 3.96Å; L171-W207 HydrophobicContact CD2-CB 4.39Å; L171-W207 HydrophobicContact CD2-CG 4.3Å; L171-W207 HydrophobicContact CG-CG 4.41Å; L194-W207 CarbonylContact C-O 3.58Å; L194-W207 WeakPolarHBondContact CA-O 3.28Å; L195-W207 PolarHBondContact N-O 2.95Å; L195-W207 PolarHBondContact O-N 3.1Å; D205-W207 HydrophobicContact CB-CH2 3.6Å; D205-W207 HydrophobicContact CB-CZ2 3.93Å; D205-W207 HydrophobicContact CB-CZ3 4.05Å; W207-E213 VanDerWaalsContact CA-O 3.23Å; W207-E213 WeakPolarHBondContact CA-O 3.3Å
208	D	94.3	Very high	92.4	Very high	34 Å²	34	37.3 Å²	37.3	18%	0.182	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	125.9	168.5	-178.5	-3.3	0	0	0	108.9	L194 R210 T211 S212 E213 V215	L194-D208 HydrophobicContact CD2-CB 4Å; D208-R210 PolarHBondContact O-N 3.37Å; D208-R210 PolarHBondContact OD1-N 2.82Å; D208-T211 WeakPolarHBondContact CB-OG1 3.49Å; D208-S212 WeakPolarHBondContact O-CA 3.31Å; D208-S212 PolarHBondContact O-N 3.37Å; D208-E213 PolarHBondContact N-O 2.9Å; D208-V215 HydrophobicContact CB-CG2 3.96Å
209	T	91.5	Very high	92.1	Very high	6 Å²	6	38.3 Å²	38.3	4%	0.037	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-23.1	-178.2	54.3	0	0	0	0	113.4	F149 R159 F188 G193 L195	F149-T209 HydrophobicContact CE1-CG2 4.48Å; F149-T209 HydrophobicContact CE2-CG2 4.12Å; F149-T209 HydrophobicContact CZ-CG2 3.6Å; R159-T209 PolarHBondContact NH2-O 3.13Å; F188-T209 HydrophobicContact CD2-CG2 3.82Å; F188-T209 HydrophobicContact CE2-CG2 3.49Å; F188-T209 VanDerWaalsContact CE2-CG2 3.49Å; G193-T209 WeakPolarHBondContact O-CB 3.38Å; G193-T209 WeakPolarHBondContact O-CG2 3.42Å; G193-T209 PolarHBondContact O-N 3.35Å; G193-T209 VanDerWaalsContact O-N 3.13Å; G193-T209 PolarHBondContact O-OG1 3.08Å; L195-T209 HydrophobicContact CB-CG2 4.16Å
210	R	90	Very high	91.8	Very high	194 Å²	194	38.3 Å²	38.3	73%	0.732	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-50.7	-179	-61.1	173.6	-179	149.6	1	111.7	D208	D208-R210 PolarHBondContact O-N 3.37Å; D208-R210 PolarHBondContact OD1-N 2.82Å
211	T	91.4	Very high	91.2	Very high	72 Å²	72	38.2 Å²	38.2	44%	0.442	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-20	-179	62.3	0	0	0	0	112.5	D208 E213	D208-T211 WeakPolarHBondContact CB-OG1 3.49Å; T211-E213 PolarHBondContact O-N 3.18Å; T211-E213 PolarHBondContact OG1-N 2.98Å
212	S	90.3	Very high	90.6	Very high	42 Å²	42	42 Å²	42	29%	0.294	21%	0.213	S	C	.	.			trans	63.2	15.1	-172.2	-42.4	0	0	0	0	113.7	R159 D208	R159-S212 PolarHBondContact NH1-OG 3.49Å; D208-S212 WeakPolarHBondContact O-CA 3.31Å; D208-S212 PolarHBondContact O-N 3.37Å
213	E	93.2	Very high	90	Very high	130 Å²	130	45.9 Å²	45.9	61%	0.607	23%	0.23	S	C	*	.			trans	-88.5	149.5	179.1	-65.1	-176.6	161.4	0	0	111	W207 D208 T211 V215	W207-E213 VanDerWaalsContact CA-O 3.23Å; W207-E213 WeakPolarHBondContact CA-O 3.3Å; D208-E213 PolarHBondContact N-O 2.9Å; T211-E213 PolarHBondContact O-N 3.18Å; T211-E213 PolarHBondContact OG1-N 2.98Å; E213-V215 PolarHBondContact O-N 3.4Å
214	H	93.6	Very high	89.2	Confident	70 Å²	70	46 Å²	46	32%	0.324	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	112.8	172	171.5	-86.2	0	0	0	109.5	D205 F216	D205-H214 IonicContact OD1-NE2 2.75Å; H214-F216 PolarHBondContact CE1-O 3.16Å; H214-F216 PolarHBondContact NE2-O 3.34Å
215	V	92.8	Very high	88	Confident	93 Å²	93	50 Å²	50	56%	0.564	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.8	-33.5	-173.2	-179.3	0	0	0	0	112.1	L194 G206 D208 E213	L194-V215 HydrophobicContact CD2-CB 4.31Å; G206-V215 PolarHBondContact O-N 2.86Å; D208-V215 HydrophobicContact CB-CG2 3.96Å; E213-V215 PolarHBondContact O-N 3.4Å
216	F	91.6	Very high	86.7	Confident	24 Å²	24	50.6 Å²	50.6	11%	0.105	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	142	-170.9	178.9	-96.5	0	0	0	111.7	F196 D205 G206 H214 L218 L264 N267	F196-F216 AromaticContact CD1-CD1 3.9Å; F196-F216 HydrophobicContact CD1-CD1 3.9Å; F196-F216 HydrophobicContact CD1-CE1 4.2Å; F196-F216 AromaticContact CE1-CD1 3.51Å; F196-F216 HydrophobicContact CE1-CD1 3.51Å; F196-F216 AromaticContact CE1-CE1 3.8Å; F196-F216 HydrophobicContact CE1-CE1 3.8Å; F196-F216 HydrophobicContact CE1-CG 4.06Å; D205-F216 CarbonylContact C-O 3.59Å; D205-F216 WeakPolarHBondContact CA-O 3.26Å; G206-F216 PolarHBondContact N-O 3.02Å; G206-F216 PolarHBondContact O-N 2.55Å; G206-F216 VanDerWaalsContact O-N 3.07Å; H214-F216 PolarHBondContact CE1-O 3.16Å; H214-F216 PolarHBondContact NE2-O 3.34Å; F216-L218 HydrophobicContact CE1-CB 3.71Å; F216-L218 HydrophobicContact CZ-CB 3.93Å; F216-L264 HydrophobicContact CD2-CD2 4.45Å; F216-L264 HydrophobicContact CE1-CD2 4.14Å; F216-L264 HydrophobicContact CE2-CD2 3.89Å; F216-L264 HydrophobicContact CZ-CD2 3.71Å; F216-N267 HydrophobicContact CE2-CB 4.02Å; F216-N267 HydrophobicContact CZ-CB 4.24Å
217	G	91.1	Very high	85.4	Confident	12 Å²	12	53.1 Å²	53.1	12%	0.124	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	125.1	175.2	0	0	0	0	0	111.3	V204 N267	V204-G217 CarbonylContact O-C 3.52Å; V204-G217 WeakPolarHBondContact O-CA 3.48Å; G217-N267 PolarHBondContact O-ND2 3.38Å; G217-N267 VanDerWaalsContact O-ND2 3.14Å
218	L	90.7	Very high	83.9	Confident	5 Å²	5	60.6 Å²	60.6	3%	0.026	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	136.3	175.7	-178.7	77	0	0	0	108.7	R175 C203 V204 F216 V220 V252 Y262 N267	R175-L218 PolarHBondContact NH1-O 3.48Å; C203-L218 CarbonylContact C-O 3.51Å; C203-L218 VanDerWaalsContact CA-O 3.25Å; C203-L218 WeakPolarHBondContact CA-O 3.43Å; V204-L218 HydrophobicContact CB-CB 4.1Å; V204-L218 HydrophobicContact CB-CD2 4.23Å; V204-L218 HydrophobicContact CG2-CD2 4.1Å; V204-L218 PolarHBondContact N-O 2.76Å; V204-L218 PolarHBondContact O-N 2.95Å; F216-L218 HydrophobicContact CE1-CB 3.71Å; F216-L218 HydrophobicContact CZ-CB 3.93Å; L218-V220 HydrophobicContact CD2-CG2 3.83Å; L218-V220 HydrophobicContact CG-CG2 4.21Å; L218-V252 HydrophobicContact CD2-CG2 4.17Å; L218-Y262 HydrophobicContact CD1-CD1 3.66Å; L218-Y262 HydrophobicContact CD1-CD2 4.4Å; L218-Y262 HydrophobicContact CD1-CE1 3.62Å; L218-Y262 HydrophobicContact CD1-CE2 4.34Å; L218-Y262 HydrophobicContact CD1-CG 4.06Å; L218-Y262 HydrophobicContact CD2-CD1 4.49Å; L218-Y262 HydrophobicContact CD2-CD2 3.74Å; L218-Y262 HydrophobicContact CD2-CE1 4.48Å; L218-Y262 HydrophobicContact CD2-CE2 3.71Å; L218-Y262 HydrophobicContact CD2-CG 4.14Å; L218-Y262 HydrophobicContact CG-CE1 4.49Å; L218-Y262 HydrophobicContact CG-CE2 4.47Å; L218-N267 HydrophobicContact CD1-CB 4.07Å; L218-N267 VanDerWaalsContact CD1-O 3.24Å; L218-N267 WeakPolarHBondContact CD1-O 3.46Å
219	N	89.1	Confident	82.5	Confident	21 Å²	21	65.5 Å²	65.5	11%	0.112	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	95.4	174.5	-164.4	-18.6	0	0	0	109.4	C221 E222 F223	N219-C221 VanDerWaalsContact C-N 3.28Å; N219-C221 PolarHBondContact O-N 3.23Å; N219-C221 PolarHBondContact OD1-N 2.79Å; N219-E222 HydrophobicContact CB-CB 4.32Å; N219-E222 WeakPolarHBondContact ND2-CG 3.35Å; N219-E222 PolarHBondContact ND2-OE1 3.4Å; N219-E222 VanDerWaalsContact ND2-OE1 3.11Å; N219-E222 PolarHBondContact ND2-OE2 2.88Å; N219-F223 HydrophobicContact CB-CD2 3.92Å; N219-F223 HydrophobicContact CB-CE2 3.92Å; N219-F223 WeakPolarHBondContact O-CB 3.39Å; N219-F223 WeakPolarHBondContact O-CD2 3.47Å; N219-F223 PolarHBondContact O-N 3.42Å
220	V	86.7	Confident	81.1	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.006	34%	0.344	C	S	.	.	H	α-helix	trans	-66.4	-36.7	-174.6	-177.3	0	0	0	0	110.4	G202 L218 E222 A224 V239 V252 T254 Y260 Y262	G202-V220 VanDerWaalsContact O-CB 3.26Å; G202-V220 WeakPolarHBondContact O-CB 3.33Å; G202-V220 PolarHBondContact O-N 2.89Å; L218-V220 HydrophobicContact CD2-CG2 3.83Å; L218-V220 HydrophobicContact CG-CG2 4.21Å; V220-E222 PolarHBondContact O-N 3.13Å; V220-A224 HydrophobicContact CG1-CB 4.46Å; V220-A224 CarbonylContact O-C 3.53Å; V220-A224 WeakPolarHBondContact O-CA 3.31Å; V220-A224 WeakPolarHBondContact O-CB 3.29Å; V220-A224 PolarHBondContact O-N 3.03Å; V220-V239 HydrophobicContact CG2-CG2 4.18Å; V220-V252 HydrophobicContact CG2-CG1 4.08Å; V220-T254 HydrophobicContact CG1-CG2 4.14Å; V220-Y260 HydrophobicContact CG1-CD2 3.53Å; V220-Y260 HydrophobicContact CG1-CE2 3.58Å; V220-Y260 HydrophobicContact CG1-CG 4.08Å; V220-Y262 HydrophobicContact CG2-CE2 4.18Å
221	C	80	Confident	79.5	Confident	33 Å²	33	63.5 Å²	63.5	22%	0.223	34%	0.339	C	S	.	.	H	α-helix	trans	-62.3	-45.3	-178	-58.7	0	0	0	0	113.2	I201 G202 N219 T237	I201-C221 PolarHBondContact O-SG 3.02Å; G202-C221 WeakPolarHBondContact CA-SG 3.39Å; N219-C221 VanDerWaalsContact C-N 3.28Å; N219-C221 PolarHBondContact O-N 3.23Å; N219-C221 PolarHBondContact OD1-N 2.79Å; C221-T237 WeakPolarHBondContact SG-CB 3.23Å; C221-T237 PolarHBondContact SG-OG1 3Å
222	E	78.3	Confident	77.5	Confident	133 Å²	133	67.5 Å²	67.5	62%	0.621	36%	0.358	S	S	*	.	H	α-helix	trans	-75.6	-42.8	-177.7	-74.2	176.7	-179.3	0	0	111.6	N219 V220	N219-E222 HydrophobicContact CB-CB 4.32Å; N219-E222 WeakPolarHBondContact ND2-CG 3.35Å; N219-E222 PolarHBondContact ND2-OE1 3.4Å; N219-E222 VanDerWaalsContact ND2-OE1 3.11Å; N219-E222 PolarHBondContact ND2-OE2 2.88Å; V220-E222 PolarHBondContact O-N 3.13Å
223	F	75.4	Confident	75.3	Confident	80 Å²	80	73 Å²	73	35%	0.351	38%	0.376	S	S	.	.	H	α-helix	trans	-94.2	-10.9	-168.1	-67.7	-54.3	0	0	0	114.2	N219 R268	N219-F223 HydrophobicContact CB-CD2 3.92Å; N219-F223 HydrophobicContact CB-CE2 3.92Å; N219-F223 WeakPolarHBondContact O-CB 3.39Å; N219-F223 WeakPolarHBondContact O-CD2 3.47Å; N219-F223 PolarHBondContact O-N 3.42Å; F223-R268 WeakPolarHBondContact CB-O 3.4Å; F223-R268 HydrophobicContact CD1-CB 4.31Å; F223-R268 VanDerWaalsContact CD1-O 3.23Å; F223-R268 WeakPolarHBondContact CD1-O 3.5Å; F223-R268 HydrophobicContact CE1-CB 4.41Å; F223-R268 HydrophobicContact CE1-CG 4.35Å; F223-R268 VanDerWaalsContact CG-O 3.31Å; F223-R268 WeakPolarHBondContact CG-O 3.46Å; F223-R268 HydrophobicContact CZ-CG 4.45Å
224	A	74.7	Confident	72.9	Confident	9 Å²	9	73.7 Å²	73.7	7%	0.074	39%	0.394	C	S	.	.	S	Bend	trans	-143.7	59.1	178.7	0	0	0	0	0	111.6	V220 A226 Y260 P270	V220-A224 HydrophobicContact CG1-CB 4.46Å; V220-A224 CarbonylContact O-C 3.53Å; V220-A224 WeakPolarHBondContact O-CA 3.31Å; V220-A224 WeakPolarHBondContact O-CB 3.29Å; V220-A224 PolarHBondContact O-N 3.03Å; A224-A226 PolarHBondContact O-N 2.64Å; A224-Y260 HydrophobicContact CB-CD1 3.58Å; A224-Y260 HydrophobicContact CB-CE1 3.3Å; A224-Y260 HydrophobicContact CB-CG 4.43Å; A224-Y260 PolarHBondContact O-OH 3.17Å; A224-P270 HydrophobicContact CB-CG 3.79Å
225	P	67.5	Low	70.9	Confident	85 Å²	85	75.6 Å²	75.6	55%	0.552	40%	0.399	S	S	*	.			trans	-57.5	141.6	-179.1	24.8	-33.3	0	0	0	110.4
226	A	68.7	Low	69.3	Low	14 Å²	14	74.3 Å²	74.3	12%	0.116	39%	0.393	C	S	.	.			trans	-57.2	150.2	175.5	0	0	0	0	0	110.3	A224 I230	A224-A226 PolarHBondContact O-N 2.64Å; A226-I230 HydrophobicContact CB-CB 4.01Å; A226-I230 HydrophobicContact CB-CD1 4.18Å; A226-I230 HydrophobicContact CB-CG2 3.88Å
227	P	67.7	Low	68.5	Low	54 Å²	54	74.8 Å²	74.8	35%	0.351	40%	0.399	S	S	.	.			trans	-44.2	144.5	175	-25.6	26	0	0	0	112.6	D229 I230 M258	P227-D229 PolarHBondContact O-N 2.72Å; P227-I230 HydrophobicContact CB-CD1 4.13Å; P227-I230 HydrophobicContact CG-CD1 3.97Å; P227-I230 WeakPolarHBondContact O-CB 3.24Å; P227-I230 PolarHBondContact O-N 3.04Å; P227-M258 HydrophobicContact CG-CE 4.03Å
228	E	64	Low	68.3	Low	160 Å²	160	74.9 Å²	74.9	75%	0.748	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-53.1	-29.7	-172.9	-64.8	-178.7	176.3	0	0	113.6	I230 Q231	E228-I230 PolarHBondContact O-N 3.17Å; E228-Q231 PolarHBondContact O-N 3.16Å
229	D	64	Low	68.4	Low	137 Å²	137	74.7 Å²	74.7	73%	0.733	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-56.7	-18.1	173.5	-64.6	-25.7	0	0	0	114.4	P227	P227-D229 PolarHBondContact O-N 2.72Å
230	I	61.7	Low	68.6	Low	23 Å²	23	75.8 Å²	75.8	12%	0.118	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-107.1	-17.7	-170.3	-61.7	159.2	0	0	0	112.2	A226 P227 E228 N232 K233	A226-I230 HydrophobicContact CB-CB 4.01Å; A226-I230 HydrophobicContact CB-CD1 4.18Å; A226-I230 HydrophobicContact CB-CG2 3.88Å; P227-I230 HydrophobicContact CB-CD1 4.13Å; P227-I230 HydrophobicContact CG-CD1 3.97Å; P227-I230 WeakPolarHBondContact O-CB 3.24Å; P227-I230 PolarHBondContact O-N 3.04Å; E228-I230 PolarHBondContact O-N 3.17Å; I230-N232 PolarHBondContact O-N 2.79Å; I230-K233 PolarHBondContact O-N 2.75Å
231	Q	57.1	Low	69	Low	136 Å²	136	76.2 Å²	76.2	64%	0.636	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-22.1	-174.4	-71	-176	5.2	0	0	114	E228 K233	E228-Q231 PolarHBondContact O-N 3.16Å; Q231-K233 PolarHBondContact O-N 3.07Å
232	N	48.7	Very low	69.7	Low	156 Å²	156	75.5 Å²	75.5	83%	0.834	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	7.3	-174.3	-73.9	-26.3	0	0	0	115.9	I230	I230-N232 PolarHBondContact O-N 2.79Å
233	K	45.3	Very low	70.5	Confident	156 Å²	156	69.9 Å²	69.9	68%	0.678	38%	0.377	S	S	*	.	S	Bend	trans	-125.6	130.4	172.3	-79.8	180	177.7	175.4	0	111.2	I230 Q231 R235	I230-K233 PolarHBondContact O-N 2.75Å; Q231-K233 PolarHBondContact O-N 3.07Å; K233-R235 HydrophobicContact CB-CG 4.26Å; K233-R235 PolarHBondContact O-N 3.01Å
234	C	43.1	Very low	71.4	Confident	145 Å²	145	67.5 Å²	67.5	98%	0.98	37%	0.366	S	S	*	.			trans	-50.7	77.3	165.4	-166.9	0	0	0	0	110.1
235	R	51	Low	72.1	Confident	111 Å²	111	69.9 Å²	69.9	42%	0.419	38%	0.375	S	S	.	.			trans	-121	126.8	174.1	-67.8	-168.3	171.2	-160.7	-4.6	107.4	K233 T237 D256 R279	K233-R235 HydrophobicContact CB-CG 4.26Å; K233-R235 PolarHBondContact O-N 3.01Å; R235-T237 PolarHBondContact O-N 2.82Å; R235-D256 WeakPolarHBondContact CB-OD1 3.39Å; R235-D256 WeakPolarHBondContact CD-OD1 3.43Å; R235-R279 PolarHBondContact NH1-O 2.89Å
236	S	59.3	Low	73.2	Confident	65 Å²	65	69.2 Å²	69.2	46%	0.455	37%	0.367	S	S	.	.			trans	-74.8	113.7	176.9	176.5	0	0	0	0	106.6	T200 A238	T200-S236 PolarHBondContact O-OG 3.48Å; S236-A238 PolarHBondContact O-N 3.11Å; S236-A238 WeakPolarHBondContact OG-CB 3.46Å; S236-A238 PolarHBondContact OG-N 3.19Å
237	T	73.5	Confident	74.2	Confident	35 Å²	35	71 Å²	71	22%	0.215	38%	0.378	C	S	.	.			trans	-62.2	32.1	163.1	38.7	0	0	0	0	111.8	G202 C221 R235 V239 D256	G202-T237 WeakPolarHBondContact CA-O 3.46Å; C221-T237 WeakPolarHBondContact SG-CB 3.23Å; C221-T237 PolarHBondContact SG-OG1 3Å; R235-T237 PolarHBondContact O-N 2.82Å; T237-V239 PolarHBondContact O-N 3Å; T237-D256 VanDerWaalsContact CG2-OD2 3.24Å; T237-D256 WeakPolarHBondContact CG2-OD2 3.1Å
238	A	88.6	Confident	75.3	Confident	14 Å²	14	71.3 Å²	71.3	12%	0.116	38%	0.377	C	S	.	.			trans	-56	129.4	174.5	0	0	0	0	0	108.8	T200 S236 T240 T254 G255	T200-A238 WeakPolarHBondContact O-CA 3.03Å; T200-A238 WeakPolarHBondContact O-CB 3.23Å; S236-A238 PolarHBondContact O-N 3.11Å; S236-A238 WeakPolarHBondContact OG-CB 3.46Å; S236-A238 PolarHBondContact OG-N 3.19Å; A238-T240 PolarHBondContact O-N 3.43Å; A238-T254 CarbonylContact O-C 3.59Å; A238-T254 VanDerWaalsContact O-CA 3.3Å; A238-T254 WeakPolarHBondContact O-CA 3.46Å; A238-G255 PolarHBondContact O-N 3Å
239	V	92.8	Very high	76.7	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	123.8	170	172.3	0	0	0	0	107.7	T184 A198 S199 V204 V220 T237 V252 G253	T184-V239 VanDerWaalsContact CB-O 3.24Å; T184-V239 WeakPolarHBondContact CB-O 3.31Å; T184-V239 PolarHBondContact OG1-O 3.45Å; A198-V239 HydrophobicContact CB-CB 3.8Å; A198-V239 HydrophobicContact CB-CG1 3.41Å; A198-V239 VanDerWaalsContact CB-CG1 3.41Å; S199-V239 PolarHBondContact O-N 3.36Å; V204-V239 HydrophobicContact CG2-CG2 4.25Å; V220-V239 HydrophobicContact CG2-CG2 4.18Å; T237-V239 PolarHBondContact O-N 3Å; V239-V252 HydrophobicContact CB-CG1 4.08Å; V239-V252 HydrophobicContact CG1-CG1 3.45Å; V239-V252 VanDerWaalsContact CG1-CG1 3.45Å; V239-V252 HydrophobicContact CG2-CG1 3.45Å; V239-V252 VanDerWaalsContact CG2-CG1 3.45Å; V239-G253 CarbonylContact C-O 3.6Å; V239-G253 WeakPolarHBondContact CA-O 3.48Å
240	T	93.5	Very high	78.1	Confident	45 Å²	45	58.6 Å²	58.6	28%	0.276	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	-31.8	-177.4	51	0	0	0	0	112.7	V185 A238 G253 P281 I282	V185-T240 WeakPolarHBondContact CG2-O 3.01Å; A238-T240 PolarHBondContact O-N 3.43Å; T240-G253 PolarHBondContact N-O 2.8Å; T240-G253 PolarHBondContact OG1-O 3.22Å; T240-P281 HydrophobicContact CG2-CB 4.13Å; T240-I282 WeakPolarHBondContact CB-O 3.28Å; T240-I282 PolarHBondContact OG1-O 3.35Å
241	C	94.4	Very high	79.7	Confident	10 Å²	10	57.5 Å²	57.5	7%	0.068	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	156.9	-177.7	55.7	0	0	0	0	110.7	G253 I282 I285	C241-G253 PolarHBondContact O-N 2.94Å; C241-I282 WeakPolarHBondContact SG-CG2 3.34Å; C241-I282 PolarHBondContact SG-O 2.77Å; C241-I282 VanDerWaalsContact SG-O 3.42Å; C241-I285 VanDerWaalsContact SG-CD1 3.57Å; C241-I285 VanDerWaalsContact SG-CG1 3.57Å
242	M	94.6	Very high	81.4	Confident	17 Å²	17	51 Å²	51	8%	0.084	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	146.9	179.3	-177.2	167.9	61.9	0	0	108.9	V185 F196 V204 F244 V250 A251	V185-M242 HydrophobicContact CG1-CB 4.18Å; F196-M242 HydrophobicContact CB-CE 3.26Å; F196-M242 HydrophobicContact CB-SD 3.95Å; F196-M242 HydrophobicContact CG-CE 4.3Å; V204-M242 HydrophobicContact CG1-SD 3.82Å; M242-F244 HydrophobicContact CE-CZ 4.2Å; M242-F244 HydrophobicContact SD-CZ 4.34Å; M242-V250 HydrophobicContact CG-CG1 3.76Å; M242-V250 HydrophobicContact SD-CG1 4.09Å; M242-A251 VanDerWaalsContact CA-O 3.29Å; M242-A251 WeakPolarHBondContact CA-O 3.37Å
243	S	94.5	Very high	83.6	Confident	16 Å²	16	43.6 Å²	43.6	11%	0.112	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	147.7	178.8	-171.6	0	0	0	0	109.7	A251 I285	S243-A251 PolarHBondContact N-O 3.12Å; S243-A251 PolarHBondContact O-N 3.42Å; S243-I285 VanDerWaalsContact CB-O 3.23Å; S243-I285 WeakPolarHBondContact CB-O 3.15Å; S243-I285 PolarHBondContact OG-O 2.76Å
244	F	93.8	Very high	85.9	Confident	29 Å²	29	36.2 Å²	36.2	13%	0.127	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	133.8	175.4	-59.3	-79.7	0	0	0	108.8	S187 E189 F196 M242 V250	S187-F244 VanDerWaalsContact OG-CE2 3.31Å; S187-F244 WeakPolarHBondContact OG-CE2 3.34Å; E189-F244 HydrophobicContact CB-CD1 4.38Å; E189-F244 HydrophobicContact CB-CD2 4.31Å; E189-F244 HydrophobicContact CB-CE1 4.34Å; E189-F244 HydrophobicContact CB-CE2 4.21Å; E189-F244 HydrophobicContact CB-CG 4.43Å; E189-F244 HydrophobicContact CB-CZ 4.29Å; E189-F244 HydrophobicContact CG-CD1 4.33Å; E189-F244 HydrophobicContact CG-CG 4.36Å; E189-F244 WeakPolarHBondContact OE2-CB 3.5Å; E189-F244 VanDerWaalsContact OE2-CD2 3.32Å; E189-F244 WeakPolarHBondContact OE2-CD2 3.31Å; E189-F244 VanDerWaalsContact OE2-CG 3.26Å; E189-F244 WeakPolarHBondContact OE2-CG 3.41Å; F196-F244 HydrophobicContact CB-CZ 4.21Å; F196-F244 AromaticContact CD2-CE1 3.73Å; F196-F244 HydrophobicContact CD2-CE1 3.73Å; F196-F244 HydrophobicContact CD2-CE2 4.32Å; F196-F244 AromaticContact CD2-CZ 3.28Å; F196-F244 HydrophobicContact CD2-CZ 3.28Å; F196-F244 AromaticContact CE2-CE1 3.65Å; F196-F244 HydrophobicContact CE2-CE1 3.65Å; F196-F244 AromaticContact CE2-CZ 3.7Å; F196-F244 HydrophobicContact CE2-CZ 3.7Å; F196-F244 HydrophobicContact CG-CE1 4.33Å; F196-F244 AromaticContact CG-CZ 3.85Å; F196-F244 HydrophobicContact CG-CZ 3.85Å; F196-F244 HydrophobicContact CZ-CE1 4.21Å; M242-F244 HydrophobicContact CE-CZ 4.2Å; M242-F244 HydrophobicContact SD-CZ 4.34Å; F244-V250 HydrophobicContact CD1-CB 4.39Å; F244-V250 HydrophobicContact CD1-CG1 4.24Å; F244-V250 HydrophobicContact CD1-CG2 3.61Å; F244-V250 HydrophobicContact CE1-CB 4.37Å; F244-V250 HydrophobicContact CE1-CG1 3.94Å; F244-V250 HydrophobicContact CE1-CG2 3.55Å
245	K	91	Very high	88.1	Confident	60 Å²	60	30.1 Å²	30.1	26%	0.261	17%	0.169	S	C	.	.	S	Bend	trans	-86.1	-57.1	168.1	-177	-167.6	-179.4	-131.5	0	109.4	N249 F287 D289 D290	K245-N249 HydrophobicContact CB-CB 3.95Å; K245-N249 HydrophobicContact CD-CB 4.39Å; K245-N249 PolarHBondContact N-O 3.23Å; K245-F287 HydrophobicContact CB-CB 3.99Å; K245-F287 HydrophobicContact CB-CD1 3.64Å; K245-F287 HydrophobicContact CB-CD2 3.65Å; K245-F287 HydrophobicContact CB-CE1 3.87Å; K245-F287 HydrophobicContact CB-CE2 3.88Å; K245-F287 HydrophobicContact CB-CG 3.5Å; K245-F287 VanDerWaalsContact CB-CG 3.5Å; K245-F287 HydrophobicContact CB-CZ 3.95Å; K245-F287 HydrophobicContact CD-CD1 4.12Å; K245-F287 HydrophobicContact CD-CE1 4.39Å; K245-F287 HydrophobicContact CG-CB 3.98Å; K245-F287 HydrophobicContact CG-CD1 3.85Å; K245-F287 HydrophobicContact CG-CE1 4.38Å; K245-F287 HydrophobicContact CG-CG 3.9Å; K245-D289 WeakPolarHBondContact CE-O 3.4Å; K245-D290 IonicContact NZ-OD1 2.62Å; K245-D290 PolarHBondContact NZ-OD1 3.4Å; K245-D290 VanDerWaalsContact NZ-OD1 3.14Å
246	D	90	Very high	89.9	Confident	70 Å²	70	25.3 Å²	25.3	37%	0.374	15%	0.151	S	C	.	.	S	Bend	trans	-134.3	-177.8	-175.6	-57.5	-49.6	0	0	0	107.9	L248 N249	D246-L248 PolarHBondContact O-N 2.82Å; D246-N249 PolarHBondContact OD2-ND2 2.75Å
247	S	89.4	Confident	91.3	Very high	52 Å²	52	22.2 Å²	22.2	36%	0.364	13%	0.129	S	C	.	.	S	Bend	trans	-62.8	-10.4	176.7	58	0	0	0	0	115.6	Y192 L264	Y192-S247 WeakPolarHBondContact CE1-O 3.46Å; S247-L264 WeakPolarHBondContact O-CD1 3.43Å
248	L	91.3	Very high	92.1	Very high	61 Å²	61	20.8 Å²	20.8	32%	0.319	12%	0.12	S	C	.	.	S	Bend	trans	-120.6	-27	-175.6	-65.4	170.3	0	0	0	113.2	D246 D263 L264 R265	D246-L248 PolarHBondContact O-N 2.82Å; L248-D263 CarbonylContact O-C 3.5Å; L248-D263 WeakPolarHBondContact O-CA 3.26Å; L248-L264 WeakPolarHBondContact O-CG 3.35Å; L248-L264 PolarHBondContact O-N 3.02Å; L248-R265 HydrophobicContact CD2-CG 4.2Å
249	N	92.6	Very high	92.3	Very high	24 Å²	24	20.1 Å²	20.1	13%	0.128	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	118.7	-168.5	-68.9	-39.4	0	0	0	110	K245 D246 Y262	K245-N249 HydrophobicContact CB-CB 3.95Å; K245-N249 HydrophobicContact CD-CB 4.39Å; K245-N249 PolarHBondContact N-O 3.23Å; D246-N249 PolarHBondContact OD2-ND2 2.75Å; N249-Y262 WeakPolarHBondContact CA-O 3.5Å
250	V	93.7	Very high	92.3	Very high	6 Å²	6	20.2 Å²	20.2	4%	0.036	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	130	-178.5	-171.9	0	0	0	0	109.6	M242 F244 V252 I261 Y262 L264	M242-V250 HydrophobicContact CG-CG1 3.76Å; M242-V250 HydrophobicContact SD-CG1 4.09Å; F244-V250 HydrophobicContact CD1-CB 4.39Å; F244-V250 HydrophobicContact CD1-CG1 4.24Å; F244-V250 HydrophobicContact CD1-CG2 3.61Å; F244-V250 HydrophobicContact CE1-CB 4.37Å; F244-V250 HydrophobicContact CE1-CG1 3.94Å; F244-V250 HydrophobicContact CE1-CG2 3.55Å; V250-V252 HydrophobicContact CG1-CG2 4.2Å; V250-I261 CarbonylContact O-C 3.46Å; V250-I261 WeakPolarHBondContact O-CA 3.49Å; V250-Y262 PolarHBondContact N-O 2.97Å; V250-Y262 PolarHBondContact O-N 2.89Å; V250-L264 HydrophobicContact CG2-CD1 4.08Å; V250-L264 HydrophobicContact CG2-CD2 3.63Å; V250-L264 HydrophobicContact CG2-CG 3.72Å
251	A	94.7	Very high	92.3	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	137.5	165.2	0	0	0	0	0	110.6	M242 S243 Y260 I285 F287	M242-A251 VanDerWaalsContact CA-O 3.29Å; M242-A251 WeakPolarHBondContact CA-O 3.37Å; S243-A251 PolarHBondContact N-O 3.12Å; S243-A251 PolarHBondContact O-N 3.42Å; A251-Y260 CarbonylContact C-O 3.51Å; A251-Y260 WeakPolarHBondContact CA-O 3.37Å; A251-I285 HydrophobicContact CB-CD1 4.33Å; A251-I285 HydrophobicContact CB-CG2 3.74Å; A251-F287 HydrophobicContact CB-CE1 4.42Å; A251-F287 HydrophobicContact CB-CE2 3.46Å; A251-F287 VanDerWaalsContact CB-CE2 3.46Å; A251-F287 HydrophobicContact CB-CZ 3.34Å
252	V	94.6	Very high	92.2	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	124.2	177.3	-176.4	0	0	0	0	108.2	V204 L218 V220 V239 V250 Y260 Y262	V204-V252 HydrophobicContact CG2-CG1 4.38Å; V204-V252 HydrophobicContact CG2-CG2 4.41Å; L218-V252 HydrophobicContact CD2-CG2 4.17Å; V220-V252 HydrophobicContact CG2-CG1 4.08Å; V239-V252 HydrophobicContact CB-CG1 4.08Å; V239-V252 HydrophobicContact CG1-CG1 3.45Å; V239-V252 VanDerWaalsContact CG1-CG1 3.45Å; V239-V252 HydrophobicContact CG2-CG1 3.45Å; V239-V252 VanDerWaalsContact CG2-CG1 3.45Å; V250-V252 HydrophobicContact CG1-CG2 4.2Å; V252-Y260 PolarHBondContact N-O 2.98Å; V252-Y260 PolarHBondContact O-N 2.86Å; V252-Y262 HydrophobicContact CB-CE2 4.42Å; V252-Y262 HydrophobicContact CG2-CD2 4.04Å; V252-Y262 HydrophobicContact CG2-CE2 4.31Å
253	G	94.4	Very high	92.1	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	136.3	175.5	0	0	0	0	0	110.9	V239 T240 C241 I285	V239-G253 CarbonylContact C-O 3.6Å; V239-G253 WeakPolarHBondContact CA-O 3.48Å; T240-G253 PolarHBondContact N-O 2.8Å; T240-G253 PolarHBondContact OG1-O 3.22Å; C241-G253 PolarHBondContact O-N 2.94Å; G253-I285 VanDerWaalsContact CA-CD1 3.49Å; G253-I285 VanDerWaalsContact N-CD1 3.3Å
254	T	92.9	Very high	91.9	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	162.4	176.4	61.9	0	0	0	0	113	V220 A238 D256 G257 M258 Y260 I282	V220-T254 HydrophobicContact CG1-CG2 4.14Å; A238-T254 CarbonylContact O-C 3.59Å; A238-T254 VanDerWaalsContact O-CA 3.3Å; A238-T254 WeakPolarHBondContact O-CA 3.46Å; T254-D256 PolarHBondContact O-N 3.44Å; T254-G257 PolarHBondContact O-N 3.17Å; T254-M258 PolarHBondContact N-O 2.62Å; T254-M258 WeakPolarHBondContact OG1-CB 3.33Å; T254-M258 PolarHBondContact OG1-N 2.47Å; T254-M258 PolarHBondContact OG1-O 3.2Å; T254-Y260 HydrophobicContact CG2-CD2 3.96Å; T254-Y260 HydrophobicContact CG2-CE2 3.57Å; T254-I282 PolarHBondContact O-N 2.89Å
255	G	90	Very high	91.8	Very high	18 Å²	18	25.8 Å²	25.8	19%	0.186	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-19.2	172.1	0	0	0	0	0	113.9	A238 G257 P281	A238-G255 PolarHBondContact O-N 3Å; G255-G257 VanDerWaalsContact C-N 3.29Å; G255-G257 PolarHBondContact O-N 3.25Å; G255-P281 VanDerWaalsContact O-CA 3.32Å; G255-P281 WeakPolarHBondContact O-CA 3.24Å
256	D	87.4	Confident	91.6	Very high	9 Å²	9	28.7 Å²	28.7	5%	0.048	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-6.9	178.7	-65.4	-42.7	0	0	0	113.9	R235 T237 T254 M258 R279	R235-D256 WeakPolarHBondContact CB-OD1 3.39Å; R235-D256 WeakPolarHBondContact CD-OD1 3.43Å; T237-D256 VanDerWaalsContact CG2-OD2 3.24Å; T237-D256 WeakPolarHBondContact CG2-OD2 3.1Å; T254-D256 PolarHBondContact O-N 3.44Å; D256-M258 HydrophobicContact CB-CG 4.43Å; D256-R279 WeakPolarHBondContact O-CA 3.46Å
257	G	88.8	Confident	91.2	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.142	C	C	.	.	S	Bend	trans	86.4	19.4	-175.9	0	0	0	0	0	113.8	T254 G255 T276 E280	T254-G257 PolarHBondContact O-N 3.17Å; G255-G257 VanDerWaalsContact C-N 3.29Å; G255-G257 PolarHBondContact O-N 3.25Å; G257-T276 WeakPolarHBondContact CA-OG1 3.26Å; G257-T276 WeakPolarHBondContact O-CB 3.27Å; G257-T276 VanDerWaalsContact O-CG2 3.23Å; G257-T276 WeakPolarHBondContact O-CG2 3.32Å; G257-T276 PolarHBondContact O-N 2.9Å; G257-T276 VanDerWaalsContact O-N 3.15Å; G257-T276 PolarHBondContact O-OG1 2.87Å; G257-E280 WeakPolarHBondContact CA-O 3.08Å; G257-E280 PolarHBondContact N-O 3.46Å
258	M	91	Very high	91	Very high	5 Å²	5	34.9 Å²	34.9	3%	0.025	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	137.4	176.3	-56.1	-65.4	-76.8	0	0	110.5	P227 T254 D256 Y260 V273 R274 D275 I282	P227-M258 HydrophobicContact CG-CE 4.03Å; T254-M258 PolarHBondContact N-O 2.62Å; T254-M258 WeakPolarHBondContact OG1-CB 3.33Å; T254-M258 PolarHBondContact OG1-N 2.47Å; T254-M258 PolarHBondContact OG1-O 3.2Å; D256-M258 HydrophobicContact CB-CG 4.43Å; M258-Y260 HydrophobicContact CB-CD2 4.36Å; M258-Y260 HydrophobicContact CB-CE1 4.46Å; M258-Y260 HydrophobicContact CB-CE2 3.52Å; M258-V273 HydrophobicContact CE-CG1 3.78Å; M258-R274 WeakPolarHBondContact CA-O 3.15Å; M258-D275 HydrophobicContact CE-CB 3.99Å; M258-D275 HydrophobicContact SD-CB 3.64Å; M258-D275 VanDerWaalsContact SD-CG 3.5Å; M258-I282 VanDerWaalsContact C-CD1 3.45Å; M258-I282 WeakPolarHBondContact O-CD1 3.15Å
259	V	92.9	Very high	90.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	123.7	175.5	-174.7	0	0	0	0	108.1	R274 T276 I282 I285 V292 T294 W303	V259-R274 HydrophobicContact CB-CB 4.27Å; V259-R274 PolarHBondContact N-O 3.44Å; V259-R274 PolarHBondContact O-N 3.16Å; V259-T276 HydrophobicContact CG2-CG2 4.49Å; V259-I282 HydrophobicContact CB-CD1 4.43Å; V259-I282 HydrophobicContact CG2-CD1 3.45Å; V259-I282 VanDerWaalsContact CG2-CD1 3.45Å; V259-I282 HydrophobicContact CG2-CG1 4.37Å; V259-I285 HydrophobicContact CG1-CD1 4.11Å; V259-V292 HydrophobicContact CG1-CG1 4.49Å; V259-T294 HydrophobicContact CG1-CG2 4.45Å; V259-T294 HydrophobicContact CG2-CG2 3.8Å; V259-W303 HydrophobicContact CG2-CH2 4.06Å; V259-W303 HydrophobicContact CG2-CZ3 3.94Å
260	Y	92.7	Very high	90.5	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.008	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	126.9	178.5	-57.7	-80.2	0	0	0	109.2	V220 A224 A251 V252 T254 M258 Y262 P270 V273	V220-Y260 HydrophobicContact CG1-CD2 3.53Å; V220-Y260 HydrophobicContact CG1-CE2 3.58Å; V220-Y260 HydrophobicContact CG1-CG 4.08Å; A224-Y260 HydrophobicContact CB-CD1 3.58Å; A224-Y260 HydrophobicContact CB-CE1 3.3Å; A224-Y260 HydrophobicContact CB-CG 4.43Å; A224-Y260 PolarHBondContact O-OH 3.17Å; A251-Y260 CarbonylContact C-O 3.51Å; A251-Y260 WeakPolarHBondContact CA-O 3.37Å; V252-Y260 PolarHBondContact N-O 2.98Å; V252-Y260 PolarHBondContact O-N 2.86Å; T254-Y260 HydrophobicContact CG2-CD2 3.96Å; T254-Y260 HydrophobicContact CG2-CE2 3.57Å; M258-Y260 HydrophobicContact CB-CD2 4.36Å; M258-Y260 HydrophobicContact CB-CE1 4.46Å; M258-Y260 HydrophobicContact CB-CE2 3.52Å; Y260-Y262 HydrophobicContact CG-CE2 4.27Å; Y260-P270 HydrophobicContact CD1-CB 4.23Å; Y260-P270 HydrophobicContact CD1-CG 4.17Å; Y260-V273 HydrophobicContact CD1-CB 4.35Å; Y260-V273 HydrophobicContact CD1-CG1 3.93Å; Y260-V273 HydrophobicContact CD1-CG2 3.92Å; Y260-V273 HydrophobicContact CE1-CB 4.45Å; Y260-V273 HydrophobicContact CE1-CG1 3.62Å; Y260-V273 HydrophobicContact CE1-CG2 4.14Å
261	I	93.2	Very high	90.2	Very high	3 Å²	3	44.3 Å²	44.3	2%	0.015	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	123.7	173.8	-55.8	174.2	0	0	0	107.1	V250 P270 W271 H272 V292 V305	V250-I261 CarbonylContact O-C 3.46Å; V250-I261 WeakPolarHBondContact O-CA 3.49Å; I261-P270 CarbonylContact O-C 3.48Å; I261-P270 WeakPolarHBondContact O-CA 3.37Å; I261-W271 HydrophobicContact CG2-CE3 4.16Å; I261-W271 PolarHBondContact O-N 3.34Å; I261-H272 HydrophobicContact CB-CB 4.2Å; I261-H272 HydrophobicContact CD1-CB 4.13Å; I261-H272 HydrophobicContact CG1-CB 4.44Å; I261-H272 PolarHBondContact N-O 2.88Å; I261-H272 PolarHBondContact O-N 3.28Å; I261-V292 HydrophobicContact CD1-CG2 3.67Å; I261-V305 HydrophobicContact CD1-CG1 4.3Å; I261-V305 HydrophobicContact CD1-CG2 4.33Å
262	Y	93	Very high	89.9	Confident	3 Å²	3	45.8 Å²	45.8	1%	0.012	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	146.4	179.1	-69.2	-83.9	0	0	0	110.4	L218 V220 N249 V250 V252 Y260 P270	L218-Y262 HydrophobicContact CD1-CD1 3.66Å; L218-Y262 HydrophobicContact CD1-CD2 4.4Å; L218-Y262 HydrophobicContact CD1-CE1 3.62Å; L218-Y262 HydrophobicContact CD1-CE2 4.34Å; L218-Y262 HydrophobicContact CD1-CG 4.06Å; L218-Y262 HydrophobicContact CD2-CD1 4.49Å; L218-Y262 HydrophobicContact CD2-CD2 3.74Å; L218-Y262 HydrophobicContact CD2-CE1 4.48Å; L218-Y262 HydrophobicContact CD2-CE2 3.71Å; L218-Y262 HydrophobicContact CD2-CG 4.14Å; L218-Y262 HydrophobicContact CG-CE1 4.49Å; L218-Y262 HydrophobicContact CG-CE2 4.47Å; V220-Y262 HydrophobicContact CG2-CE2 4.18Å; N249-Y262 WeakPolarHBondContact CA-O 3.5Å; V250-Y262 PolarHBondContact N-O 2.97Å; V250-Y262 PolarHBondContact O-N 2.89Å; V252-Y262 HydrophobicContact CB-CE2 4.42Å; V252-Y262 HydrophobicContact CG2-CD2 4.04Å; V252-Y262 HydrophobicContact CG2-CE2 4.31Å; Y260-Y262 HydrophobicContact CG-CE2 4.27Å; Y262-P270 HydrophobicContact CD1-CB 4.1Å; Y262-P270 VanDerWaalsContact CE1-CA 3.45Å; Y262-P270 HydrophobicContact CE1-CB 3.66Å; Y262-P270 HydrophobicContact CE1-CG 4.28Å; Y262-P270 HydrophobicContact CE2-CB 4.36Å
263	D	92.2	Very high	89.6	Confident	22 Å²	22	49.1 Å²	49.1	12%	0.118	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	129.3	157.2	-175.4	-32.2	0	0	0	106.8	L248 R265 Q266	L248-D263 CarbonylContact O-C 3.5Å; L248-D263 WeakPolarHBondContact O-CA 3.26Å; D263-R265 PolarHBondContact O-N 2.94Å; D263-R265 WeakPolarHBondContact OD1-CB 3.46Å; D263-R265 WeakPolarHBondContact OD1-CG 3.39Å; D263-R265 IonicContact OD1-CZ 2.87Å; D263-R265 PolarHBondContact OD1-N 2.99Å; D263-R265 IonicContact OD1-NE 3.46Å; D263-R265 PolarHBondContact OD1-NE 3.1Å; D263-R265 IonicContact OD1-NH2 3.69Å; D263-R265 IonicContact OD2-CZ 3.14Å; D263-R265 VanDerWaalsContact OD2-CZ 3.31Å; D263-R265 IonicContact OD2-NE 2.72Å; D263-R265 PolarHBondContact OD2-NE 2.89Å; D263-R265 VanDerWaalsContact OD2-NE 3.14Å; D263-R265 IonicContact OD2-NH2 2.68Å; D263-R265 PolarHBondContact OD2-NH2 2.82Å; D263-Q266 CarbonylContact O-C 3.46Å; D263-Q266 VanDerWaalsContact O-C 3.29Å; D263-Q266 WeakPolarHBondContact O-CA 3.48Å; D263-Q266 PolarHBondContact O-N 2.93Å
264	L	90.5	Very high	89.4	Confident	31 Å²	31	51.8 Å²	51.8	16%	0.162	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-24.9	-179.1	-72.3	171	0	0	0	113.3	Y192 F196 F216 S247 L248 V250 Q266	Y192-L264 HydrophobicContact CE1-CD1 4.4Å; Y192-L264 HydrophobicContact CE2-CD1 4.32Å; Y192-L264 WeakPolarHBondContact OH-CD1 3.35Å; F196-L264 HydrophobicContact CE1-CD2 3.63Å; F196-L264 HydrophobicContact CZ-CD1 4.05Å; F196-L264 HydrophobicContact CZ-CD2 3.65Å; F216-L264 HydrophobicContact CD2-CD2 4.45Å; F216-L264 HydrophobicContact CE1-CD2 4.14Å; F216-L264 HydrophobicContact CE2-CD2 3.89Å; F216-L264 HydrophobicContact CZ-CD2 3.71Å; S247-L264 WeakPolarHBondContact O-CD1 3.43Å; L248-L264 WeakPolarHBondContact O-CG 3.35Å; L248-L264 PolarHBondContact O-N 3.02Å; V250-L264 HydrophobicContact CG2-CD1 4.08Å; V250-L264 HydrophobicContact CG2-CD2 3.63Å; V250-L264 HydrophobicContact CG2-CG 3.72Å; L264-Q266 VanDerWaalsContact C-N 3.26Å; L264-Q266 PolarHBondContact O-N 3.37Å
265	R	90.6	Very high	89.2	Confident	176 Å²	176	54.5 Å²	54.5	66%	0.664	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-20.7	175.8	-59.9	173.2	-69.6	-177.3	0.4	112.3	L248 D263	L248-R265 HydrophobicContact CD2-CG 4.2Å; D263-R265 PolarHBondContact O-N 2.94Å; D263-R265 WeakPolarHBondContact OD1-CB 3.46Å; D263-R265 WeakPolarHBondContact OD1-CG 3.39Å; D263-R265 IonicContact OD1-CZ 2.87Å; D263-R265 PolarHBondContact OD1-N 2.99Å; D263-R265 IonicContact OD1-NE 3.46Å; D263-R265 PolarHBondContact OD1-NE 3.1Å; D263-R265 IonicContact OD1-NH2 3.69Å; D263-R265 IonicContact OD2-CZ 3.14Å; D263-R265 VanDerWaalsContact OD2-CZ 3.31Å; D263-R265 IonicContact OD2-NE 2.72Å; D263-R265 PolarHBondContact OD2-NE 2.89Å; D263-R265 VanDerWaalsContact OD2-NE 3.14Å; D263-R265 IonicContact OD2-NH2 2.68Å; D263-R265 PolarHBondContact OD2-NH2 2.82Å
266	Q	87.2	Confident	89.1	Confident	121 Å²	121	53.6 Å²	53.6	57%	0.565	24%	0.236	S	C	*	.			trans	-123.8	80.9	-177.7	-64.4	-172	-5	0	0	111	D263 L264 R268	D263-Q266 CarbonylContact O-C 3.46Å; D263-Q266 VanDerWaalsContact O-C 3.29Å; D263-Q266 WeakPolarHBondContact O-CA 3.48Å; D263-Q266 PolarHBondContact O-N 2.93Å; L264-Q266 VanDerWaalsContact C-N 3.26Å; L264-Q266 PolarHBondContact O-N 3.37Å; Q266-R268 VanDerWaalsContact C-N 3.3Å; Q266-R268 PolarHBondContact O-N 3.12Å
267	N	82.3	Confident	89.1	Confident	61 Å²	61	59.2 Å²	59.2	33%	0.326	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-3.4	-179.8	65.4	-12.3	0	0	0	115	F216 G217 L218	F216-N267 HydrophobicContact CE2-CB 4.02Å; F216-N267 HydrophobicContact CZ-CB 4.24Å; G217-N267 PolarHBondContact O-ND2 3.38Å; G217-N267 VanDerWaalsContact O-ND2 3.14Å; L218-N267 HydrophobicContact CD1-CB 4.07Å; L218-N267 VanDerWaalsContact CD1-O 3.24Å; L218-N267 WeakPolarHBondContact CD1-O 3.46Å
268	R	84.1	Confident	88.9	Confident	190 Å²	190	64.7 Å²	64.7	72%	0.717	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-17.5	-176.1	-68	-169.3	-178.8	-153.4	0.4	115.1	F223 Q266	F223-R268 WeakPolarHBondContact CB-O 3.4Å; F223-R268 HydrophobicContact CD1-CB 4.31Å; F223-R268 VanDerWaalsContact CD1-O 3.23Å; F223-R268 WeakPolarHBondContact CD1-O 3.5Å; F223-R268 HydrophobicContact CE1-CB 4.41Å; F223-R268 HydrophobicContact CE1-CG 4.35Å; F223-R268 VanDerWaalsContact CG-O 3.31Å; F223-R268 WeakPolarHBondContact CG-O 3.46Å; F223-R268 HydrophobicContact CZ-CG 4.45Å; Q266-R268 VanDerWaalsContact C-N 3.3Å; Q266-R268 PolarHBondContact O-N 3.12Å
269	K	86.1	Confident	88.6	Confident	153 Å²	153	70 Å²	70	67%	0.665	30%	0.303	S	S	*	.	S	Bend	trans	-147.7	130.4	-179.7	-172	178.6	176	179.6	0	108.7
270	P	89	Confident	88.4	Confident	11 Å²	11	72.1 Å²	72.1	7%	0.071	31%	0.313	C	S	.	.			trans	-63.4	138.9	172.6	27.3	-34.3	0	0	0	109.6	A224 Y260 I261 Y262 H272 V273	A224-P270 HydrophobicContact CB-CG 3.79Å; Y260-P270 HydrophobicContact CD1-CB 4.23Å; Y260-P270 HydrophobicContact CD1-CG 4.17Å; I261-P270 CarbonylContact O-C 3.48Å; I261-P270 WeakPolarHBondContact O-CA 3.37Å; Y262-P270 HydrophobicContact CD1-CB 4.1Å; Y262-P270 VanDerWaalsContact CE1-CA 3.45Å; Y262-P270 HydrophobicContact CE1-CB 3.66Å; Y262-P270 HydrophobicContact CE1-CG 4.28Å; Y262-P270 HydrophobicContact CE2-CB 4.36Å; P270-H272 VanDerWaalsContact C-N 3.34Å; P270-V273 HydrophobicContact CB-CG2 3.99Å; P270-V273 HydrophobicContact CG-CG2 3.42Å; P270-V273 VanDerWaalsContact CG-CG2 3.42Å
271	W	86.3	Confident	88.4	Confident	125 Å²	125	75 Å²	75	47%	0.473	33%	0.332	S	S	.	.	S	Bend	trans	-64.8	-43.6	172.6	-178.5	28.3	0	0	0	110.5	I261 V305	I261-W271 HydrophobicContact CG2-CE3 4.16Å; I261-W271 PolarHBondContact O-N 3.34Å; W271-V305 HydrophobicContact CE3-CG1 4.43Å; W271-V305 HydrophobicContact CH2-CG1 3.96Å; W271-V305 HydrophobicContact CZ3-CG1 3.75Å
272	H	88.3	Confident	88.4	Confident	32 Å²	32	74.9 Å²	74.9	15%	0.148	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	142.1	173.1	-69.4	-70.3	0	0	0	111.9	I261 P270 R274 V305	I261-H272 HydrophobicContact CB-CB 4.2Å; I261-H272 HydrophobicContact CD1-CB 4.13Å; I261-H272 HydrophobicContact CG1-CB 4.44Å; I261-H272 PolarHBondContact N-O 2.88Å; I261-H272 PolarHBondContact O-N 3.28Å; P270-H272 VanDerWaalsContact C-N 3.34Å; H272-R274 PolarHBondContact ND1-NH2 3.28Å; H272-V305 PolarHBondContact NE2-O 3.34Å
273	V	89.7	Confident	88.5	Confident	69 Å²	69	77.8 Å²	77.8	42%	0.418	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	129.7	172.2	-175.4	0	0	0	0	107.9	M258 Y260 P270	M258-V273 HydrophobicContact CE-CG1 3.78Å; Y260-V273 HydrophobicContact CD1-CB 4.35Å; Y260-V273 HydrophobicContact CD1-CG1 3.93Å; Y260-V273 HydrophobicContact CD1-CG2 3.92Å; Y260-V273 HydrophobicContact CE1-CB 4.45Å; Y260-V273 HydrophobicContact CE1-CG1 3.62Å; Y260-V273 HydrophobicContact CE1-CG2 4.14Å; P270-V273 HydrophobicContact CB-CG2 3.99Å; P270-V273 HydrophobicContact CG-CG2 3.42Å; P270-V273 VanDerWaalsContact CG-CG2 3.42Å
274	R	88.8	Confident	88.7	Confident	56 Å²	56	77.3 Å²	77.3	21%	0.211	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	128.3	176.3	-56.8	-65.7	166.1	-158.6	-9	110.2	M258 V259 H272 G308	M258-R274 WeakPolarHBondContact CA-O 3.15Å; V259-R274 HydrophobicContact CB-CB 4.27Å; V259-R274 PolarHBondContact N-O 3.44Å; V259-R274 PolarHBondContact O-N 3.16Å; H272-R274 PolarHBondContact ND1-NH2 3.28Å; R274-G308 VanDerWaalsContact NH1-CA 3.29Å; R274-G308 PolarHBondContact NH1-O 3.22Å
275	D	89	Confident	88.9	Confident	57 Å²	57	76 Å²	76	31%	0.305	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	135.1	169.6	-169.3	-8.7	0	0	0	109.2	M258 E277	M258-D275 HydrophobicContact CE-CB 3.99Å; M258-D275 HydrophobicContact SD-CB 3.64Å; M258-D275 VanDerWaalsContact SD-CG 3.5Å; D275-E277 VanDerWaalsContact C-N 3.34Å; D275-E277 PolarHBondContact OD1-N 3.19Å
276	T	88.6	Confident	89.2	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	32%	0.315	C	S	.	.			trans	-83	-11.3	173.5	56.4	0	0	0	0	113.3	G257 V259 Y278 M296 K301 W303	G257-T276 WeakPolarHBondContact CA-OG1 3.26Å; G257-T276 WeakPolarHBondContact O-CB 3.27Å; G257-T276 VanDerWaalsContact O-CG2 3.23Å; G257-T276 WeakPolarHBondContact O-CG2 3.32Å; G257-T276 PolarHBondContact O-N 2.9Å; G257-T276 VanDerWaalsContact O-N 3.15Å; G257-T276 PolarHBondContact O-OG1 2.87Å; V259-T276 HydrophobicContact CG2-CG2 4.49Å; T276-Y278 VanDerWaalsContact O-CD2 3.26Å; T276-Y278 WeakPolarHBondContact O-CD2 3.32Å; T276-Y278 PolarHBondContact O-N 3Å; T276-M296 WeakPolarHBondContact CB-SD 3.25Å; T276-M296 HydrophobicContact CG2-CE 4.02Å; T276-M296 HydrophobicContact CG2-CG 4.31Å; T276-M296 HydrophobicContact CG2-SD 3.67Å; T276-K301 PolarHBondContact O-NZ 3.21Å; T276-W303 HydrophobicContact CG2-CH2 3.71Å; T276-W303 HydrophobicContact CG2-CZ2 4.13Å
277	E	86.5	Confident	89.5	Confident	126 Å²	126	65.6 Å²	65.6	59%	0.589	29%	0.294	S	S	*	.	S	Bend	trans	69.3	-25.9	-176.5	-52.9	157	178.8	0	0	114.6	D275 R279 K301	D275-E277 VanDerWaalsContact C-N 3.34Å; D275-E277 PolarHBondContact OD1-N 3.19Å; E277-R279 VanDerWaalsContact C-N 3.33Å; E277-R279 PolarHBondContact O-N 2.85Å; E277-K301 VanDerWaalsContact CD-NZ 3.3Å; E277-K301 IonicContact OE1-NZ 3.72Å; E277-K301 IonicContact OE2-NZ 3.73Å; E277-K301 PolarHBondContact OE2-NZ 3.3Å
278	Y	84.8	Confident	90	Very high	116 Å²	116	63 Å²	63	46%	0.455	28%	0.28	S	S	.	.	S	Bend	trans	-77.9	-16.9	-178.2	-69.3	-74	0	0	0	113.8	T276 E280 M296 C299 K301	T276-Y278 VanDerWaalsContact O-CD2 3.26Å; T276-Y278 WeakPolarHBondContact O-CD2 3.32Å; T276-Y278 PolarHBondContact O-N 3Å; Y278-E280 PolarHBondContact O-N 3.41Å; Y278-M296 HydrophobicContact CD2-CE 3.98Å; Y278-M296 HydrophobicContact CD2-SD 3.65Å; Y278-M296 HydrophobicContact CE2-CE 4.43Å; Y278-M296 HydrophobicContact CG-SD 4.22Å; Y278-C299 HydrophobicContact CD2-CB 4.21Å; Y278-C299 HydrophobicContact CE2-CB 3.84Å; Y278-C299 VanDerWaalsContact CE2-SG 3.58Å; Y278-K301 HydrophobicContact CE2-CD 4.5Å
279	R	84.8	Confident	90.2	Very high	115 Å²	115	58.4 Å²	58.4	43%	0.434	27%	0.269	S	S	.	.			trans	55	35	178.9	-52.7	-177.1	175.8	-172.2	-3.5	113.7	R235 D256 E277	R235-R279 PolarHBondContact NH1-O 2.89Å; D256-R279 WeakPolarHBondContact O-CA 3.46Å; E277-R279 VanDerWaalsContact C-N 3.33Å; E277-R279 PolarHBondContact O-N 2.85Å
280	E	88.8	Confident	90.4	Very high	46 Å²	46	54.6 Å²	54.6	22%	0.215	26%	0.256	C	S	.	.			trans	-109.5	151.8	176.6	-73.3	-165.5	146.3	0	0	110.5	G257 Y278 I282 R297	G257-E280 WeakPolarHBondContact CA-O 3.08Å; G257-E280 PolarHBondContact N-O 3.46Å; Y278-E280 PolarHBondContact O-N 3.41Å; E280-I282 PolarHBondContact O-N 3.21Å; E280-R297 WeakPolarHBondContact OE2-CB 3.47Å
281	P	92.1	Very high	90.6	Very high	62 Å²	62	56.2 Å²	56.2	40%	0.403	26%	0.262	S	S	.	.			trans	-61.9	132.7	179.6	26.2	-35.5	0	0	0	111.2	T240 G255 K283	T240-P281 HydrophobicContact CG2-CB 4.13Å; G255-P281 VanDerWaalsContact O-CA 3.32Å; G255-P281 WeakPolarHBondContact O-CA 3.24Å; P281-K283 PolarHBondContact O-N 2.92Å
282	I	94.4	Very high	91	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.005	24%	0.24	C	C	.	.			trans	-74.2	123.7	175.5	-58.5	151.3	0	0	0	107.8	T240 C241 T254 M258 V259 E280 I285	T240-I282 WeakPolarHBondContact CB-O 3.28Å; T240-I282 PolarHBondContact OG1-O 3.35Å; C241-I282 WeakPolarHBondContact SG-CG2 3.34Å; C241-I282 PolarHBondContact SG-O 2.77Å; C241-I282 VanDerWaalsContact SG-O 3.42Å; T254-I282 PolarHBondContact O-N 2.89Å; M258-I282 VanDerWaalsContact C-CD1 3.45Å; M258-I282 WeakPolarHBondContact O-CD1 3.15Å; V259-I282 HydrophobicContact CB-CD1 4.43Å; V259-I282 HydrophobicContact CG2-CD1 3.45Å; V259-I282 VanDerWaalsContact CG2-CD1 3.45Å; V259-I282 HydrophobicContact CG2-CG1 4.37Å; E280-I282 PolarHBondContact O-N 3.21Å; I282-I285 HydrophobicContact CG2-CD1 4.17Å; I282-I285 HydrophobicContact CG2-CG1 3.68Å
283	K	94.6	Very high	91.4	Very high	64 Å²	64	48.8 Å²	48.8	28%	0.278	23%	0.233	S	C	.	.			trans	-86.5	-37.8	-177.5	-71.6	-173.2	172.8	-167.2	0	112	P281 A295 C321	P281-K283 PolarHBondContact O-N 2.92Å; K283-A295 PolarHBondContact N-O 3.18Å; K283-C321 WeakPolarHBondContact CD-O 3.15Å; K283-C321 WeakPolarHBondContact CE-O 3.15Å; K283-C321 PolarHBondContact NZ-O 3.3Å
284	S	95.3	Very high	91.7	Very high	11 Å²	11	45.5 Å²	45.5	8%	0.077	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	143.4	180	49.4	0	0	0	0	111.6	A295 M324	S284-A295 PolarHBondContact O-N 2.76Å; S284-A295 WeakPolarHBondContact OG-CB 3.4Å; S284-M324 WeakPolarHBondContact OG-CB 3.34Å; S284-M324 PolarHBondContact OG-N 2.71Å; S284-M324 VanDerWaalsContact OG-N 3.11Å
285	I	96	Very high	92	Very high	5 Å²	5	42.9 Å²	42.9	3%	0.026	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	136.8	175.2	-59.1	169.3	0	0	0	107.6	C241 S243 A251 G253 V259 I282 V292 L293 T294	C241-I285 VanDerWaalsContact SG-CD1 3.57Å; C241-I285 VanDerWaalsContact SG-CG1 3.57Å; S243-I285 VanDerWaalsContact CB-O 3.23Å; S243-I285 WeakPolarHBondContact CB-O 3.15Å; S243-I285 PolarHBondContact OG-O 2.76Å; A251-I285 HydrophobicContact CB-CD1 4.33Å; A251-I285 HydrophobicContact CB-CG2 3.74Å; G253-I285 VanDerWaalsContact CA-CD1 3.49Å; G253-I285 VanDerWaalsContact N-CD1 3.3Å; V259-I285 HydrophobicContact CG1-CD1 4.11Å; I282-I285 HydrophobicContact CG2-CD1 4.17Å; I282-I285 HydrophobicContact CG2-CG1 3.68Å; I285-V292 HydrophobicContact CG2-CG1 3.67Å; I285-L293 WeakPolarHBondContact CA-O 3.46Å; I285-T294 HydrophobicContact CB-CG2 4.42Å; I285-T294 HydrophobicContact CG1-CG2 3.87Å; I285-T294 HydrophobicContact CG2-CG2 4.17Å
286	H	95.5	Very high	92.2	Very high	51 Å²	51	40.1 Å²	40.1	24%	0.236	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	149.2	171.6	-71.1	-74.1	0	0	0	109.7	L293 M324 H326	H286-L293 HydrophobicContact CB-CB 4.37Å; H286-L293 HydrophobicContact CB-CD1 4.24Å; H286-L293 PolarHBondContact N-O 3.41Å; H286-L293 WeakPolarHBondContact O-CB 2.91Å; H286-L293 PolarHBondContact O-N 3.48Å; H286-M324 HydrophobicContact CB-CE 4.25Å; H286-M324 PolarHBondContact NE2-O 3.18Å; H286-H326 HydrophobicContact CB-CB 3.98Å
287	F	94.2	Very high	92.4	Very high	26 Å²	26	44.6 Å²	44.6	11%	0.114	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	143.2	171.5	-71.7	-86.7	0	0	0	110.4	K245 A251 V292 V305	K245-F287 HydrophobicContact CB-CB 3.99Å; K245-F287 HydrophobicContact CB-CD1 3.64Å; K245-F287 HydrophobicContact CB-CD2 3.65Å; K245-F287 HydrophobicContact CB-CE1 3.87Å; K245-F287 HydrophobicContact CB-CE2 3.88Å; K245-F287 HydrophobicContact CB-CG 3.5Å; K245-F287 VanDerWaalsContact CB-CG 3.5Å; K245-F287 HydrophobicContact CB-CZ 3.95Å; K245-F287 HydrophobicContact CD-CD1 4.12Å; K245-F287 HydrophobicContact CD-CE1 4.39Å; K245-F287 HydrophobicContact CG-CB 3.98Å; K245-F287 HydrophobicContact CG-CD1 3.85Å; K245-F287 HydrophobicContact CG-CE1 4.38Å; K245-F287 HydrophobicContact CG-CG 3.9Å; A251-F287 HydrophobicContact CB-CE1 4.42Å; A251-F287 HydrophobicContact CB-CE2 3.46Å; A251-F287 VanDerWaalsContact CB-CE2 3.46Å; A251-F287 HydrophobicContact CB-CZ 3.34Å; F287-V292 HydrophobicContact CD1-CG2 3.73Å; F287-V292 HydrophobicContact CE1-CB 4.45Å; F287-V292 HydrophobicContact CE1-CG1 4.42Å; F287-V292 HydrophobicContact CE1-CG2 3.43Å; F287-V292 VanDerWaalsContact CE1-CG2 3.43Å; F287-V292 HydrophobicContact CZ-CG2 4.38Å; F287-V305 HydrophobicContact CE1-CG2 4.48Å
288	H	92.8	Very high	92.7	Very high	7 Å²	7	42.6 Å²	42.6	3%	0.032	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	104.2	168.8	-179.5	80.4	0	0	0	108	D290 K291 L293 H326 L350	H288-D290 PolarHBondContact O-N 3.44Å; H288-K291 PolarHBondContact N-O 2.86Å; H288-K291 WeakPolarHBondContact O-CA 3.39Å; H288-K291 WeakPolarHBondContact O-CB 3.26Å; H288-K291 PolarHBondContact O-N 3.39Å; H288-L293 HydrophobicContact CB-CD1 3.69Å; H288-H326 AromaticContact CG-CE1 3.74Å; H288-H326 AromaticContact CG-NE2 3.77Å; H288-H326 AromaticContact ND1-CE1 3.2Å; H288-H326 PolarHBondContact ND1-CE1 3.15Å; H288-H326 AromaticContact ND1-NE2 3.32Å; H288-H326 PolarHBondContact ND1-NE2 3.08Å; H288-L350 HydrophobicContact CB-CD1 4.32Å; H288-L350 WeakPolarHBondContact CD2-CD1 3.48Å; H288-L350 PolarHBondContact NE2-O 3.23Å
289	D	88.8	Confident	93.1	Very high	93 Å²	93	37.2 Å²	37.2	50%	0.497	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.5	-122.3	-169.1	-52.4	-36.6	0	0	0	110.4	K245 K291	K245-D289 WeakPolarHBondContact CE-O 3.4Å; D289-K291 VanDerWaalsContact C-N 3.26Å; D289-K291 PolarHBondContact O-N 3.06Å
290	D	90.9	Very high	93.6	Very high	74 Å²	74	31.8 Å²	31.8	40%	0.396	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	23.6	178.7	-52.8	-44.1	0	0	0	113.3	K245 H288 S304 V305	K245-D290 IonicContact NZ-OD1 2.62Å; K245-D290 PolarHBondContact NZ-OD1 3.4Å; K245-D290 VanDerWaalsContact NZ-OD1 3.14Å; H288-D290 PolarHBondContact O-N 3.44Å; D290-S304 CarbonylContact O-C 3.5Å; D290-S304 WeakPolarHBondContact O-CA 3.31Å; D290-V305 WeakPolarHBondContact O-CG2 3.42Å; D290-V305 PolarHBondContact O-N 2.81Å
291	K	93.2	Very high	93.8	Very high	44 Å²	44	30.2 Å²	30.2	19%	0.191	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	140	177.1	-57.4	176.1	-164.2	67.3	0	111.1	H288 D289 W303 F311 L350	H288-K291 PolarHBondContact N-O 2.86Å; H288-K291 WeakPolarHBondContact O-CA 3.39Å; H288-K291 WeakPolarHBondContact O-CB 3.26Å; H288-K291 PolarHBondContact O-N 3.39Å; D289-K291 VanDerWaalsContact C-N 3.26Å; D289-K291 PolarHBondContact O-N 3.06Å; K291-W303 CarbonylContact C-O 3.29Å; K291-W303 WeakPolarHBondContact CA-O 3.45Å; K291-F311 HydrophobicContact CD-CD1 4.18Å; K291-F311 HydrophobicContact CD-CE1 4.34Å; K291-F311 HydrophobicContact CD-CG 4.31Å; K291-L350 HydrophobicContact CD-CD1 3.64Å
292	V	94.9	Very high	93.9	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.012	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	120.7	173.8	-170.5	0	0	0	0	108.6	V259 I261 I285 F287 T294 M302 W303 V305	V259-V292 HydrophobicContact CG1-CG1 4.49Å; I261-V292 HydrophobicContact CD1-CG2 3.67Å; I285-V292 HydrophobicContact CG2-CG1 3.67Å; F287-V292 HydrophobicContact CD1-CG2 3.73Å; F287-V292 HydrophobicContact CE1-CB 4.45Å; F287-V292 HydrophobicContact CE1-CG1 4.42Å; F287-V292 HydrophobicContact CE1-CG2 3.43Å; F287-V292 VanDerWaalsContact CE1-CG2 3.43Å; F287-V292 HydrophobicContact CZ-CG2 4.38Å; V292-T294 HydrophobicContact CG1-CG2 4.04Å; V292-M302 VanDerWaalsContact O-CA 3.28Å; V292-M302 WeakPolarHBondContact O-CA 3.44Å; V292-W303 HydrophobicContact CB-CE3 4.45Å; V292-W303 PolarHBondContact N-O 2.94Å; V292-W303 PolarHBondContact O-N 3.41Å; V292-V305 HydrophobicContact CG2-CG2 3.49Å; V292-V305 VanDerWaalsContact CG2-CG2 3.49Å
293	L	95.8	Very high	93.9	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	131.2	173.2	-63.9	127.2	0	0	0	109.1	I285 H286 H288 M302 M324 L333 L350	I285-L293 WeakPolarHBondContact CA-O 3.46Å; H286-L293 HydrophobicContact CB-CB 4.37Å; H286-L293 HydrophobicContact CB-CD1 4.24Å; H286-L293 PolarHBondContact N-O 3.41Å; H286-L293 WeakPolarHBondContact O-CB 2.91Å; H286-L293 PolarHBondContact O-N 3.48Å; H288-L293 HydrophobicContact CB-CD1 3.69Å; L293-M302 HydrophobicContact CD2-CE 3.29Å; L293-M302 HydrophobicContact CD2-CG 3.81Å; L293-M302 HydrophobicContact CD2-SD 3.62Å; L293-M302 HydrophobicContact CG-CE 3.78Å; L293-M302 HydrophobicContact CG-CG 4.29Å; L293-M324 HydrophobicContact CB-CE 3.65Å; L293-L333 HydrophobicContact CD2-CD1 3.84Å; L293-L333 HydrophobicContact CD2-CD2 3.7Å; L293-L333 HydrophobicContact CD2-CG 4.38Å; L293-L350 HydrophobicContact CD2-CD2 4.28Å
294	T	95.7	Very high	93.8	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	133.3	175.9	60.7	0	0	0	0	111.7	V259 I285 V292 C300 K301 W303	V259-T294 HydrophobicContact CG1-CG2 4.45Å; V259-T294 HydrophobicContact CG2-CG2 3.8Å; I285-T294 HydrophobicContact CB-CG2 4.42Å; I285-T294 HydrophobicContact CG1-CG2 3.87Å; I285-T294 HydrophobicContact CG2-CG2 4.17Å; V292-T294 HydrophobicContact CG1-CG2 4.04Å; T294-C300 CarbonylContact O-C 3.58Å; T294-C300 VanDerWaalsContact O-CA 3.27Å; T294-C300 WeakPolarHBondContact O-CA 3.25Å; T294-C300 PolarHBondContact O-SG 2.72Å; T294-K301 PolarHBondContact N-O 2.96Å; T294-K301 PolarHBondContact O-N 3.43Å; T294-K301 PolarHBondContact OG1-O 3.01Å; T294-K301 VanDerWaalsContact OG1-O 3.06Å; T294-W303 HydrophobicContact CG2-CE3 4.29Å; T294-W303 HydrophobicContact CG2-CH2 4.12Å; T294-W303 HydrophobicContact CG2-CZ3 3.37Å; T294-W303 WeakPolarHBondContact OG1-CH2 3.21Å; T294-W303 WeakPolarHBondContact OG1-CZ3 3.46Å
295	A	95.5	Very high	93.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	127.8	175.3	0	0	0	0	0	110	K283 S284 M324 F335	K283-A295 PolarHBondContact N-O 3.18Å; S284-A295 PolarHBondContact O-N 2.76Å; S284-A295 WeakPolarHBondContact OG-CB 3.4Å; A295-M324 HydrophobicContact CB-CB 3.7Å; A295-M324 HydrophobicContact CB-CE 4.28Å; A295-M324 HydrophobicContact CB-CG 4.41Å; A295-M324 HydrophobicContact CB-SD 3.94Å; A295-F335 HydrophobicContact CB-CD1 4.45Å; A295-F335 HydrophobicContact CB-CE1 4.1Å
296	M	93.7	Very high	93.2	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.143	C	C	.	.			trans	-103.6	-165.4	169.5	-64	162.4	-90.6	0	0	108.7	T276 Y278 C299 K301	T276-M296 WeakPolarHBondContact CB-SD 3.25Å; T276-M296 HydrophobicContact CG2-CE 4.02Å; T276-M296 HydrophobicContact CG2-CG 4.31Å; T276-M296 HydrophobicContact CG2-SD 3.67Å; Y278-M296 HydrophobicContact CD2-CE 3.98Å; Y278-M296 HydrophobicContact CD2-SD 3.65Å; Y278-M296 HydrophobicContact CE2-CE 4.43Å; Y278-M296 HydrophobicContact CG-SD 4.22Å; M296-C299 WeakPolarHBondContact CB-O 3.4Å; M296-C299 HydrophobicContact CE-CB 3.79Å; M296-C299 PolarHBondContact N-O 2.88Å; M296-K301 HydrophobicContact CE-CB 4.06Å; M296-K301 HydrophobicContact CE-CD 4.04Å; M296-K301 HydrophobicContact CE-CG 3.88Å
297	R	92.5	Very high	92.8	Very high	93 Å²	93	31.7 Å²	31.7	35%	0.351	16%	0.158	S	C	.	.	S	Bend	trans	-65.4	-44	-179.7	-164	176	-176.5	167.9	1.4	112.7	E280 E320 C321	E280-R297 WeakPolarHBondContact OE2-CB 3.47Å; R297-E320 HydrophobicContact CG-CB 4Å; R297-E320 HydrophobicContact CG-CG 3.9Å; R297-E320 IonicContact CZ-OE1 3.92Å; R297-E320 VanDerWaalsContact CZ-OE1 3.26Å; R297-E320 IonicContact CZ-OE2 2.63Å; R297-E320 VanDerWaalsContact CZ-OE2 3.26Å; R297-E320 IonicContact NE-OE1 3.85Å; R297-E320 PolarHBondContact NE-OE1 3.32Å; R297-E320 VanDerWaalsContact NE-OE1 3.16Å; R297-E320 IonicContact NE-OE2 3.26Å; R297-E320 PolarHBondContact NE-OE2 3.21Å; R297-E320 IonicContact NH2-OE1 2.68Å; R297-E320 PolarHBondContact NH2-OE1 2.83Å; R297-E320 IonicContact NH2-OE2 3.16Å; R297-E320 PolarHBondContact NH2-OE2 2.86Å; R297-C321 WeakPolarHBondContact O-CB 3.47Å; R297-C321 PolarHBondContact O-N 3.01Å
298	Y	92.9	Very high	92.3	Very high	84 Å²	84	31 Å²	31	33%	0.329	16%	0.158	S	C	.	.	S	Bend	trans	-127.6	-0.4	-176	-55.8	-69.2	0	0	0	114.3	N315 I316 E320	Y298-N315 CarbonylContact O-C 3.57Å; Y298-N315 VanDerWaalsContact O-CA 3.31Å; Y298-N315 WeakPolarHBondContact O-CA 3.44Å; Y298-I316 PolarHBondContact O-N 2.79Å; Y298-E320 HydrophobicContact CE1-CB 4.35Å; Y298-E320 HydrophobicContact CE1-CG 3.57Å; Y298-E320 WeakPolarHBondContact OH-CG 3.15Å; Y298-E320 PolarHBondContact OH-OE1 2.85Å
299	C	93.2	Very high	92.2	Very high	4 Å²	4	38 Å²	38	3%	0.027	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	143.4	-174.4	-169.8	0	0	0	0	111	Y278 M296 F314	Y278-C299 HydrophobicContact CD2-CB 4.21Å; Y278-C299 HydrophobicContact CE2-CB 3.84Å; Y278-C299 VanDerWaalsContact CE2-SG 3.58Å; M296-C299 WeakPolarHBondContact CB-O 3.4Å; M296-C299 HydrophobicContact CE-CB 3.79Å; M296-C299 PolarHBondContact N-O 2.88Å; C299-F314 WeakPolarHBondContact CA-O 3.48Å; C299-F314 PolarHBondContact SG-O 2.86Å
300	C	94.4	Very high	92.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	125.3	166.3	-172	0	0	0	0	108.3	T294 G313 F314 I316 F335	T294-C300 CarbonylContact O-C 3.58Å; T294-C300 VanDerWaalsContact O-CA 3.27Å; T294-C300 WeakPolarHBondContact O-CA 3.25Å; T294-C300 PolarHBondContact O-SG 2.72Å; C300-G313 CarbonylContact O-C 3.54Å; C300-G313 VanDerWaalsContact O-CA 3.24Å; C300-G313 WeakPolarHBondContact O-CA 3.12Å; C300-F314 HydrophobicContact CB-CD1 4.43Å; C300-F314 HydrophobicContact CB-CE1 3.96Å; C300-F314 HydrophobicContact CB-CE2 4.11Å; C300-F314 HydrophobicContact CB-CZ 3.79Å; C300-F314 PolarHBondContact N-O 2.93Å; C300-F314 PolarHBondContact O-N 2.83Å; C300-I316 HydrophobicContact CB-CD1 3.94Å; C300-I316 HydrophobicContact CB-CG1 4Å; C300-F335 HydrophobicContact CB-CE1 4.05Å; C300-F335 HydrophobicContact CB-CZ 3.82Å
301	K	93.6	Very high	92.2	Very high	13 Å²	13	35.3 Å²	35.3	6%	0.057	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	141.8	174.3	-80.6	-175	168.1	176.6	0	110.4	T276 E277 Y278 T294 M296 W303	T276-K301 PolarHBondContact O-NZ 3.21Å; E277-K301 VanDerWaalsContact CD-NZ 3.3Å; E277-K301 IonicContact OE1-NZ 3.72Å; E277-K301 IonicContact OE2-NZ 3.73Å; E277-K301 PolarHBondContact OE2-NZ 3.3Å; Y278-K301 HydrophobicContact CE2-CD 4.5Å; T294-K301 PolarHBondContact N-O 2.96Å; T294-K301 PolarHBondContact O-N 3.43Å; T294-K301 PolarHBondContact OG1-O 3.01Å; T294-K301 VanDerWaalsContact OG1-O 3.06Å; M296-K301 HydrophobicContact CE-CB 4.06Å; M296-K301 HydrophobicContact CE-CD 4.04Å; M296-K301 HydrophobicContact CE-CG 3.88Å; K301-W303 HydrophobicContact CB-CH2 3.91Å; K301-W303 HydrophobicContact CB-CZ2 3.62Å; K301-W303 HydrophobicContact CD-CZ2 3.95Å; K301-W303 HydrophobicContact CG-CZ2 4.42Å
302	M	94.9	Very high	92.2	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	130	-179.6	-56.1	-179.5	62.6	0	0	109.5	V292 L293 F311 V312 I347 L350	V292-M302 VanDerWaalsContact O-CA 3.28Å; V292-M302 WeakPolarHBondContact O-CA 3.44Å; L293-M302 HydrophobicContact CD2-CE 3.29Å; L293-M302 HydrophobicContact CD2-CG 3.81Å; L293-M302 HydrophobicContact CD2-SD 3.62Å; L293-M302 HydrophobicContact CG-CE 3.78Å; L293-M302 HydrophobicContact CG-CG 4.29Å; M302-F311 HydrophobicContact CB-CB 4.3Å; M302-F311 HydrophobicContact CB-CD1 4.45Å; M302-F311 HydrophobicContact CE-CD1 4.21Å; M302-F311 PolarHBondContact O-N 3.16Å; M302-F311 HydrophobicContact SD-CD1 4.48Å; M302-V312 WeakPolarHBondContact CB-O 3.49Å; M302-V312 PolarHBondContact N-O 2.94Å; M302-V312 PolarHBondContact O-N 2.76Å; M302-V312 HydrophobicContact SD-CB 4.42Å; M302-I347 HydrophobicContact SD-CD1 3.59Å; M302-I347 VanDerWaalsContact SD-CD1 3.59Å; M302-L350 HydrophobicContact CE-CD1 3.35Å; M302-L350 HydrophobicContact CE-CD2 3.65Å; M302-L350 HydrophobicContact CE-CG 4.05Å
303	W	93.3	Very high	92	Very high	9 Å²	9	33.8 Å²	33.8	3%	0.034	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	149.5	175.8	-53.6	-89.1	0	0	0	110.6	V259 T276 K291 V292 T294 K301 K309	V259-W303 HydrophobicContact CG2-CH2 4.06Å; V259-W303 HydrophobicContact CG2-CZ3 3.94Å; T276-W303 HydrophobicContact CG2-CH2 3.71Å; T276-W303 HydrophobicContact CG2-CZ2 4.13Å; K291-W303 CarbonylContact C-O 3.29Å; K291-W303 WeakPolarHBondContact CA-O 3.45Å; V292-W303 HydrophobicContact CB-CE3 4.45Å; V292-W303 PolarHBondContact N-O 2.94Å; V292-W303 PolarHBondContact O-N 3.41Å; T294-W303 HydrophobicContact CG2-CE3 4.29Å; T294-W303 HydrophobicContact CG2-CH2 4.12Å; T294-W303 HydrophobicContact CG2-CZ3 3.37Å; T294-W303 WeakPolarHBondContact OG1-CH2 3.21Å; T294-W303 WeakPolarHBondContact OG1-CZ3 3.46Å; K301-W303 HydrophobicContact CB-CH2 3.91Å; K301-W303 HydrophobicContact CB-CZ2 3.62Å; K301-W303 HydrophobicContact CD-CZ2 3.95Å; K301-W303 HydrophobicContact CG-CZ2 4.42Å; W303-K309 WeakPolarHBondContact CA-O 3.27Å
304	S	93.5	Very high	91.9	Very high	25 Å²	25	34.1 Å²	34.1	18%	0.175	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	134	161.1	161.1	0	0	0	0	109	D290 T307 G308 K309	D290-S304 CarbonylContact O-C 3.5Å; D290-S304 WeakPolarHBondContact O-CA 3.31Å; S304-T307 VanDerWaalsContact CB-OG1 3.26Å; S304-T307 WeakPolarHBondContact CB-OG1 3.19Å; S304-T307 PolarHBondContact OG-OG1 3.2Å; S304-G308 WeakPolarHBondContact O-CA 3.29Å; S304-G308 PolarHBondContact O-N 3.37Å; S304-K309 PolarHBondContact N-O 2.92Å; S304-K309 VanDerWaalsContact N-O 3.14Å
305	V	89.8	Confident	91.6	Very high	5 Å²	5	39.3 Å²	39.3	3%	0.03	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-55.7	179.8	177.3	0	0	0	0	109.6	I261 W271 H272 F287 D290 V292 T307	I261-V305 HydrophobicContact CD1-CG1 4.3Å; I261-V305 HydrophobicContact CD1-CG2 4.33Å; W271-V305 HydrophobicContact CE3-CG1 4.43Å; W271-V305 HydrophobicContact CH2-CG1 3.96Å; W271-V305 HydrophobicContact CZ3-CG1 3.75Å; H272-V305 PolarHBondContact NE2-O 3.34Å; F287-V305 HydrophobicContact CE1-CG2 4.48Å; D290-V305 WeakPolarHBondContact O-CG2 3.42Å; D290-V305 PolarHBondContact O-N 2.81Å; V292-V305 HydrophobicContact CG2-CG2 3.49Å; V292-V305 VanDerWaalsContact CG2-CG2 3.49Å; V305-T307 PolarHBondContact O-N 2.77Å
306	D	88.2	Confident	91.2	Very high	99 Å²	99	39.4 Å²	39.4	53%	0.529	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-47.8	-173	-50.7	-30	0	0	0	112.9
307	T	87.1	Confident	90.6	Very high	87 Å²	87	41 Å²	41	53%	0.534	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-26.7	-174.1	63.1	0	0	0	0	112.5	S304 V305 K309	S304-T307 VanDerWaalsContact CB-OG1 3.26Å; S304-T307 WeakPolarHBondContact CB-OG1 3.19Å; S304-T307 PolarHBondContact OG-OG1 3.2Å; V305-T307 PolarHBondContact O-N 2.77Å; T307-K309 PolarHBondContact O-N 3.26Å; T307-K309 PolarHBondContact OG1-N 2.53Å
308	G	84.4	Confident	90.3	Very high	11 Å²	11	42.3 Å²	42.3	11%	0.113	24%	0.235	C	C	.	.			trans	71.7	0.3	-171.8	0	0	0	0	0	116.8	R274 S304	R274-G308 VanDerWaalsContact NH1-CA 3.29Å; R274-G308 PolarHBondContact NH1-O 3.22Å; S304-G308 WeakPolarHBondContact O-CA 3.29Å; S304-G308 PolarHBondContact O-N 3.37Å
309	K	89.6	Confident	90.1	Very high	154 Å²	154	40 Å²	40	67%	0.67	23%	0.231	S	C	*	.			trans	-71.1	140.8	-179.9	-67	-177.7	-179.2	178.5	0	109	W303 S304 T307 F311	W303-K309 WeakPolarHBondContact CA-O 3.27Å; S304-K309 PolarHBondContact N-O 2.92Å; S304-K309 VanDerWaalsContact N-O 3.14Å; T307-K309 PolarHBondContact O-N 3.26Å; T307-K309 PolarHBondContact OG1-N 2.53Å; K309-F311 PolarHBondContact O-N 2.89Å; K309-F311 VanDerWaalsContact O-N 3.16Å
310	I	90.2	Very high	90.1	Very high	67 Å²	67	41.8 Å²	41.8	34%	0.344	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	115.3	172.1	-56	173.2	0	0	0	107
311	F	90.9	Very high	90.1	Very high	44 Å²	44	41.8 Å²	41.8	19%	0.193	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	-58.3	174.7	-178.6	-111.4	0	0	0	109.1	V9 K291 M302 K309 L349	V9-F311 HydrophobicContact CG1-CE1 4.42Å; V9-F311 HydrophobicContact CG1-CZ 4.48Å; V9-F311 HydrophobicContact CG2-CE2 4.43Å; V9-F311 HydrophobicContact CG2-CZ 4.4Å; K291-F311 HydrophobicContact CD-CD1 4.18Å; K291-F311 HydrophobicContact CD-CE1 4.34Å; K291-F311 HydrophobicContact CD-CG 4.31Å; M302-F311 HydrophobicContact CB-CB 4.3Å; M302-F311 HydrophobicContact CB-CD1 4.45Å; M302-F311 HydrophobicContact CE-CD1 4.21Å; M302-F311 PolarHBondContact O-N 3.16Å; M302-F311 HydrophobicContact SD-CD1 4.48Å; K309-F311 PolarHBondContact O-N 2.89Å; K309-F311 VanDerWaalsContact O-N 3.16Å; F311-L349 HydrophobicContact CE2-CD2 3.83Å; F311-L349 HydrophobicContact CE2-CG 4.41Å; F311-L349 HydrophobicContact CZ-CB 4.13Å; F311-L349 HydrophobicContact CZ-CD2 3.59Å; F311-L349 HydrophobicContact CZ-CG 3.86Å
312	V	92.6	Very high	90.1	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	140.8	179	178.5	0	0	0	0	109.2	V9 V11 M302 F314	V9-V312 HydrophobicContact CB-CG2 3.4Å; V9-V312 HydrophobicContact CG1-CG2 3.52Å; V9-V312 HydrophobicContact CG2-CG2 3.59Å; V11-V312 HydrophobicContact CG2-CG1 3.53Å; M302-V312 WeakPolarHBondContact CB-O 3.49Å; M302-V312 PolarHBondContact N-O 2.94Å; M302-V312 PolarHBondContact O-N 2.76Å; M302-V312 HydrophobicContact SD-CB 4.42Å; V312-F314 HydrophobicContact CG1-CD1 3.99Å
313	G	91.3	Very high	90.1	Very high	15 Å²	15	43 Å²	43	16%	0.155	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	132.9	164.2	0	0	0	0	0	109.5	I6 C300	I6-G313 WeakPolarHBondContact CD1-O 3.05Å; C300-G313 CarbonylContact O-C 3.54Å; C300-G313 VanDerWaalsContact O-CA 3.24Å; C300-G313 WeakPolarHBondContact O-CA 3.12Å
314	F	92.1	Very high	90.3	Very high	7 Å²	7	42.7 Å²	42.7	3%	0.031	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	156.6	177.7	65.3	-90	0	0	0	111.7	I6 V11 C299 C300 V312 I316 L333 F335 Y345 I347	I6-F314 HydrophobicContact CD1-CB 3.98Å; V11-F314 HydrophobicContact CG1-CD1 4.02Å; V11-F314 HydrophobicContact CG1-CD2 4.43Å; V11-F314 HydrophobicContact CG1-CE1 4.14Å; V11-F314 HydrophobicContact CG1-CG 4.17Å; V11-F314 HydrophobicContact CG1-CZ 4.4Å; V11-F314 HydrophobicContact CG2-CD1 4.11Å; C299-F314 WeakPolarHBondContact CA-O 3.48Å; C299-F314 PolarHBondContact SG-O 2.86Å; C300-F314 HydrophobicContact CB-CD1 4.43Å; C300-F314 HydrophobicContact CB-CE1 3.96Å; C300-F314 HydrophobicContact CB-CE2 4.11Å; C300-F314 HydrophobicContact CB-CZ 3.79Å; C300-F314 PolarHBondContact N-O 2.93Å; C300-F314 PolarHBondContact O-N 2.83Å; V312-F314 HydrophobicContact CG1-CD1 3.99Å; F314-I316 HydrophobicContact CE2-CG1 4.39Å; F314-L333 HydrophobicContact CZ-CD1 4.34Å; F314-F335 HydrophobicContact CE2-CE2 4.09Å; F314-F335 HydrophobicContact CE2-CZ 4.25Å; F314-F335 AromaticContact CZ-CE2 3.98Å; F314-F335 HydrophobicContact CZ-CE2 3.98Å; F314-F335 AromaticContact CZ-CZ 3.93Å; F314-F335 HydrophobicContact CZ-CZ 3.93Å; F314-Y345 HydrophobicContact CD2-CD1 4.01Å; F314-Y345 AromaticContact CD2-CE1 3.78Å; F314-Y345 HydrophobicContact CD2-CE1 3.78Å; F314-Y345 AromaticContact CE2-CD1 3.54Å; F314-Y345 HydrophobicContact CE2-CD1 3.54Å; F314-Y345 AromaticContact CE2-CD2 3.87Å; F314-Y345 HydrophobicContact CE2-CD2 3.87Å; F314-Y345 AromaticContact CE2-CE1 3.62Å; F314-Y345 HydrophobicContact CE2-CE1 3.62Å; F314-Y345 AromaticContact CE2-CE2 3.96Å; F314-Y345 HydrophobicContact CE2-CE2 3.96Å; F314-Y345 AromaticContact CE2-CG 3.64Å; F314-Y345 HydrophobicContact CE2-CG 3.64Å; F314-Y345 AromaticContact CE2-CZ 3.82Å; F314-Y345 HydrophobicContact CZ-CD1 4.15Å; F314-Y345 HydrophobicContact CZ-CD2 4.39Å; F314-Y345 AromaticContact CZ-CG 3.99Å; F314-Y345 HydrophobicContact CZ-CG 3.99Å; F314-I347 HydrophobicContact CE1-CD1 4.06Å
315	N	90.9	Very high	90.4	Very high	108 Å²	108	43 Å²	43	58%	0.578	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-85.5	132.5	179.3	-63.8	-21	0	0	0	111.1	Y298 G317 Y345	Y298-N315 CarbonylContact O-C 3.57Å; Y298-N315 VanDerWaalsContact O-CA 3.31Å; Y298-N315 WeakPolarHBondContact O-CA 3.44Å; N315-G317 VanDerWaalsContact C-N 3.34Å; N315-G317 PolarHBondContact O-N 3.2Å; N315-G317 VanDerWaalsContact O-N 3.16Å; N315-Y345 PolarHBondContact O-OH 2.84Å
316	I	85.6	Confident	90.6	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.01	25%	0.245	C	C	.	.			trans	-88.5	72.9	-179.4	-51.1	161.6	0	0	0	108.1	Y298 C300 F314 C321 F335 Y345	Y298-I316 PolarHBondContact O-N 2.79Å; C300-I316 HydrophobicContact CB-CD1 3.94Å; C300-I316 HydrophobicContact CB-CG1 4Å; F314-I316 HydrophobicContact CE2-CG1 4.39Å; I316-C321 HydrophobicContact CD1-CB 4.01Å; I316-C321 HydrophobicContact CG2-CB 4.35Å; I316-F335 HydrophobicContact CD1-CD1 3.64Å; I316-F335 HydrophobicContact CD1-CE1 3.51Å; I316-F335 HydrophobicContact CD1-CG 4.34Å; I316-F335 HydrophobicContact CD1-CZ 4.17Å; I316-F335 HydrophobicContact CG1-CD1 4.21Å; I316-F335 HydrophobicContact CG1-CE1 4.03Å; I316-F335 HydrophobicContact CG1-CZ 4.21Å; I316-F335 HydrophobicContact CG2-CB 3.9Å; I316-F335 HydrophobicContact CG2-CD1 4.17Å; I316-F335 HydrophobicContact CG2-CD2 4.1Å; I316-F335 HydrophobicContact CG2-CG 3.8Å; I316-Y345 HydrophobicContact CG2-CE2 4.33Å
317	G	81.4	Confident	90.9	Very high	34 Å²	34	39 Å²	39	35%	0.351	22%	0.221	S	C	.	.			trans	53.7	-164.5	177.3	0	0	0	0	0	114.8	N315 Y345	N315-G317 VanDerWaalsContact C-N 3.34Å; N315-G317 PolarHBondContact O-N 3.2Å; N315-G317 VanDerWaalsContact O-N 3.16Å; G317-Y345 PolarHBondContact N-OH 3.31Å
318	P	85.4	Confident	91.1	Very high	120 Å²	120	38.9 Å²	38.9	78%	0.779	22%	0.222	S	C	*	.	S	Bend	trans	-89.1	-17.3	176.4	33.9	-33.9	0	0	0	113.6
319	S	90.1	Very high	91.4	Very high	36 Å²	36	44.3 Å²	44.3	25%	0.252	25%	0.249	S	C	.	.	S	Bend	trans	-90.3	151.3	-175.3	-64.4	0	0	0	0	111.3	C321 E338 S339	S319-C321 PolarHBondContact O-N 2.91Å; S319-E338 PolarHBondContact OG-O 3.04Å; S319-S339 WeakPolarHBondContact OG-CB 3.42Å
320	E	92.9	Very high	91.5	Very high	41 Å²	41	37.1 Å²	37.1	19%	0.192	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-68.3	125.4	179.2	-57	-174.5	-169.9	0	0	110.6	R297 Y298 S337 E338	R297-E320 HydrophobicContact CG-CB 4Å; R297-E320 HydrophobicContact CG-CG 3.9Å; R297-E320 IonicContact CZ-OE1 3.92Å; R297-E320 VanDerWaalsContact CZ-OE1 3.26Å; R297-E320 IonicContact CZ-OE2 2.63Å; R297-E320 VanDerWaalsContact CZ-OE2 3.26Å; R297-E320 IonicContact NE-OE1 3.85Å; R297-E320 PolarHBondContact NE-OE1 3.32Å; R297-E320 VanDerWaalsContact NE-OE1 3.16Å; R297-E320 IonicContact NE-OE2 3.26Å; R297-E320 PolarHBondContact NE-OE2 3.21Å; R297-E320 IonicContact NH2-OE1 2.68Å; R297-E320 PolarHBondContact NH2-OE1 2.83Å; R297-E320 IonicContact NH2-OE2 3.16Å; R297-E320 PolarHBondContact NH2-OE2 2.86Å; Y298-E320 HydrophobicContact CE1-CB 4.35Å; Y298-E320 HydrophobicContact CE1-CG 3.57Å; Y298-E320 WeakPolarHBondContact OH-CG 3.15Å; Y298-E320 PolarHBondContact OH-OE1 2.85Å; E320-S337 CarbonylContact O-C 3.49Å; E320-S337 WeakPolarHBondContact O-CA 3.31Å; E320-S337 WeakPolarHBondContact O-CB 3.5Å; E320-E338 HydrophobicContact CB-CB 4.39Å; E320-E338 HydrophobicContact CB-CG 4.11Å; E320-E338 PolarHBondContact O-N 2.98Å
321	C	94.1	Very high	91.6	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	131.1	169.5	175.6	0	0	0	0	108.9	K283 R297 I316 S319 A336	K283-C321 WeakPolarHBondContact CD-O 3.15Å; K283-C321 WeakPolarHBondContact CE-O 3.15Å; K283-C321 PolarHBondContact NZ-O 3.3Å; R297-C321 WeakPolarHBondContact O-CB 3.47Å; R297-C321 PolarHBondContact O-N 3.01Å; I316-C321 HydrophobicContact CD1-CB 4.01Å; I316-C321 HydrophobicContact CG2-CB 4.35Å; S319-C321 PolarHBondContact O-N 2.91Å; C321-A336 CarbonylContact C-O 3.57Å; C321-A336 WeakPolarHBondContact CA-O 3.5Å
322	N	94.5	Very high	91.8	Very high	33 Å²	33	31.9 Å²	31.9	18%	0.176	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	-41	173.8	-70.7	-32	0	0	0	112	T54 T55 A336	T54-N322 PolarHBondContact O-ND2 3.12Å; T55-N322 VanDerWaalsContact O-CB 3.27Å; T55-N322 WeakPolarHBondContact O-CB 3.36Å; N322-A336 HydrophobicContact CB-CB 4.37Å; N322-A336 PolarHBondContact N-O 2.77Å
323	S	95	Very high	91.9	Very high	7 Å²	7	31.9 Å²	31.9	5%	0.049	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	140.4	-177.2	175.8	0	0	0	0	109.7	Y56 F335 A336	Y56-S323 WeakPolarHBondContact CD2-OG 3.48Å; Y56-S323 WeakPolarHBondContact CE2-OG 3.44Å; S323-F335 WeakPolarHBondContact O-CA 3.31Å; S323-A336 WeakPolarHBondContact O-CB 3.48Å; S323-A336 PolarHBondContact O-N 2.86Å
324	M	95.8	Very high	92.1	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.01	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	136.9	169.2	-178.1	179	68.9	0	0	109.8	S284 H286 L293 A295 L333 M334 F335	S284-M324 WeakPolarHBondContact OG-CB 3.34Å; S284-M324 PolarHBondContact OG-N 2.71Å; S284-M324 VanDerWaalsContact OG-N 3.11Å; H286-M324 HydrophobicContact CB-CE 4.25Å; H286-M324 PolarHBondContact NE2-O 3.18Å; L293-M324 HydrophobicContact CB-CE 3.65Å; A295-M324 HydrophobicContact CB-CB 3.7Å; A295-M324 HydrophobicContact CB-CE 4.28Å; A295-M324 HydrophobicContact CB-CG 4.41Å; A295-M324 HydrophobicContact CB-SD 3.94Å; M324-L333 HydrophobicContact SD-CD2 4.23Å; M324-M334 CarbonylContact C-O 3.54Å; M324-M334 WeakPolarHBondContact CA-O 3.47Å; M324-F335 HydrophobicContact CB-CD1 3.79Å; M324-F335 HydrophobicContact CB-CE1 3.85Å; M324-F335 HydrophobicContact CG-CD1 3.77Å; M324-F335 HydrophobicContact CG-CE1 3.45Å; M324-F335 VanDerWaalsContact CG-CE1 3.45Å; M324-F335 HydrophobicContact CG-CZ 4.07Å; M324-F335 HydrophobicContact SD-CD1 4.29Å; M324-F335 HydrophobicContact SD-CE1 3.39Å; M324-F335 WeakPolarHBondContact SD-CE1 3.16Å; M324-F335 HydrophobicContact SD-CZ 3.8Å
325	Y	95.8	Very high	92.3	Very high	32 Å²	32	30.8 Å²	30.8	13%	0.125	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	128	166.5	-176.5	-98	0	0	0	109.5	C59 F327 M334	C59-Y325 HydrophobicContact CB-CE1 4Å; C59-Y325 HydrophobicContact CB-CE2 4.24Å; C59-Y325 VanDerWaalsContact CB-OH 3.26Å; C59-Y325 WeakPolarHBondContact CB-OH 3.49Å; C59-Y325 WeakPolarHBondContact SG-CE1 3.48Å; C59-Y325 VanDerWaalsContact SG-CZ 3.55Å; Y325-F327 HydrophobicContact CD1-CD2 4.12Å; Y325-F327 HydrophobicContact CD1-CE2 4.01Å; Y325-F327 HydrophobicContact CD1-CG 4.42Å; Y325-F327 HydrophobicContact CD1-CZ 4.21Å; Y325-F327 AromaticContact CE1-CD1 3.76Å; Y325-F327 HydrophobicContact CE1-CD1 3.76Å; Y325-F327 AromaticContact CE1-CD2 3.99Å; Y325-F327 HydrophobicContact CE1-CD2 3.99Å; Y325-F327 AromaticContact CE1-CE1 3.83Å; Y325-F327 HydrophobicContact CE1-CE1 3.83Å; Y325-F327 HydrophobicContact CE1-CE2 4.06Å; Y325-F327 AromaticContact CE1-CG 3.84Å; Y325-F327 HydrophobicContact CE1-CG 3.84Å; Y325-F327 AromaticContact CE1-CZ 3.97Å; Y325-F327 HydrophobicContact CE1-CZ 3.97Å; Y325-M334 PolarHBondContact N-O 3.24Å; Y325-M334 PolarHBondContact O-N 3.27Å
326	H	95.2	Very high	92.5	Very high	13 Å²	13	25.7 Å²	25.7	6%	0.06	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	129.1	174.6	169.2	-110.7	0	0	0	108.8	H286 H288 S330 L333	H286-H326 HydrophobicContact CB-CB 3.98Å; H288-H326 AromaticContact CG-CE1 3.74Å; H288-H326 AromaticContact CG-NE2 3.77Å; H288-H326 AromaticContact ND1-CE1 3.2Å; H288-H326 PolarHBondContact ND1-CE1 3.15Å; H288-H326 AromaticContact ND1-NE2 3.32Å; H288-H326 PolarHBondContact ND1-NE2 3.08Å; H326-S330 PolarHBondContact NE2-O 2.95Å; H326-L333 HydrophobicContact CB-CD2 3.8Å
327	F	94.4	Very high	92.9	Very high	6 Å²	6	25.7 Å²	25.7	3%	0.026	16%	0.156	C	C	.	.			trans	-78.8	125.5	174.1	-77.1	-87.1	0	0	0	109.4	C59 L81 Y325 S330 L332 M334 W356	C59-F327 WeakPolarHBondContact SG-CE1 3.48Å; L81-F327 HydrophobicContact CD1-CE1 3.8Å; L81-F327 HydrophobicContact CD1-CZ 4.38Å; Y325-F327 HydrophobicContact CD1-CD2 4.12Å; Y325-F327 HydrophobicContact CD1-CE2 4.01Å; Y325-F327 HydrophobicContact CD1-CG 4.42Å; Y325-F327 HydrophobicContact CD1-CZ 4.21Å; Y325-F327 AromaticContact CE1-CD1 3.76Å; Y325-F327 HydrophobicContact CE1-CD1 3.76Å; Y325-F327 AromaticContact CE1-CD2 3.99Å; Y325-F327 HydrophobicContact CE1-CD2 3.99Å; Y325-F327 AromaticContact CE1-CE1 3.83Å; Y325-F327 HydrophobicContact CE1-CE1 3.83Å; Y325-F327 HydrophobicContact CE1-CE2 4.06Å; Y325-F327 AromaticContact CE1-CG 3.84Å; Y325-F327 HydrophobicContact CE1-CG 3.84Å; Y325-F327 AromaticContact CE1-CZ 3.97Å; Y325-F327 HydrophobicContact CE1-CZ 3.97Å; F327-S330 WeakPolarHBondContact CB-OG 2.84Å; F327-S330 PolarHBondContact O-N 3.25Å; F327-S330 PolarHBondContact O-OG 2.94Å; F327-L332 HydrophobicContact CD2-CB 4.03Å; F327-L332 HydrophobicContact CD2-CD2 3.7Å; F327-L332 HydrophobicContact CD2-CG 3.9Å; F327-L332 HydrophobicContact CE2-CD2 3.71Å; F327-L332 HydrophobicContact CE2-CG 4.2Å; F327-L332 HydrophobicContact CG-CD2 4.45Å; F327-L332 HydrophobicContact CZ-CD2 4.47Å; F327-L332 PolarHBondContact N-O 3.3Å; F327-M334 HydrophobicContact CE2-CE 3.94Å; F327-M334 HydrophobicContact CE2-CG 3.9Å; F327-M334 HydrophobicContact CE2-SD 3.68Å; F327-M334 HydrophobicContact CZ-CE 4.17Å; F327-M334 HydrophobicContact CZ-SD 3.98Å; F327-W356 HydrophobicContact CD1-CZ2 4.32Å; F327-W356 AromaticContact CE1-CZ2 3.77Å; F327-W356 HydrophobicContact CE1-CZ2 3.77Å; F327-W356 HydrophobicContact CE2-CZ2 4.17Å; F327-W356 HydrophobicContact CZ-CH2 4.46Å; F327-W356 AromaticContact CZ-CZ2 3.69Å; F327-W356 HydrophobicContact CZ-CZ2 3.69Å
328	P	91	Very high	93.4	Very high	85 Å²	85	27.5 Å²	27.5	55%	0.552	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	141.9	-174.9	25.9	-34.4	0	0	0	111.3	S330	P328-S330 PolarHBondContact O-N 3.12Å; P328-S330 VanDerWaalsContact O-N 3.12Å
329	N	89.8	Confident	93.7	Very high	125 Å²	125	22.8 Å²	22.8	67%	0.668	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.2	20.4	179.1	-55.9	-17.6	0	0	0	115.1
330	S	93.1	Very high	93.7	Very high	3 Å²	3	24 Å²	24	2%	0.021	13%	0.133	C	C	.	.	S	Bend	trans	-133.6	158.7	-175.2	79.7	0	0	0	0	112.8	H326 F327 P328 L332 E352	H326-S330 PolarHBondContact NE2-O 2.95Å; F327-S330 WeakPolarHBondContact CB-OG 2.84Å; F327-S330 PolarHBondContact O-N 3.25Å; F327-S330 PolarHBondContact O-OG 2.94Å; P328-S330 PolarHBondContact O-N 3.12Å; P328-S330 VanDerWaalsContact O-N 3.12Å; S330-L332 PolarHBondContact O-N 2.85Å; S330-L332 PolarHBondContact OG-N 3.15Å; S330-E352 VanDerWaalsContact CA-O 3.24Å; S330-E352 WeakPolarHBondContact CA-O 3.46Å; S330-E352 VanDerWaalsContact CB-O 3.27Å; S330-E352 WeakPolarHBondContact CB-O 3.46Å
331	G	92.6	Very high	93.5	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.127	C	C	.	.	S	Bend	trans	-77.4	4.5	175.6	0	0	0	0	0	114.9	F346 I347 G351 E352	G331-F346 CarbonylContact O-C 3.48Å; G331-F346 WeakPolarHBondContact O-CA 3.42Å; G331-F346 WeakPolarHBondContact O-CD2 3.48Å; G331-I347 WeakPolarHBondContact CA-O 3.36Å; G331-I347 PolarHBondContact O-N 3.37Å; G331-G351 WeakPolarHBondContact CA-O 3.15Å; G331-G351 PolarHBondContact N-O 3.16Å; G331-E352 PolarHBondContact N-O 3.34Å
332	L	94.3	Very high	93.5	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	126.8	-169.1	-169.8	70.7	0	0	0	112.3	L14 L44 F327 S330 F346 P354 W356	L14-L332 HydrophobicContact CD1-CD1 4.35Å; L44-L332 HydrophobicContact CD1-CD1 4.18Å; F327-L332 HydrophobicContact CD2-CB 4.03Å; F327-L332 HydrophobicContact CD2-CD2 3.7Å; F327-L332 HydrophobicContact CD2-CG 3.9Å; F327-L332 HydrophobicContact CE2-CD2 3.71Å; F327-L332 HydrophobicContact CE2-CG 4.2Å; F327-L332 HydrophobicContact CG-CD2 4.45Å; F327-L332 HydrophobicContact CZ-CD2 4.47Å; F327-L332 PolarHBondContact N-O 3.3Å; S330-L332 PolarHBondContact O-N 2.85Å; S330-L332 PolarHBondContact OG-N 3.15Å; L332-F346 HydrophobicContact CB-CD2 4.27Å; L332-F346 HydrophobicContact CD1-CB 4.27Å; L332-F346 HydrophobicContact CD1-CD2 4.3Å; L332-P354 HydrophobicContact CD2-CG 3.9Å; L332-W356 HydrophobicContact CD2-CH2 3.49Å; L332-W356 VanDerWaalsContact CD2-CH2 3.49Å; L332-W356 HydrophobicContact CD2-CZ2 3.59Å
333	L	95.5	Very high	93.4	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	136	179.6	-63.9	167.5	0	0	0	110.3	L293 F314 M324 H326 F335 T344 Y345 I347	L293-L333 HydrophobicContact CD2-CD1 3.84Å; L293-L333 HydrophobicContact CD2-CD2 3.7Å; L293-L333 HydrophobicContact CD2-CG 4.38Å; F314-L333 HydrophobicContact CZ-CD1 4.34Å; M324-L333 HydrophobicContact SD-CD2 4.23Å; H326-L333 HydrophobicContact CB-CD2 3.8Å; L333-F335 HydrophobicContact CB-CE2 3.91Å; L333-F335 HydrophobicContact CB-CZ 4.24Å; L333-F335 HydrophobicContact CD1-CZ 4.45Å; L333-T344 WeakPolarHBondContact O-CA 3.07Å; L333-Y345 PolarHBondContact N-O 2.96Å; L333-Y345 PolarHBondContact O-N 2.94Å; L333-I347 HydrophobicContact CD1-CD1 4.07Å
334	M	95.4	Very high	93.3	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	136	172.5	-71.9	-172.8	168.1	0	0	110.5	I45 L48 L57 L66 M324 Y325 F327 I342 S343 T344	I45-M334 HydrophobicContact CD1-CE 3.78Å; L48-M334 HydrophobicContact CD2-CE 3.8Å; L48-M334 HydrophobicContact CD2-SD 4.48Å; L57-M334 HydrophobicContact CD1-CB 3.99Å; L66-M334 HydrophobicContact CD1-SD 4.19Å; L66-M334 HydrophobicContact CD2-CE 4.01Å; L66-M334 HydrophobicContact CD2-SD 3.58Å; L66-M334 VanDerWaalsContact CD2-SD 3.58Å; M324-M334 CarbonylContact C-O 3.54Å; M324-M334 WeakPolarHBondContact CA-O 3.47Å; Y325-M334 PolarHBondContact N-O 3.24Å; Y325-M334 PolarHBondContact O-N 3.27Å; F327-M334 HydrophobicContact CE2-CE 3.94Å; F327-M334 HydrophobicContact CE2-CG 3.9Å; F327-M334 HydrophobicContact CE2-SD 3.68Å; F327-M334 HydrophobicContact CZ-CE 4.17Å; F327-M334 HydrophobicContact CZ-SD 3.98Å; M334-I342 HydrophobicContact CB-CG2 4.19Å; M334-I342 HydrophobicContact CG-CG2 4.44Å; M334-I342 HydrophobicContact SD-CG2 4.49Å; M334-S343 CarbonylContact C-O 3.58Å; M334-S343 WeakPolarHBondContact CA-O 3.45Å; M334-T344 HydrophobicContact CE-CG2 3.87Å; M334-T344 HydrophobicContact CG-CG2 4.04Å
335	F	95.7	Very high	93.2	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	119.7	177.2	-57.8	-89.3	0	0	0	109.3	A295 C300 F314 I316 S323 M324 L333 S343 Y345	A295-F335 HydrophobicContact CB-CD1 4.45Å; A295-F335 HydrophobicContact CB-CE1 4.1Å; C300-F335 HydrophobicContact CB-CE1 4.05Å; C300-F335 HydrophobicContact CB-CZ 3.82Å; F314-F335 HydrophobicContact CE2-CE2 4.09Å; F314-F335 HydrophobicContact CE2-CZ 4.25Å; F314-F335 AromaticContact CZ-CE2 3.98Å; F314-F335 HydrophobicContact CZ-CE2 3.98Å; F314-F335 AromaticContact CZ-CZ 3.93Å; F314-F335 HydrophobicContact CZ-CZ 3.93Å; I316-F335 HydrophobicContact CD1-CD1 3.64Å; I316-F335 HydrophobicContact CD1-CE1 3.51Å; I316-F335 HydrophobicContact CD1-CG 4.34Å; I316-F335 HydrophobicContact CD1-CZ 4.17Å; I316-F335 HydrophobicContact CG1-CD1 4.21Å; I316-F335 HydrophobicContact CG1-CE1 4.03Å; I316-F335 HydrophobicContact CG1-CZ 4.21Å; I316-F335 HydrophobicContact CG2-CB 3.9Å; I316-F335 HydrophobicContact CG2-CD1 4.17Å; I316-F335 HydrophobicContact CG2-CD2 4.1Å; I316-F335 HydrophobicContact CG2-CG 3.8Å; S323-F335 WeakPolarHBondContact O-CA 3.31Å; M324-F335 HydrophobicContact CB-CD1 3.79Å; M324-F335 HydrophobicContact CB-CE1 3.85Å; M324-F335 HydrophobicContact CG-CD1 3.77Å; M324-F335 HydrophobicContact CG-CE1 3.45Å; M324-F335 VanDerWaalsContact CG-CE1 3.45Å; M324-F335 HydrophobicContact CG-CZ 4.07Å; M324-F335 HydrophobicContact SD-CD1 4.29Å; M324-F335 HydrophobicContact SD-CE1 3.39Å; M324-F335 WeakPolarHBondContact SD-CE1 3.16Å; M324-F335 HydrophobicContact SD-CZ 3.8Å; L333-F335 HydrophobicContact CB-CE2 3.91Å; L333-F335 HydrophobicContact CB-CZ 4.24Å; L333-F335 HydrophobicContact CD1-CZ 4.45Å; F335-S343 WeakPolarHBondContact CD2-O 3.31Å; F335-S343 PolarHBondContact N-O 3.39Å; F335-S343 PolarHBondContact O-N 2.91Å; F335-Y345 AromaticContact CD2-CD2 3.52Å; F335-Y345 HydrophobicContact CD2-CD2 3.52Å; F335-Y345 AromaticContact CD2-CE2 3.83Å; F335-Y345 HydrophobicContact CD2-CE2 3.83Å; F335-Y345 AromaticContact CE2-CD2 3.42Å; F335-Y345 HydrophobicContact CE2-CD2 3.42Å; F335-Y345 VanDerWaalsContact CE2-CD2 3.42Å; F335-Y345 AromaticContact CE2-CE2 3.97Å; F335-Y345 HydrophobicContact CE2-CE2 3.97Å; F335-Y345 HydrophobicContact CE2-CG 4.19Å
336	A	95.5	Very high	93.1	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	129.6	162.4	0	0	0	0	0	106.8	T54 L57 C321 N322 S323	T54-A336 WeakPolarHBondContact OG1-CA 3.27Å; L57-A336 HydrophobicContact CD1-CB 3.87Å; L57-A336 VanDerWaalsContact CD1-N 3.33Å; L57-A336 HydrophobicContact CG-CB 3.91Å; C321-A336 CarbonylContact C-O 3.57Å; C321-A336 WeakPolarHBondContact CA-O 3.5Å; N322-A336 HydrophobicContact CB-CB 4.37Å; N322-A336 PolarHBondContact N-O 2.77Å; S323-A336 WeakPolarHBondContact O-CB 3.48Å; S323-A336 PolarHBondContact O-N 2.86Å
337	S	93.4	Very high	93	Very high	2 Å²	2	20.4 Å²	20.4	1%	0.014	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	164.6	-179.9	63.1	0	0	0	0	111.9	T54 E320 S339 K341	T54-S337 PolarHBondContact N-O 3.23Å; T54-S337 VanDerWaalsContact N-O 3.08Å; T54-S337 PolarHBondContact OG1-N 2.94Å; T54-S337 PolarHBondContact OG1-O 3.24Å; T54-S337 VanDerWaalsContact OG1-O 3.04Å; E320-S337 CarbonylContact O-C 3.49Å; E320-S337 WeakPolarHBondContact O-CA 3.31Å; E320-S337 WeakPolarHBondContact O-CB 3.5Å; S337-S339 PolarHBondContact O-N 3.08Å; S337-S339 PolarHBondContact OG-OG 3.46Å; S337-K341 PolarHBondContact OG-O 2.6Å
338	E	92.5	Very high	92.9	Very high	72 Å²	72	22.4 Å²	22.4	34%	0.336	13%	0.13	S	C	.	.	S	Bend	trans	-72.9	48.8	164	-61.6	-157.8	145	0	0	111.3	R71 S319 E320	R71-E338 IonicContact CZ-OE1 2.71Å; R71-E338 IonicContact NH1-OE1 2.83Å; R71-E338 PolarHBondContact NH1-OE1 3.17Å; R71-E338 IonicContact NH2-OE1 3.7Å; R71-E338 PolarHBondContact NH2-OE1 3.03Å; S319-E338 PolarHBondContact OG-O 3.04Å; E320-E338 HydrophobicContact CB-CB 4.39Å; E320-E338 HydrophobicContact CB-CG 4.11Å; E320-E338 PolarHBondContact O-N 2.98Å
339	S	90.7	Very high	92.9	Very high	22 Å²	22	23.7 Å²	23.7	15%	0.154	13%	0.132	C	C	.	.	S	Bend	trans	-140.1	156.1	170.1	85.8	0	0	0	0	107.9	D52 S319 S337 K341	D52-S339 CarbonylContact O-C 3.6Å; D52-S339 VanDerWaalsContact O-C 3.29Å; S319-S339 WeakPolarHBondContact OG-CB 3.42Å; S337-S339 PolarHBondContact O-N 3.08Å; S337-S339 PolarHBondContact OG-OG 3.46Å; S339-K341 PolarHBondContact O-N 3.43Å; S339-K341 PolarHBondContact OG-O 2.84Å
340	P	90.1	Very high	93	Very high	62 Å²	62	18.2 Å²	18.2	40%	0.403	10%	0.102	S	C	.	.	S	Bend	trans	-63.1	-29.6	-179.6	22.6	-33.1	0	0	0	111.2	E49 M50 D52	E49-P340 CarbonylContact C-O 3.55Å; E49-P340 WeakPolarHBondContact CA-O 3.35Å; E49-P340 WeakPolarHBondContact CB-O 3.27Å; M50-P340 PolarHBondContact N-O 3.24Å; M50-P340 VanDerWaalsContact O-CA 3.23Å; M50-P340 WeakPolarHBondContact O-CA 3.43Å; M50-P340 WeakPolarHBondContact O-CB 3.42Å; D52-P340 VanDerWaalsContact O-CA 3.26Å; D52-P340 WeakPolarHBondContact O-CA 3.23Å
341	K	89.8	Confident	92.9	Very high	18 Å²	18	18.9 Å²	18.9	8%	0.078	11%	0.11	C	C	.	.	B	Isolated β-bridge	trans	-93.8	139.7	-177.5	-64.7	-165.5	175.6	-174.9	0	112.1	A16 S19 R41 E49 S337 S339	A16-K341 HydrophobicContact CB-CD 4.32Å; A16-K341 WeakPolarHBondContact O-CD 2.98Å; A16-K341 PolarHBondContact O-NZ 2.94Å; S19-K341 VanDerWaalsContact CB-NZ 3.26Å; S19-K341 WeakPolarHBondContact OG-CE 2.95Å; S19-K341 PolarHBondContact OG-NZ 2.88Å; R41-K341 VanDerWaalsContact NH2-NZ 3.17Å; E49-K341 HydrophobicContact CB-CG 4.17Å; E49-K341 VanDerWaalsContact OE2-CE 3.31Å; E49-K341 WeakPolarHBondContact OE2-CE 3.42Å; S337-K341 PolarHBondContact OG-O 2.6Å; S339-K341 PolarHBondContact O-N 3.43Å; S339-K341 PolarHBondContact OG-O 2.84Å
342	I	93.3	Very high	93	Very high	5 Å²	5	25.8 Å²	25.8	3%	0.026	14%	0.142	C	C	.	.			trans	-76.1	130.2	171.9	-66.4	165	0	0	0	108.3	L48 T54 L57 A68 M334 T344	L48-I342 HydrophobicContact CD1-CD1 3.79Å; L48-I342 HydrophobicContact CD2-CB 3.99Å; L48-I342 HydrophobicContact CD2-CD1 4.49Å; L48-I342 HydrophobicContact CD2-CG2 4.14Å; L48-I342 HydrophobicContact CG-CB 4Å; L48-I342 HydrophobicContact CG-CD1 3.8Å; L48-I342 HydrophobicContact CG-CG1 4.38Å; L48-I342 PolarHBondContact O-N 2.97Å; T54-I342 HydrophobicContact CG2-CD1 4.05Å; T54-I342 HydrophobicContact CG2-CG1 3.64Å; L57-I342 HydrophobicContact CD1-CG2 3.67Å; L57-I342 HydrophobicContact CD2-CD1 3.68Å; L57-I342 HydrophobicContact CD2-CG1 4.36Å; A68-I342 HydrophobicContact CB-CD1 3.96Å; M334-I342 HydrophobicContact CB-CG2 4.19Å; M334-I342 HydrophobicContact CG-CG2 4.44Å; M334-I342 HydrophobicContact SD-CG2 4.49Å; I342-T344 PolarHBondContact O-N 3.04Å
343	S	92.5	Very high	92.9	Very high	11 Å²	11	26.1 Å²	26.1	8%	0.077	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	109.2	-175.3	-84.8	0	0	0	0	111.4	M334 F335	M334-S343 CarbonylContact C-O 3.58Å; M334-S343 WeakPolarHBondContact CA-O 3.45Å; F335-S343 WeakPolarHBondContact CD2-O 3.31Å; F335-S343 PolarHBondContact N-O 3.39Å; F335-S343 PolarHBondContact O-N 2.91Å
344	T	93.2	Very high	92.8	Very high	9 Å²	9	26.8 Å²	26.8	6%	0.055	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	126.3	-178.6	53.8	0	0	0	0	112.1	L14 L48 L333 M334 I342	L14-T344 VanDerWaalsContact CB-OG1 3.32Å; L14-T344 WeakPolarHBondContact CB-OG1 2.96Å; L14-T344 PolarHBondContact N-O 3.4Å; L48-T344 HydrophobicContact CD2-CG2 3.88Å; L333-T344 WeakPolarHBondContact O-CA 3.07Å; M334-T344 HydrophobicContact CE-CG2 3.87Å; M334-T344 HydrophobicContact CG-CG2 4.04Å; I342-T344 PolarHBondContact O-N 3.04Å
345	Y	93.4	Very high	92.5	Very high	8 Å²	8	33.2 Å²	33.2	3%	0.031	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	144.4	176.3	-68.3	-96.4	0	0	0	110.7	V11 Y12 N13 F314 N315 I316 G317 L333 F335	V11-Y345 HydrophobicContact CG1-CD1 3.88Å; Y12-Y345 CarbonylContact O-C 3.4Å; Y12-Y345 WeakPolarHBondContact O-CA 3.49Å; N13-Y345 HydrophobicContact CB-CD1 3.99Å; N13-Y345 HydrophobicContact CB-CE1 3.77Å; F314-Y345 HydrophobicContact CD2-CD1 4.01Å; F314-Y345 AromaticContact CD2-CE1 3.78Å; F314-Y345 HydrophobicContact CD2-CE1 3.78Å; F314-Y345 AromaticContact CE2-CD1 3.54Å; F314-Y345 HydrophobicContact CE2-CD1 3.54Å; F314-Y345 AromaticContact CE2-CD2 3.87Å; F314-Y345 HydrophobicContact CE2-CD2 3.87Å; F314-Y345 AromaticContact CE2-CE1 3.62Å; F314-Y345 HydrophobicContact CE2-CE1 3.62Å; F314-Y345 AromaticContact CE2-CE2 3.96Å; F314-Y345 HydrophobicContact CE2-CE2 3.96Å; F314-Y345 AromaticContact CE2-CG 3.64Å; F314-Y345 HydrophobicContact CE2-CG 3.64Å; F314-Y345 AromaticContact CE2-CZ 3.82Å; F314-Y345 HydrophobicContact CZ-CD1 4.15Å; F314-Y345 HydrophobicContact CZ-CD2 4.39Å; F314-Y345 AromaticContact CZ-CG 3.99Å; F314-Y345 HydrophobicContact CZ-CG 3.99Å; N315-Y345 PolarHBondContact O-OH 2.84Å; I316-Y345 HydrophobicContact CG2-CE2 4.33Å; G317-Y345 PolarHBondContact N-OH 3.31Å; L333-Y345 PolarHBondContact N-O 2.96Å; L333-Y345 PolarHBondContact O-N 2.94Å; F335-Y345 AromaticContact CD2-CD2 3.52Å; F335-Y345 HydrophobicContact CD2-CD2 3.52Å; F335-Y345 AromaticContact CD2-CE2 3.83Å; F335-Y345 HydrophobicContact CD2-CE2 3.83Å; F335-Y345 AromaticContact CE2-CD2 3.42Å; F335-Y345 HydrophobicContact CE2-CD2 3.42Å; F335-Y345 VanDerWaalsContact CE2-CD2 3.42Å; F335-Y345 AromaticContact CE2-CE2 3.97Å; F335-Y345 HydrophobicContact CE2-CE2 3.97Å; F335-Y345 HydrophobicContact CE2-CG 4.19Å
346	F	94.1	Very high	92.3	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	135.4	175.6	-178	-110.5	0	0	0	111.5	Y12 L14 G331 L332 P348 A353 L360 D361 V364	Y12-F346 PolarHBondContact N-O 3.43Å; Y12-F346 PolarHBondContact O-N 3.07Å; L14-F346 HydrophobicContact CD1-CB 3.71Å; G331-F346 CarbonylContact O-C 3.48Å; G331-F346 WeakPolarHBondContact O-CA 3.42Å; G331-F346 WeakPolarHBondContact O-CD2 3.48Å; L332-F346 HydrophobicContact CB-CD2 4.27Å; L332-F346 HydrophobicContact CD1-CB 4.27Å; L332-F346 HydrophobicContact CD1-CD2 4.3Å; F346-P348 HydrophobicContact CD1-CG 3.83Å; F346-P348 HydrophobicContact CE1-CB 3.85Å; F346-P348 HydrophobicContact CE1-CG 3.54Å; F346-P348 HydrophobicContact CZ-CB 4.38Å; F346-P348 HydrophobicContact CZ-CG 4.47Å; F346-A353 HydrophobicContact CE2-CB 4.08Å; F346-A353 HydrophobicContact CZ-CB 4.14Å; F346-L360 HydrophobicContact CB-CD1 4.46Å; F346-L360 HydrophobicContact CB-CD2 4.08Å; F346-L360 HydrophobicContact CD1-CD2 3.09Å; F346-L360 HydrophobicContact CD1-CG 4.5Å; F346-L360 HydrophobicContact CD2-CD2 3.78Å; F346-L360 HydrophobicContact CE1-CD2 3.21Å; F346-L360 HydrophobicContact CE2-CD2 3.93Å; F346-L360 HydrophobicContact CG-CD1 4.4Å; F346-L360 HydrophobicContact CG-CD2 3.37Å; F346-L360 HydrophobicContact CZ-CD2 3.65Å; F346-D361 WeakPolarHBondContact CZ-OD1 3.37Å; F346-V364 HydrophobicContact CD1-CG2 3.88Å; F346-V364 HydrophobicContact CE1-CG2 3.96Å
347	I	93.5	Very high	92	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.185	C	C	.	.			trans	-126.6	98.3	179.5	-53.6	177.7	0	0	0	108.2	V9 V11 M302 F314 G331 L333 L349 L350	V9-I347 HydrophobicContact CG1-CG2 3.96Å; V11-I347 HydrophobicContact CG1-CG1 4.19Å; V11-I347 HydrophobicContact CG2-CD1 4.31Å; V11-I347 HydrophobicContact CG2-CG1 4.23Å; M302-I347 HydrophobicContact SD-CD1 3.59Å; M302-I347 VanDerWaalsContact SD-CD1 3.59Å; F314-I347 HydrophobicContact CE1-CD1 4.06Å; G331-I347 WeakPolarHBondContact CA-O 3.36Å; G331-I347 PolarHBondContact O-N 3.37Å; L333-I347 HydrophobicContact CD1-CD1 4.07Å; I347-L349 PolarHBondContact O-N 2.79Å; I347-L350 HydrophobicContact CB-CB 3.91Å; I347-L350 HydrophobicContact CG2-CB 3.87Å; I347-L350 VanDerWaalsContact O-CB 3.31Å; I347-L350 WeakPolarHBondContact O-CB 3.36Å; I347-L350 PolarHBondContact O-N 2.79Å
348	P	91.9	Very high	91.7	Very high	48 Å²	48	38.8 Å²	38.8	31%	0.312	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-29.4	-176.7	-15.5	22.9	0	0	0	113.4	Y12 F346 L350 V364	Y12-P348 HydrophobicContact CD2-CG 3.89Å; Y12-P348 HydrophobicContact CE2-CG 3.53Å; F346-P348 HydrophobicContact CD1-CG 3.83Å; F346-P348 HydrophobicContact CE1-CB 3.85Å; F346-P348 HydrophobicContact CE1-CG 3.54Å; F346-P348 HydrophobicContact CZ-CB 4.38Å; F346-P348 HydrophobicContact CZ-CG 4.47Å; P348-L350 PolarHBondContact O-N 3.38Å; P348-V364 HydrophobicContact CG-CG1 3.86Å
349	L	91.2	Very high	91.6	Very high	113 Å²	113	42 Å²	42	59%	0.592	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-14.8	178.4	-161.7	71.6	0	0	0	112.7	V9 F311 I347	V9-L349 HydrophobicContact CB-CD2 4.38Å; V9-L349 HydrophobicContact CG1-CB 4Å; V9-L349 HydrophobicContact CG1-CD2 3.92Å; V9-L349 HydrophobicContact CG2-CD2 3.75Å; F311-L349 HydrophobicContact CE2-CD2 3.83Å; F311-L349 HydrophobicContact CE2-CG 4.41Å; F311-L349 HydrophobicContact CZ-CB 4.13Å; F311-L349 HydrophobicContact CZ-CD2 3.59Å; F311-L349 HydrophobicContact CZ-CG 3.86Å; I347-L349 PolarHBondContact O-N 2.79Å
350	L	91.7	Very high	91.6	Very high	10 Å²	10	41 Å²	41	5%	0.052	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-44.2	175.4	-175.3	64.4	0	0	0	110.6	H288 K291 L293 M302 I347 P348	H288-L350 HydrophobicContact CB-CD1 4.32Å; H288-L350 WeakPolarHBondContact CD2-CD1 3.48Å; H288-L350 PolarHBondContact NE2-O 3.23Å; K291-L350 HydrophobicContact CD-CD1 3.64Å; L293-L350 HydrophobicContact CD2-CD2 4.28Å; M302-L350 HydrophobicContact CE-CD1 3.35Å; M302-L350 HydrophobicContact CE-CD2 3.65Å; M302-L350 HydrophobicContact CE-CG 4.05Å; I347-L350 HydrophobicContact CB-CB 3.91Å; I347-L350 HydrophobicContact CG2-CB 3.87Å; I347-L350 VanDerWaalsContact O-CB 3.31Å; I347-L350 WeakPolarHBondContact O-CB 3.36Å; I347-L350 PolarHBondContact O-N 2.79Å; P348-L350 PolarHBondContact O-N 3.38Å
351	G	91.6	Very high	91.5	Very high	17 Å²	17	40.4 Å²	40.4	18%	0.175	21%	0.209	C	C	.	.			trans	-179.1	171.6	179.2	0	0	0	0	0	110.9	G331	G331-G351 WeakPolarHBondContact CA-O 3.15Å; G331-G351 PolarHBondContact N-O 3.16Å
352	E	93.5	Very high	91.5	Very high	144 Å²	144	41.8 Å²	41.8	67%	0.673	22%	0.22	S	C	*	.	P	Polyproline II helix	trans	-67.3	166.4	175.7	59	-174.4	-171.6	0	0	112.3	S330 G331	S330-E352 VanDerWaalsContact CA-O 3.24Å; S330-E352 WeakPolarHBondContact CA-O 3.46Å; S330-E352 VanDerWaalsContact CB-O 3.27Å; S330-E352 WeakPolarHBondContact CB-O 3.46Å; G331-E352 PolarHBondContact N-O 3.34Å
353	A	92.6	Very high	91.2	Very high	7 Å²	7	42.4 Å²	42.4	6%	0.058	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-67.5	147.2	171.1	0	0	0	0	0	110.4	F346 C357 L360 D361	F346-A353 HydrophobicContact CE2-CB 4.08Å; F346-A353 HydrophobicContact CZ-CB 4.14Å; A353-C357 VanDerWaalsContact CB-O 3.3Å; A353-C357 WeakPolarHBondContact CB-O 3.32Å; A353-L360 HydrophobicContact CB-CB 4.06Å; A353-L360 HydrophobicContact CB-CD2 4.3Å; A353-D361 WeakPolarHBondContact CB-OD2 2.89Å; A353-D361 PolarHBondContact N-OD2 2.87Å
354	P	92.7	Very high	90.8	Very high	15 Å²	15	42.1 Å²	42.1	10%	0.097	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-62.4	158.5	177.4	27.9	-35.4	0	0	0	111.3	L332 W356 C357 S358	L332-P354 HydrophobicContact CD2-CG 3.9Å; P354-W356 HydrophobicContact CB-CZ2 4.37Å; P354-W356 HydrophobicContact CG-CD2 4.11Å; P354-W356 VanDerWaalsContact CG-CE2 3.45Å; P354-W356 HydrophobicContact CG-CH2 4.24Å; P354-W356 HydrophobicContact CG-CZ2 3.53Å; P354-W356 PolarHBondContact O-N 2.8Å; P354-C357 HydrophobicContact CG-CB 4.06Å; P354-C357 CarbonylContact O-C 3.43Å; P354-C357 WeakPolarHBondContact O-CA 3.27Å; P354-C357 PolarHBondContact O-N 3.45Å; P354-S358 PolarHBondContact O-N 2.99Å
355	F	89.9	Confident	90.4	Very high	134 Å²	134	46.4 Å²	46.4	59%	0.588	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-52.1	-35.7	-173.1	68.1	-91.7	0	0	0	114.6	Q64 C357	Q64-F355 HydrophobicContact CG-CZ 4.25Å; F355-C357 VanDerWaalsContact C-N 3.26Å; F355-C357 PolarHBondContact O-N 3.37Å
356	W	91.5	Very high	89.7	Confident	26 Å²	26	52.5 Å²	52.5	10%	0.098	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-76.9	-11.8	179.6	55.2	-97.7	0	0	0	113.4	I45 L81 L84 F327 L332 P354	I45-W356 HydrophobicContact CD1-CH2 4.32Å; I45-W356 HydrophobicContact CD1-CZ3 4.43Å; I45-W356 HydrophobicContact CG1-CZ3 4.3Å; L81-W356 HydrophobicContact CB-CB 4.31Å; L81-W356 HydrophobicContact CB-CD2 3.88Å; L81-W356 HydrophobicContact CB-CE3 4.45Å; L81-W356 HydrophobicContact CB-CG 3.78Å; L81-W356 HydrophobicContact CD1-CZ2 4.4Å; L81-W356 HydrophobicContact CD2-CD2 4.38Å; L81-W356 HydrophobicContact CD2-CH2 4.24Å; L81-W356 HydrophobicContact CD2-CZ2 4.05Å; L81-W356 HydrophobicContact CD2-CZ3 4.47Å; L81-W356 WeakPolarHBondContact O-CB 3.45Å; L84-W356 HydrophobicContact CD2-CE3 3.56Å; L84-W356 HydrophobicContact CD2-CZ3 3.99Å; F327-W356 HydrophobicContact CD1-CZ2 4.32Å; F327-W356 AromaticContact CE1-CZ2 3.77Å; F327-W356 HydrophobicContact CE1-CZ2 3.77Å; F327-W356 HydrophobicContact CE2-CZ2 4.17Å; F327-W356 HydrophobicContact CZ-CH2 4.46Å; F327-W356 AromaticContact CZ-CZ2 3.69Å; F327-W356 HydrophobicContact CZ-CZ2 3.69Å; L332-W356 HydrophobicContact CD2-CH2 3.49Å; L332-W356 VanDerWaalsContact CD2-CH2 3.49Å; L332-W356 HydrophobicContact CD2-CZ2 3.59Å; P354-W356 HydrophobicContact CB-CZ2 4.37Å; P354-W356 HydrophobicContact CG-CD2 4.11Å; P354-W356 VanDerWaalsContact CG-CE2 3.45Å; P354-W356 HydrophobicContact CG-CH2 4.24Å; P354-W356 HydrophobicContact CG-CZ2 3.53Å; P354-W356 PolarHBondContact O-N 2.8Å
357	C	89.1	Confident	88.9	Confident	11 Å²	11	55.4 Å²	55.4	7%	0.074	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-126.4	32.3	-178.4	-145.9	0	0	0	0	113.7	L44 A353 P354 F355 Y359 L360	L44-C357 WeakPolarHBondContact CD2-SG 3.45Å; A353-C357 VanDerWaalsContact CB-O 3.3Å; A353-C357 WeakPolarHBondContact CB-O 3.32Å; P354-C357 HydrophobicContact CG-CB 4.06Å; P354-C357 CarbonylContact O-C 3.43Å; P354-C357 WeakPolarHBondContact O-CA 3.27Å; P354-C357 PolarHBondContact O-N 3.45Å; F355-C357 VanDerWaalsContact C-N 3.26Å; F355-C357 PolarHBondContact O-N 3.37Å; C357-Y359 PolarHBondContact O-N 2.92Å; C357-Y359 VanDerWaalsContact O-N 3.12Å; C357-L360 WeakPolarHBondContact O-CB 3.37Å; C357-L360 PolarHBondContact O-N 2.78Å
358	S	87.3	Confident	87.9	Confident	83 Å²	83	59 Å²	59	58%	0.58	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-29.7	-179	57.1	0	0	0	0	114.1	P354 L360 D361	P354-S358 PolarHBondContact O-N 2.99Å; S358-L360 PolarHBondContact O-N 3Å; S358-D361 PolarHBondContact O-N 2.83Å
359	Y	89.1	Confident	86.4	Confident	140 Å²	140	60.2 Å²	60.2	55%	0.549	32%	0.32	S	S	.	.	H	α-helix	trans	-61.9	-21.9	175.6	179.6	-117	0	0	0	113.5	C357 D361 S362 L363	C357-Y359 PolarHBondContact O-N 2.92Å; C357-Y359 VanDerWaalsContact O-N 3.12Å; Y359-D361 VanDerWaalsContact C-N 3.27Å; Y359-D361 PolarHBondContact O-N 2.8Å; Y359-S362 WeakPolarHBondContact CA-OG 3.1Å; Y359-S362 WeakPolarHBondContact CD2-OG 3.44Å; Y359-S362 PolarHBondContact O-N 2.98Å; Y359-S362 PolarHBondContact O-OG 2.79Å; Y359-L363 HydrophobicContact CD1-CD1 3.5Å; Y359-L363 VanDerWaalsContact CD1-CD1 3.5Å; Y359-L363 HydrophobicContact CD1-CG 3.79Å; Y359-L363 HydrophobicContact CE1-CD1 3.28Å; Y359-L363 HydrophobicContact CE1-CD2 3.61Å; Y359-L363 HydrophobicContact CE1-CG 3.33Å; Y359-L363 HydrophobicContact CE2-CD2 4.42Å; Y359-L363 HydrophobicContact CE2-CG 4.17Å; Y359-L363 HydrophobicContact CG-CD1 4.44Å; Y359-L363 HydrophobicContact CG-CG 4.41Å; Y359-L363 WeakPolarHBondContact O-CG 3.42Å; Y359-L363 PolarHBondContact O-N 2.89Å; Y359-L363 WeakPolarHBondContact OH-CD2 3.1Å
360	L	90.6	Very high	84.6	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-62.5	-37	178	-172.3	153.8	0	0	0	111.5	L14 L44 F346 A353 C357 S358 L363 V364	L14-L360 HydrophobicContact CD1-CD1 3.46Å; L14-L360 VanDerWaalsContact CD1-CD1 3.46Å; L14-L360 HydrophobicContact CD1-CG 4.48Å; L44-L360 HydrophobicContact CD1-CD1 4.03Å; L44-L360 HydrophobicContact CD2-CD1 3.52Å; L44-L360 HydrophobicContact CD2-CG 4.44Å; L44-L360 HydrophobicContact CG-CD1 4.39Å; F346-L360 HydrophobicContact CB-CD1 4.46Å; F346-L360 HydrophobicContact CB-CD2 4.08Å; F346-L360 HydrophobicContact CD1-CD2 3.09Å; F346-L360 HydrophobicContact CD1-CG 4.5Å; F346-L360 HydrophobicContact CD2-CD2 3.78Å; F346-L360 HydrophobicContact CE1-CD2 3.21Å; F346-L360 HydrophobicContact CE2-CD2 3.93Å; F346-L360 HydrophobicContact CG-CD1 4.4Å; F346-L360 HydrophobicContact CG-CD2 3.37Å; F346-L360 HydrophobicContact CZ-CD2 3.65Å; A353-L360 HydrophobicContact CB-CB 4.06Å; A353-L360 HydrophobicContact CB-CD2 4.3Å; C357-L360 WeakPolarHBondContact O-CB 3.37Å; C357-L360 PolarHBondContact O-N 2.78Å; S358-L360 PolarHBondContact O-N 3Å; L360-L363 WeakPolarHBondContact O-CB 3.46Å; L360-L363 PolarHBondContact O-N 3.18Å; L360-V364 HydrophobicContact CD2-CG2 3.82Å; L360-V364 VanDerWaalsContact O-CG2 3.32Å; L360-V364 WeakPolarHBondContact O-CG2 3.48Å; L360-V364 PolarHBondContact O-N 3.14Å
361	D	89.6	Confident	83	Confident	49 Å²	49	63.8 Å²	63.8	26%	0.262	34%	0.343	S	S	.	.	H	α-helix	trans	-65.7	-42.1	177.7	-74.5	-33.6	0	0	0	111.3	F346 A353 S358 Y359 L363 V364 V365	F346-D361 WeakPolarHBondContact CZ-OD1 3.37Å; A353-D361 WeakPolarHBondContact CB-OD2 2.89Å; A353-D361 PolarHBondContact N-OD2 2.87Å; S358-D361 PolarHBondContact O-N 2.83Å; Y359-D361 VanDerWaalsContact C-N 3.27Å; Y359-D361 PolarHBondContact O-N 2.8Å; D361-L363 VanDerWaalsContact C-N 3.34Å; D361-L363 PolarHBondContact O-N 3.14Å; D361-V364 PolarHBondContact O-N 3.03Å; D361-V365 WeakPolarHBondContact O-CG2 3.49Å; D361-V365 PolarHBondContact O-N 3.37Å
362	S	89.1	Confident	81.2	Confident	46 Å²	46	67.7 Å²	67.7	32%	0.322	36%	0.364	S	S	.	.	H	α-helix	trans	-61.9	-41.1	172.9	43.3	0	0	0	0	112.4	Y359 V364 V365 E366	Y359-S362 WeakPolarHBondContact CA-OG 3.1Å; Y359-S362 WeakPolarHBondContact CD2-OG 3.44Å; Y359-S362 PolarHBondContact O-N 2.98Å; Y359-S362 PolarHBondContact O-OG 2.79Å; S362-V364 VanDerWaalsContact C-N 3.32Å; S362-V364 PolarHBondContact O-N 3.33Å; S362-V365 PolarHBondContact O-N 2.99Å; S362-E366 WeakPolarHBondContact O-CG 3.4Å; S362-E366 PolarHBondContact O-N 3.47Å
363	L	86.3	Confident	79.4	Confident	19 Å²	19	64.6 Å²	64.6	10%	0.099	36%	0.355	C	S	.	.	H	α-helix	trans	-63.3	-38.7	176.4	-78.5	171.7	0	0	0	112.5	I42 Y359 L360 D361 E366 C367	I42-L363 HydrophobicContact CD1-CD1 3.81Å; I42-L363 HydrophobicContact CD1-CD2 4.3Å; I42-L363 HydrophobicContact CD1-CG 4.47Å; I42-L363 HydrophobicContact CG1-CD1 4.06Å; I42-L363 HydrophobicContact CG2-CD1 3.97Å; Y359-L363 HydrophobicContact CD1-CD1 3.5Å; Y359-L363 VanDerWaalsContact CD1-CD1 3.5Å; Y359-L363 HydrophobicContact CD1-CG 3.79Å; Y359-L363 HydrophobicContact CE1-CD1 3.28Å; Y359-L363 HydrophobicContact CE1-CD2 3.61Å; Y359-L363 HydrophobicContact CE1-CG 3.33Å; Y359-L363 HydrophobicContact CE2-CD2 4.42Å; Y359-L363 HydrophobicContact CE2-CG 4.17Å; Y359-L363 HydrophobicContact CG-CD1 4.44Å; Y359-L363 HydrophobicContact CG-CG 4.41Å; Y359-L363 WeakPolarHBondContact O-CG 3.42Å; Y359-L363 PolarHBondContact O-N 2.89Å; Y359-L363 WeakPolarHBondContact OH-CD2 3.1Å; L360-L363 WeakPolarHBondContact O-CB 3.46Å; L360-L363 PolarHBondContact O-N 3.18Å; D361-L363 VanDerWaalsContact C-N 3.34Å; D361-L363 PolarHBondContact O-N 3.14Å; L363-E366 PolarHBondContact O-N 3.35Å; L363-C367 VanDerWaalsContact O-CB 3.27Å; L363-C367 WeakPolarHBondContact O-CB 3.21Å; L363-C367 PolarHBondContact O-N 2.8Å; L363-C367 PolarHBondContact O-SG 3.16Å
364	V	85.4	Confident	77.7	Confident	5 Å²	5	70 Å²	70	3%	0.03	38%	0.38	C	S	.	.	H	α-helix	trans	-63.2	-46.2	176.7	164.8	0	0	0	0	110.1	M1 Y12 F346 P348 L360 D361 S362 C367 E368	M1-V364 HydrophobicContact CE-CG2 3.61Å; Y12-V364 HydrophobicContact CD1-CG2 4.42Å; Y12-V364 HydrophobicContact CD2-CG2 4.46Å; Y12-V364 HydrophobicContact CE1-CG1 4.15Å; Y12-V364 HydrophobicContact CE1-CG2 4.39Å; Y12-V364 HydrophobicContact CE2-CG1 3.88Å; Y12-V364 HydrophobicContact CE2-CG2 4.5Å; Y12-V364 HydrophobicContact CG-CG2 4.44Å; F346-V364 HydrophobicContact CD1-CG2 3.88Å; F346-V364 HydrophobicContact CE1-CG2 3.96Å; P348-V364 HydrophobicContact CG-CG1 3.86Å; L360-V364 HydrophobicContact CD2-CG2 3.82Å; L360-V364 VanDerWaalsContact O-CG2 3.32Å; L360-V364 WeakPolarHBondContact O-CG2 3.48Å; L360-V364 PolarHBondContact O-N 3.14Å; D361-V364 PolarHBondContact O-N 3.03Å; S362-V364 VanDerWaalsContact C-N 3.32Å; S362-V364 PolarHBondContact O-N 3.33Å; V364-C367 CarbonylContact O-C 3.45Å; V364-C367 PolarHBondContact O-N 2.87Å; V364-E368 VanDerWaalsContact O-CG 3.29Å; V364-E368 WeakPolarHBondContact O-CG 3.22Å; V364-E368 PolarHBondContact O-N 2.68Å
365	V	83.4	Confident	76.2	Confident	99 Å²	99	71.7 Å²	71.7	60%	0.6	39%	0.385	S	S	*	.	H	α-helix	trans	-61.1	-45.5	176.8	173.5	0	0	0	0	110.9	D361 S362 C367 E368	D361-V365 WeakPolarHBondContact O-CG2 3.49Å; D361-V365 PolarHBondContact O-N 3.37Å; S362-V365 PolarHBondContact O-N 2.99Å; V365-C367 VanDerWaalsContact C-N 3.29Å; V365-C367 PolarHBondContact O-N 2.87Å; V365-E368 WeakPolarHBondContact O-CB 3.37Å; V365-E368 PolarHBondContact O-N 3.3Å; V365-E368 VanDerWaalsContact O-N 3.15Å
366	E	80.6	Confident	75	Confident	135 Å²	135	71.7 Å²	71.7	63%	0.631	39%	0.392	S	S	*	.	H	α-helix	trans	-64.8	-30.9	175.9	-71.7	174.8	-170.9	0	0	113.3	S362 L363	S362-E366 WeakPolarHBondContact O-CG 3.4Å; S362-E366 PolarHBondContact O-N 3.47Å; L363-E366 PolarHBondContact O-N 3.35Å
367	C	75.9	Confident	74	Confident	62 Å²	62	72.5 Å²	72.5	42%	0.419	41%	0.408	S	S	.	.	H	α-helix	trans	-80.4	-16.9	176.1	-73.3	0	0	0	0	112.9	L363 V364 V365	L363-C367 VanDerWaalsContact O-CB 3.27Å; L363-C367 WeakPolarHBondContact O-CB 3.21Å; L363-C367 PolarHBondContact O-N 2.8Å; L363-C367 PolarHBondContact O-SG 3.16Å; V364-C367 CarbonylContact O-C 3.45Å; V364-C367 PolarHBondContact O-N 2.87Å; V365-C367 VanDerWaalsContact C-N 3.29Å; V365-C367 PolarHBondContact O-N 2.87Å
368	E	72.2	Confident	73.6	Confident	76 Å²	76	77.7 Å²	77.7	36%	0.355	43%	0.427	S	S	.	.	S	Bend	trans	-65.6	126.8	170.8	-62.7	-148.4	158.5	0	0	108	K10 Y12 V364 V365 D370	K10-E368 IonicContact NZ-OE1 3.45Å; K10-E368 PolarHBondContact NZ-OE1 2.88Å; K10-E368 IonicContact NZ-OE2 3Å; K10-E368 PolarHBondContact NZ-OE2 2.94Å; Y12-E368 PolarHBondContact OH-OE1 3.38Å; V364-E368 VanDerWaalsContact O-CG 3.29Å; V364-E368 WeakPolarHBondContact O-CG 3.22Å; V364-E368 PolarHBondContact O-N 2.68Å; V365-E368 WeakPolarHBondContact O-CB 3.37Å; V365-E368 PolarHBondContact O-N 3.3Å; V365-E368 VanDerWaalsContact O-N 3.15Å; E368-D370 PolarHBondContact O-N 3.31Å
369	P	61	Low	73.4	Confident	72 Å²	72	77.9 Å²	77.9	47%	0.468	42%	0.418	S	S	.	.			trans	-66.2	106.6	179.5	26.9	-32.2	0	0	0	107.5	V371 M374	P369-V371 PolarHBondContact O-N 2.87Å; P369-M374 HydrophobicContact CB-CE 4.02Å; P369-M374 HydrophobicContact CG-CE 3.9Å
370	D	54.5	Low	73.3	Confident	102 Å²	102	74.6 Å²	74.6	55%	0.545	41%	0.406	S	S	.	.			trans	-53.9	130.6	169.3	-78.9	-31.6	0	0	0	107.5	E368 T372 T373	E368-D370 PolarHBondContact O-N 3.31Å; D370-T372 VanDerWaalsContact CB-OG1 3.28Å; D370-T372 WeakPolarHBondContact CB-OG1 3.35Å; D370-T372 PolarHBondContact O-N 2.86Å; D370-T373 HydrophobicContact CB-CG2 4.31Å; D370-T373 PolarHBondContact O-N 2.86Å; D370-T373 PolarHBondContact O-OG1 2.88Å
371	V	56.3	Low	73.1	Confident	96 Å²	96	74.6 Å²	74.6	58%	0.582	41%	0.406	S	S	*	.	H	α-helix	trans	-52.4	-29.6	179.5	-176.1	0	0	0	0	110.4	P369 M374 Y375	P369-V371 PolarHBondContact O-N 2.87Å; V371-M374 PolarHBondContact O-N 3.39Å; V371-Y375 HydrophobicContact CG1-CD2 4.29Å; V371-Y375 HydrophobicContact CG1-CE2 3.94Å; V371-Y375 WeakPolarHBondContact O-CD2 3.29Å
372	T	53.8	Low	73.2	Confident	100 Å²	100	74.2 Å²	74.2	61%	0.613	41%	0.406	S	S	*	.	H	α-helix	trans	-60.1	-43.4	174.6	53.6	0	0	0	0	113	D370 M374 Y375 D376	D370-T372 VanDerWaalsContact CB-OG1 3.28Å; D370-T372 WeakPolarHBondContact CB-OG1 3.35Å; D370-T372 PolarHBondContact O-N 2.86Å; T372-M374 VanDerWaalsContact C-N 3.32Å; T372-M374 PolarHBondContact O-N 2.96Å; T372-Y375 CarbonylContact O-C 3.54Å; T372-Y375 PolarHBondContact O-N 3.39Å; T372-Y375 VanDerWaalsContact O-N 3.15Å; T372-D376 PolarHBondContact O-N 2.85Å; T372-D376 VanDerWaalsContact O-N 3.15Å
373	T	56.7	Low	73	Confident	79 Å²	79	80.3 Å²	80.3	49%	0.485	42%	0.422	S	S	.	.	H	α-helix	trans	-70.7	-24.6	-179.4	63.3	0	0	0	0	113.7	D370 Y375 D376	D370-T373 HydrophobicContact CB-CG2 4.31Å; D370-T373 PolarHBondContact O-N 2.86Å; D370-T373 PolarHBondContact O-OG1 2.88Å; T373-Y375 PolarHBondContact O-N 3.44Å; T373-D376 PolarHBondContact O-N 2.83Å
374	M	56.2	Low	73.1	Confident	119 Å²	119	86.8 Å²	86.8	59%	0.586	45%	0.452	S	S	*	.	H	α-helix	trans	-68.4	-23	173.2	-72.9	-156.1	-165.4	0	0	112.8	P369 V371 T372	P369-M374 HydrophobicContact CB-CE 4.02Å; P369-M374 HydrophobicContact CG-CE 3.9Å; V371-M374 PolarHBondContact O-N 3.39Å; T372-M374 VanDerWaalsContact C-N 3.32Å; T372-M374 PolarHBondContact O-N 2.96Å
375	Y	62.2	Low	73.1	Confident	51 Å²	51	91 Å²	91	20%	0.2	47%	0.471	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	7.5	178.2	-62.1	-71.2	0	0	0	112.7	V371 T372 T373 G377 Y378 F408	V371-Y375 HydrophobicContact CG1-CD2 4.29Å; V371-Y375 HydrophobicContact CG1-CE2 3.94Å; V371-Y375 WeakPolarHBondContact O-CD2 3.29Å; T372-Y375 CarbonylContact O-C 3.54Å; T372-Y375 PolarHBondContact O-N 3.39Å; T372-Y375 VanDerWaalsContact O-N 3.15Å; T373-Y375 PolarHBondContact O-N 3.44Å; Y375-G377 PolarHBondContact O-N 2.72Å; Y375-Y378 PolarHBondContact O-N 2.82Å; Y375-F408 HydrophobicContact CD1-CB 4.35Å; Y375-F408 AromaticContact CD1-CD1 3.76Å; Y375-F408 HydrophobicContact CD1-CD1 3.76Å; Y375-F408 AromaticContact CD1-CD2 3.66Å; Y375-F408 HydrophobicContact CD1-CD2 3.66Å; Y375-F408 AromaticContact CD1-CE1 3.84Å; Y375-F408 HydrophobicContact CD1-CE1 3.84Å; Y375-F408 AromaticContact CD1-CE2 3.72Å; Y375-F408 HydrophobicContact CD1-CE2 3.72Å; Y375-F408 AromaticContact CD1-CG 3.67Å; Y375-F408 HydrophobicContact CD1-CG 3.67Å; Y375-F408 AromaticContact CD1-CZ 3.82Å; Y375-F408 HydrophobicContact CD1-CZ 3.82Å; Y375-F408 HydrophobicContact CD2-CE2 4.44Å; Y375-F408 HydrophobicContact CD2-CZ 4.22Å; Y375-F408 HydrophobicContact CE1-CB 4.45Å; Y375-F408 HydrophobicContact CE1-CD1 4.33Å; Y375-F408 AromaticContact CE1-CD2 3.35Å; Y375-F408 HydrophobicContact CE1-CD2 3.35Å; Y375-F408 HydrophobicContact CE1-CE1 4.43Å; Y375-F408 AromaticContact CE1-CE2 3.46Å; Y375-F408 HydrophobicContact CE1-CE2 3.46Å; Y375-F408 VanDerWaalsContact CE1-CE2 3.46Å; Y375-F408 AromaticContact CE1-CG 3.81Å; Y375-F408 HydrophobicContact CE1-CG 3.81Å; Y375-F408 HydrophobicContact CE1-CZ 4.03Å; Y375-F408 HydrophobicContact CE2-CE2 4.24Å; Y375-F408 HydrophobicContact CE2-CZ 4.43Å; Y375-F408 HydrophobicContact CG-CD1 4.31Å; Y375-F408 AromaticContact CG-CE1 3.97Å; Y375-F408 HydrophobicContact CG-CE1 3.97Å; Y375-F408 HydrophobicContact CG-CE2 4.21Å; Y375-F408 AromaticContact CG-CZ 3.92Å; Y375-F408 HydrophobicContact CG-CZ 3.92Å; Y375-F408 AromaticContact CZ-CE2 3.74Å
376	D	63.3	Low	73.3	Confident	134 Å²	134	86.3 Å²	86.3	72%	0.717	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	120	176.4	-121.7	-12.2	0	0	0	109.3	T372 T373	T372-D376 PolarHBondContact O-N 2.85Å; T372-D376 VanDerWaalsContact O-N 3.15Å; T373-D376 PolarHBondContact O-N 2.83Å
377	G	72	Confident	73.5	Confident	44 Å²	44	82.5 Å²	82.5	45%	0.454	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	89	6.8	-169	0	0	0	0	0	115	Y375 A411	Y375-G377 PolarHBondContact O-N 2.72Å; G377-A411 VanDerWaalsContact O-CB 3.25Å; G377-A411 WeakPolarHBondContact O-CB 3.33Å; G377-A411 PolarHBondContact O-N 2.68Å
378	Y	80.8	Confident	73.9	Confident	119 Å²	119	85.8 Å²	85.8	47%	0.467	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	137.6	167.5	-70.6	-95.5	0	0	0	110.7	Y375 F408 I409	Y375-Y378 PolarHBondContact O-N 2.82Å; Y378-F408 HydrophobicContact CD1-CB 4.42Å; Y378-I409 CarbonylContact C-O 3.55Å; Y378-I409 WeakPolarHBondContact CA-O 3.45Å; Y378-I409 WeakPolarHBondContact CB-O 3.11Å; Y378-I409 VanDerWaalsContact CD1-C 3.42Å; Y378-I409 WeakPolarHBondContact CD1-O 3.21Å
379	K	82.8	Confident	74.4	Confident	88 Å²	88	83 Å²	83	38%	0.383	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	131.6	174.9	-166.2	177.3	-176.2	178.2	0	109.3	I409 Y414	K379-I409 HydrophobicContact CB-CG2 4.32Å; K379-I409 PolarHBondContact N-O 3.44Å; K379-I409 PolarHBondContact O-N 2.88Å; K379-Y414 HydrophobicContact CD-CD1 3.51Å; K379-Y414 HydrophobicContact CD-CD2 4.24Å; K379-Y414 HydrophobicContact CD-CE1 3.43Å; K379-Y414 VanDerWaalsContact CD-CE1 3.43Å; K379-Y414 HydrophobicContact CD-CE2 4.12Å; K379-Y414 HydrophobicContact CD-CG 3.9Å; K379-Y414 PolarHBondContact NZ-OH 3.46Å
380	F	87.1	Confident	75.4	Confident	71 Å²	71	82.3 Å²	82.3	31%	0.311	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	131.1	173.2	-175.8	-101.5	0	0	0	110.4	T382 Y403 F408	F380-T382 HydrophobicContact CE1-CG2 4.33Å; F380-Y403 HydrophobicContact CE2-CD1 4.28Å; F380-Y403 WeakPolarHBondContact CE2-O 3.03Å; F380-F408 HydrophobicContact CB-CD1 4.07Å; F380-F408 HydrophobicContact CB-CE1 3.75Å; F380-F408 HydrophobicContact CB-CZ 4.35Å; F380-F408 HydrophobicContact CD2-CD1 4.32Å; F380-F408 HydrophobicContact CD2-CD2 4.3Å; F380-F408 HydrophobicContact CD2-CE1 4.05Å; F380-F408 HydrophobicContact CD2-CE2 4.05Å; F380-F408 HydrophobicContact CD2-CG 4.44Å; F380-F408 AromaticContact CD2-CZ 3.91Å; F380-F408 HydrophobicContact CD2-CZ 3.91Å; F380-F408 HydrophobicContact CG-CE1 4.38Å
381	I	86.8	Confident	76.6	Confident	1 Å²	1	77.9 Å²	77.9	1%	0.005	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	132.8	-178.3	-57.6	177	0	0	0	108.8	Q385 L386 L389 G406 Y407 I409 Y414	I381-Q385 HydrophobicContact CG2-CB 3.49Å; I381-Q385 VanDerWaalsContact CG2-CB 3.49Å; I381-L386 HydrophobicContact CG2-CB 4.02Å; I381-L386 HydrophobicContact CG2-CD1 4.33Å; I381-L389 HydrophobicContact CD1-CD1 4.46Å; I381-G406 CarbonylContact O-C 3.42Å; I381-G406 VanDerWaalsContact O-CA 3.27Å; I381-G406 WeakPolarHBondContact O-CA 3.43Å; I381-Y407 PolarHBondContact N-O 2.85Å; I381-Y407 PolarHBondContact O-N 2.92Å; I381-I409 HydrophobicContact CD1-CB 4.17Å; I381-I409 HydrophobicContact CD1-CG2 3.35Å; I381-I409 HydrophobicContact CG1-CG2 4.16Å; I381-Y414 HydrophobicContact CD1-CD2 3.33Å; I381-Y414 HydrophobicContact CD1-CE2 3.44Å; I381-Y414 VanDerWaalsContact CD1-CE2 3.44Å; I381-Y414 HydrophobicContact CD1-CG 4.44Å; I381-Y414 HydrophobicContact CG1-CD2 4.33Å; I381-Y414 HydrophobicContact CG1-CE2 4.14Å
382	T	90	Very high	77.8	Confident	41 Å²	41	76.6 Å²	76.6	25%	0.252	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	157.4	175.1	62.3	0	0	0	0	111.1	F380 Q384 Q385 L386	F380-T382 HydrophobicContact CE1-CG2 4.33Å; T382-Q384 PolarHBondContact O-N 2.71Å; T382-Q384 VanDerWaalsContact O-N 3.12Å; T382-Q385 PolarHBondContact O-N 3Å; T382-Q385 VanDerWaalsContact O-N 3.14Å; T382-Q385 WeakPolarHBondContact OG1-CG 3.44Å; T382-Q385 PolarHBondContact OG1-N 2.83Å; T382-L386 WeakPolarHBondContact O-CB 3.23Å; T382-L386 PolarHBondContact O-N 2.92Å
383	R	86.5	Confident	79.3	Confident	174 Å²	174	80.4 Å²	80.4	66%	0.657	42%	0.424	S	S	*	.	H	α-helix	trans	-56.7	-31	179.4	-168.2	174.2	-179.4	-175.6	0.1	113.4	A387 Y407	R383-A387 PolarHBondContact O-N 3.04Å; R383-A387 VanDerWaalsContact O-N 3.16Å; R383-Y407 HydrophobicContact CB-CE2 4.5Å; R383-Y407 HydrophobicContact CG-CE2 4.45Å
384	Q	88.2	Confident	80.5	Confident	155 Å²	155	79 Å²	79	72%	0.724	41%	0.413	S	S	*	.	H	α-helix	trans	-68.1	-52.6	175.2	-69.8	176.7	-14.1	0	0	111.4	T382 L386 A387 D388	T382-Q384 PolarHBondContact O-N 2.71Å; T382-Q384 VanDerWaalsContact O-N 3.12Å; Q384-L386 PolarHBondContact O-N 2.79Å; Q384-A387 WeakPolarHBondContact O-CA 3.26Å; Q384-A387 WeakPolarHBondContact O-CB 3.49Å; Q384-A387 PolarHBondContact O-N 3.4Å; Q384-D388 VanDerWaalsContact O-CG 3.25Å; Q384-D388 PolarHBondContact O-N 2.73Å
385	Q	84.8	Confident	81.8	Confident	92 Å²	92	76.5 Å²	76.5	43%	0.43	40%	0.401	S	S	.	.	H	α-helix	trans	-59.7	-32	177	-71.5	174.2	-8.6	0	0	112.5	I381 T382 D388 L389	I381-Q385 HydrophobicContact CG2-CB 3.49Å; I381-Q385 VanDerWaalsContact CG2-CB 3.49Å; T382-Q385 PolarHBondContact O-N 3Å; T382-Q385 VanDerWaalsContact O-N 3.14Å; T382-Q385 WeakPolarHBondContact OG1-CG 3.44Å; T382-Q385 PolarHBondContact OG1-N 2.83Å; Q385-D388 PolarHBondContact O-N 3.11Å; Q385-L389 WeakPolarHBondContact O-CB 3.41Å; Q385-L389 WeakPolarHBondContact O-CD1 3.5Å; Q385-L389 WeakPolarHBondContact O-CG 3.35Å; Q385-L389 PolarHBondContact O-N 2.6Å
386	L	86.6	Confident	82.6	Confident	1 Å²	1	77.9 Å²	77.9	1%	0.005	43%	0.431	C	S	.	.	H	α-helix	trans	-71.5	-33.8	177.3	-154.1	135.4	0	0	0	112.3	I381 T382 Q384 M391 I395 L400 Y407	I381-L386 HydrophobicContact CG2-CB 4.02Å; I381-L386 HydrophobicContact CG2-CD1 4.33Å; T382-L386 WeakPolarHBondContact O-CB 3.23Å; T382-L386 PolarHBondContact O-N 2.92Å; Q384-L386 PolarHBondContact O-N 2.79Å; L386-M391 HydrophobicContact CD2-CB 3.88Å; L386-M391 VanDerWaalsContact CD2-O 3.23Å; L386-M391 WeakPolarHBondContact CD2-O 3.32Å; L386-M391 HydrophobicContact CG-CB 3.99Å; L386-M391 PolarHBondContact O-N 2.9Å; L386-I395 HydrophobicContact CD2-CD1 4.1Å; L386-I395 HydrophobicContact CD2-CG1 3.89Å; L386-L400 HydrophobicContact CD1-CD1 3.6Å; L386-L400 HydrophobicContact CD1-CD2 3.79Å; L386-L400 HydrophobicContact CD1-CG 4.36Å; L386-L400 HydrophobicContact CD2-CD1 3.94Å; L386-L400 HydrophobicContact CG-CD1 4.31Å; L386-Y407 HydrophobicContact CD1-CD2 3.82Å; L386-Y407 HydrophobicContact CD1-CG 4.12Å
387	A	85.5	Confident	83.6	Confident	56 Å²	56	74 Å²	74	46%	0.463	41%	0.412	S	S	.	.	H	α-helix	trans	-70.5	-41.2	171.1	0	0	0	0	0	111.5	R383 Q384 L389 G390	R383-A387 PolarHBondContact O-N 3.04Å; R383-A387 VanDerWaalsContact O-N 3.16Å; Q384-A387 WeakPolarHBondContact O-CA 3.26Å; Q384-A387 WeakPolarHBondContact O-CB 3.49Å; Q384-A387 PolarHBondContact O-N 3.4Å; A387-L389 VanDerWaalsContact C-N 3.29Å; A387-L389 PolarHBondContact O-N 2.8Å; A387-G390 PolarHBondContact O-N 2.75Å
388	D	84.9	Confident	84.1	Confident	130 Å²	130	81.5 Å²	81.5	70%	0.695	44%	0.435	S	S	*	.	H	α-helix	trans	-63.6	-34.5	178.3	-61.2	-25.4	0	0	0	112.2	Q384 Q385 G390	Q384-D388 VanDerWaalsContact O-CG 3.25Å; Q384-D388 PolarHBondContact O-N 2.73Å; Q385-D388 PolarHBondContact O-N 3.11Å; D388-G390 PolarHBondContact O-N 2.7Å
389	L	82.3	Confident	84.2	Confident	17 Å²	17	81.8 Å²	81.8	9%	0.089	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	2.6	175.2	-66.7	167.3	0	0	0	113.4	I381 Q385 A387 M391 Y414 L421 I423	I381-L389 HydrophobicContact CD1-CD1 4.46Å; Q385-L389 WeakPolarHBondContact O-CB 3.41Å; Q385-L389 WeakPolarHBondContact O-CD1 3.5Å; Q385-L389 WeakPolarHBondContact O-CG 3.35Å; Q385-L389 PolarHBondContact O-N 2.6Å; A387-L389 VanDerWaalsContact C-N 3.29Å; A387-L389 PolarHBondContact O-N 2.8Å; L389-M391 HydrophobicContact CB-CE 4.2Å; L389-M391 HydrophobicContact CB-CG 4.16Å; L389-M391 HydrophobicContact CB-SD 4.47Å; L389-M391 HydrophobicContact CD1-CE 4.3Å; L389-M391 PolarHBondContact O-N 3.36Å; L389-Y414 HydrophobicContact CD1-CD2 4.31Å; L389-Y414 HydrophobicContact CD1-CE2 3.63Å; L389-L421 HydrophobicContact CB-CD1 4.18Å; L389-L421 HydrophobicContact CD2-CD1 3.6Å; L389-I423 HydrophobicContact CD2-CD1 4.25Å
390	G	82.2	Confident	84.2	Confident	59 Å²	59	78.2 Å²	78.2	61%	0.608	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	18.9	-178.9	0	0	0	0	0	114.4	A387 D388	A387-G390 PolarHBondContact O-N 2.75Å; D388-G390 PolarHBondContact O-N 2.7Å
391	M	79.1	Confident	83.9	Confident	9 Å²	9	82.7 Å²	82.7	4%	0.044	44%	0.439	C	S	.	.			trans	-95.8	12.3	-174.6	-69.6	-174	-165.2	0	0	114	L386 L389 E393 L394 I409 V417	L386-M391 HydrophobicContact CD2-CB 3.88Å; L386-M391 VanDerWaalsContact CD2-O 3.23Å; L386-M391 WeakPolarHBondContact CD2-O 3.32Å; L386-M391 HydrophobicContact CG-CB 3.99Å; L386-M391 PolarHBondContact O-N 2.9Å; L389-M391 HydrophobicContact CB-CE 4.2Å; L389-M391 HydrophobicContact CB-CG 4.16Å; L389-M391 HydrophobicContact CB-SD 4.47Å; L389-M391 HydrophobicContact CD1-CE 4.3Å; L389-M391 PolarHBondContact O-N 3.36Å; M391-E393 PolarHBondContact O-N 2.97Å; M391-E393 VanDerWaalsContact O-N 3.1Å; M391-L394 HydrophobicContact CB-CD1 4.1Å; M391-L394 HydrophobicContact CG-CD1 4.12Å; M391-L394 WeakPolarHBondContact O-CB 3.44Å; M391-L394 PolarHBondContact O-N 2.87Å; M391-L394 HydrophobicContact SD-CD1 4.31Å; M391-I409 HydrophobicContact CE-CD1 4.1Å; M391-I409 HydrophobicContact SD-CD1 3.54Å; M391-I409 VanDerWaalsContact SD-CD1 3.54Å; M391-V417 HydrophobicContact CE-CB 3.27Å; M391-V417 HydrophobicContact CE-CG1 3.15Å; M391-V417 HydrophobicContact CE-CG2 3.6Å
392	S	82.4	Confident	83.8	Confident	68 Å²	68	86.2 Å²	86.2	48%	0.476	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-59.1	-26.8	-174.4	47.8	0	0	0	0	113.9	L394 I395	S392-L394 VanDerWaalsContact C-N 3.26Å; S392-L394 PolarHBondContact O-N 2.86Å; S392-I395 WeakPolarHBondContact O-CB 3.48Å; S392-I395 WeakPolarHBondContact O-CD1 3.37Å; S392-I395 VanDerWaalsContact O-CG1 3.27Å; S392-I395 WeakPolarHBondContact O-CG1 3.44Å; S392-I395 PolarHBondContact O-N 3.43Å
393	E	83.9	Confident	83.4	Confident	181 Å²	181	88.7 Å²	88.7	85%	0.846	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-70.2	-20.3	177.2	-62.2	-175.4	175.4	0	0	113.5	M391 I395	M391-E393 PolarHBondContact O-N 2.97Å; M391-E393 VanDerWaalsContact O-N 3.1Å; E393-I395 PolarHBondContact O-N 2.73Å
394	L	82	Confident	83.2	Confident	50 Å²	50	88 Å²	88	26%	0.262	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-76.6	-9.6	178.1	-67	171.4	0	0	0	112.5	M391 S392 G396 T397 F399 L400	M391-L394 HydrophobicContact CB-CD1 4.1Å; M391-L394 HydrophobicContact CG-CD1 4.12Å; M391-L394 WeakPolarHBondContact O-CB 3.44Å; M391-L394 PolarHBondContact O-N 2.87Å; M391-L394 HydrophobicContact SD-CD1 4.31Å; S392-L394 VanDerWaalsContact C-N 3.26Å; S392-L394 PolarHBondContact O-N 2.86Å; L394-G396 PolarHBondContact O-N 2.81Å; L394-T397 PolarHBondContact O-N 3.13Å; L394-T397 PolarHBondContact O-OG1 3Å; L394-F399 HydrophobicContact CD2-CD2 4.44Å; L394-L400 HydrophobicContact CB-CD1 3.57Å; L394-L400 HydrophobicContact CB-CG 4.15Å
395	I	83.9	Confident	83	Confident	66 Å²	66	87 Å²	87	34%	0.338	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	116.4	178.1	-61.9	172.6	0	0	0	108.9	L386 S392 E393 L400 Y407	L386-I395 HydrophobicContact CD2-CD1 4.1Å; L386-I395 HydrophobicContact CD2-CG1 3.89Å; S392-I395 WeakPolarHBondContact O-CB 3.48Å; S392-I395 WeakPolarHBondContact O-CD1 3.37Å; S392-I395 VanDerWaalsContact O-CG1 3.27Å; S392-I395 WeakPolarHBondContact O-CG1 3.44Å; S392-I395 PolarHBondContact O-N 3.43Å; E393-I395 PolarHBondContact O-N 2.73Å; I395-L400 HydrophobicContact CG1-CD1 4.39Å; I395-Y407 HydrophobicContact CD1-CE2 4.35Å; I395-Y407 HydrophobicContact CG1-CE2 4.38Å; I395-Y407 HydrophobicContact CG2-CE1 4.15Å; I395-Y407 WeakPolarHBondContact CG2-OH 3.28Å
396	G	78.6	Confident	83	Confident	80 Å²	80	82.9 Å²	82.9	83%	0.825	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.4	-7.7	-176.9	0	0	0	0	0	114.3	L394	L394-G396 PolarHBondContact O-N 2.81Å
397	T	85.2	Confident	83.1	Confident	53 Å²	53	84.5 Å²	84.5	33%	0.325	46%	0.463	S	S	.	.	S	Bend	trans	-86.2	165.3	171.3	68.7	0	0	0	0	111.9	L394 F399 L400	L394-T397 PolarHBondContact O-N 3.13Å; L394-T397 PolarHBondContact O-OG1 3Å; T397-F399 PolarHBondContact O-N 2.98Å; T397-F399 VanDerWaalsContact O-N 3.17Å; T397-L400 PolarHBondContact O-N 3.26Å
398	Q	82.8	Confident	83.2	Confident	201 Å²	201	82.9 Å²	82.9	94%	0.939	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-12.9	178.5	-62	-179.4	5.4	0	0	113.9
399	F	81.6	Confident	83.4	Confident	124 Å²	124	76.7 Å²	76.7	54%	0.544	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-23.6	-177	-61.4	-70.9	0	0	0	113.7	L394 T397 L413	L394-F399 HydrophobicContact CD2-CD2 4.44Å; T397-F399 PolarHBondContact O-N 2.98Å; T397-F399 VanDerWaalsContact O-N 3.17Å; F399-L413 HydrophobicContact CD1-CD1 3.98Å; F399-L413 HydrophobicContact CG-CD1 4.46Å
400	L	83.8	Confident	83.6	Confident	13 Å²	13	77.6 Å²	77.6	7%	0.068	42%	0.42	C	S	.	.			trans	-115.2	119.2	177.9	-71.1	177.2	0	0	0	110.1	L386 L394 I395 T397 Y407 I409	L386-L400 HydrophobicContact CD1-CD1 3.6Å; L386-L400 HydrophobicContact CD1-CD2 3.79Å; L386-L400 HydrophobicContact CD1-CG 4.36Å; L386-L400 HydrophobicContact CD2-CD1 3.94Å; L386-L400 HydrophobicContact CG-CD1 4.31Å; L394-L400 HydrophobicContact CB-CD1 3.57Å; L394-L400 HydrophobicContact CB-CG 4.15Å; I395-L400 HydrophobicContact CG1-CD1 4.39Å; T397-L400 PolarHBondContact O-N 3.26Å; L400-Y407 HydrophobicContact CB-CD1 4.17Å; L400-Y407 HydrophobicContact CB-CG 4.48Å; L400-I409 HydrophobicContact CD2-CB 3.72Å; L400-I409 HydrophobicContact CD2-CD1 3.81Å; L400-I409 HydrophobicContact CD2-CG1 3.72Å
401	R	81.3	Confident	83.6	Confident	166 Å²	166	76.1 Å²	76.1	63%	0.626	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.1	113.6	176.2	-163	170.6	-172.8	170.1	1.5	109.6	Y403 Y407 F408	R401-Y403 PolarHBondContact O-N 3Å; R401-Y407 CarbonylContact O-C 3.58Å; R401-Y407 WeakPolarHBondContact O-CA 3.49Å; R401-F408 HydrophobicContact CB-CB 4.34Å; R401-F408 PolarHBondContact N-O 2.85Å; R401-F408 PolarHBondContact O-N 2.88Å
402	A	83.4	Confident	83.9	Confident	75 Å²	75	81.4 Å²	81.4	62%	0.62	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.4	132.8	179.1	0	0	0	0	0	110.9	Y407	A402-Y407 HydrophobicContact CB-CD1 4.05Å; A402-Y407 HydrophobicContact CB-CE1 3.97Å
403	Y	81.9	Confident	84	Confident	93 Å²	93	80 Å²	80	37%	0.365	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	118.3	174.5	-171.1	-99.9	0	0	0	110.9	F380 R401 H405 G406 F408	F380-Y403 HydrophobicContact CE2-CD1 4.28Å; F380-Y403 WeakPolarHBondContact CE2-O 3.03Å; R401-Y403 PolarHBondContact O-N 3Å; Y403-H405 PolarHBondContact O-N 2.95Å; Y403-G406 PolarHBondContact N-O 3.06Å; Y403-G406 CarbonylContact O-C 3.57Å; Y403-G406 PolarHBondContact O-N 2.85Å; Y403-G406 VanDerWaalsContact O-O 3.12Å; Y403-F408 VanDerWaalsContact CB-CE2 3.46Å; Y403-F408 AromaticContact CD1-CE2 3.58Å; Y403-F408 HydrophobicContact CD1-CE2 3.58Å; Y403-F408 HydrophobicContact CD1-CZ 4.23Å; Y403-F408 HydrophobicContact CD2-CE2 4.12Å; Y403-F408 HydrophobicContact CE1-CE2 4.32Å; Y403-F408 HydrophobicContact CG-CD2 4.07Å; Y403-F408 AromaticContact CG-CE2 3.46Å; Y403-F408 HydrophobicContact CG-CE2 3.46Å; Y403-F408 VanDerWaalsContact CG-CE2 3.46Å; Y403-F408 HydrophobicContact CG-CZ 4.5Å
404	M	81.9	Confident	84	Confident	160 Å²	160	72.3 Å²	72.3	79%	0.788	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	-97.7	-174.3	-62.7	-164.8	177.1	0	0	113.6
405	H	84.1	Confident	84.2	Confident	134 Å²	134	73.8 Å²	73.8	62%	0.62	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.2	12.4	-175.8	55.9	-88.4	0	0	0	113.1	Y403	Y403-H405 PolarHBondContact O-N 2.95Å
406	G	86.6	Confident	84.3	Confident	4 Å²	4	77 Å²	77	4%	0.041	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	-164.2	179	0	0	0	0	0	112.1	I381 Y403	I381-G406 CarbonylContact O-C 3.42Å; I381-G406 VanDerWaalsContact O-CA 3.27Å; I381-G406 WeakPolarHBondContact O-CA 3.43Å; Y403-G406 PolarHBondContact N-O 3.06Å; Y403-G406 CarbonylContact O-C 3.57Å; Y403-G406 PolarHBondContact O-N 2.85Å; Y403-G406 VanDerWaalsContact O-O 3.12Å
407	Y	88.5	Confident	84.4	Confident	35 Å²	35	74.9 Å²	74.9	14%	0.137	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	142.2	-178.2	-57.6	-90.3	0	0	0	109.6	I381 R383 L386 I395 L400 R401 A402	I381-Y407 PolarHBondContact N-O 2.85Å; I381-Y407 PolarHBondContact O-N 2.92Å; R383-Y407 HydrophobicContact CB-CE2 4.5Å; R383-Y407 HydrophobicContact CG-CE2 4.45Å; L386-Y407 HydrophobicContact CD1-CD2 3.82Å; L386-Y407 HydrophobicContact CD1-CG 4.12Å; I395-Y407 HydrophobicContact CD1-CE2 4.35Å; I395-Y407 HydrophobicContact CG1-CE2 4.38Å; I395-Y407 HydrophobicContact CG2-CE1 4.15Å; I395-Y407 WeakPolarHBondContact CG2-OH 3.28Å; L400-Y407 HydrophobicContact CB-CD1 4.17Å; L400-Y407 HydrophobicContact CB-CG 4.48Å; R401-Y407 CarbonylContact O-C 3.58Å; R401-Y407 WeakPolarHBondContact O-CA 3.49Å; A402-Y407 HydrophobicContact CB-CD1 4.05Å; A402-Y407 HydrophobicContact CB-CE1 3.97Å
408	F	87.7	Confident	84.3	Confident	23 Å²	23	73.6 Å²	73.6	10%	0.101	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	127.7	165.4	-76	-76.3	0	0	0	109.6	Y375 Y378 F380 R401 Y403	Y375-F408 HydrophobicContact CD1-CB 4.35Å; Y375-F408 AromaticContact CD1-CD1 3.76Å; Y375-F408 HydrophobicContact CD1-CD1 3.76Å; Y375-F408 AromaticContact CD1-CD2 3.66Å; Y375-F408 HydrophobicContact CD1-CD2 3.66Å; Y375-F408 AromaticContact CD1-CE1 3.84Å; Y375-F408 HydrophobicContact CD1-CE1 3.84Å; Y375-F408 AromaticContact CD1-CE2 3.72Å; Y375-F408 HydrophobicContact CD1-CE2 3.72Å; Y375-F408 AromaticContact CD1-CG 3.67Å; Y375-F408 HydrophobicContact CD1-CG 3.67Å; Y375-F408 AromaticContact CD1-CZ 3.82Å; Y375-F408 HydrophobicContact CD1-CZ 3.82Å; Y375-F408 HydrophobicContact CD2-CE2 4.44Å; Y375-F408 HydrophobicContact CD2-CZ 4.22Å; Y375-F408 HydrophobicContact CE1-CB 4.45Å; Y375-F408 HydrophobicContact CE1-CD1 4.33Å; Y375-F408 AromaticContact CE1-CD2 3.35Å; Y375-F408 HydrophobicContact CE1-CD2 3.35Å; Y375-F408 HydrophobicContact CE1-CE1 4.43Å; Y375-F408 AromaticContact CE1-CE2 3.46Å; Y375-F408 HydrophobicContact CE1-CE2 3.46Å; Y375-F408 VanDerWaalsContact CE1-CE2 3.46Å; Y375-F408 AromaticContact CE1-CG 3.81Å; Y375-F408 HydrophobicContact CE1-CG 3.81Å; Y375-F408 HydrophobicContact CE1-CZ 4.03Å; Y375-F408 HydrophobicContact CE2-CE2 4.24Å; Y375-F408 HydrophobicContact CE2-CZ 4.43Å; Y375-F408 HydrophobicContact CG-CD1 4.31Å; Y375-F408 AromaticContact CG-CE1 3.97Å; Y375-F408 HydrophobicContact CG-CE1 3.97Å; Y375-F408 HydrophobicContact CG-CE2 4.21Å; Y375-F408 AromaticContact CG-CZ 3.92Å; Y375-F408 HydrophobicContact CG-CZ 3.92Å; Y375-F408 AromaticContact CZ-CE2 3.74Å; Y378-F408 HydrophobicContact CD1-CB 4.42Å; F380-F408 HydrophobicContact CB-CD1 4.07Å; F380-F408 HydrophobicContact CB-CE1 3.75Å; F380-F408 HydrophobicContact CB-CZ 4.35Å; F380-F408 HydrophobicContact CD2-CD1 4.32Å; F380-F408 HydrophobicContact CD2-CD2 4.3Å; F380-F408 HydrophobicContact CD2-CE1 4.05Å; F380-F408 HydrophobicContact CD2-CE2 4.05Å; F380-F408 HydrophobicContact CD2-CG 4.44Å; F380-F408 AromaticContact CD2-CZ 3.91Å; F380-F408 HydrophobicContact CD2-CZ 3.91Å; F380-F408 HydrophobicContact CG-CE1 4.38Å; R401-F408 HydrophobicContact CB-CB 4.34Å; R401-F408 PolarHBondContact N-O 2.85Å; R401-F408 PolarHBondContact O-N 2.88Å; Y403-F408 VanDerWaalsContact CB-CE2 3.46Å; Y403-F408 AromaticContact CD1-CE2 3.58Å; Y403-F408 HydrophobicContact CD1-CE2 3.58Å; Y403-F408 HydrophobicContact CD1-CZ 4.23Å; Y403-F408 HydrophobicContact CD2-CE2 4.12Å; Y403-F408 HydrophobicContact CE1-CE2 4.32Å; Y403-F408 HydrophobicContact CG-CD2 4.07Å; Y403-F408 AromaticContact CG-CE2 3.46Å; Y403-F408 HydrophobicContact CG-CE2 3.46Å; Y403-F408 VanDerWaalsContact CG-CE2 3.46Å; Y403-F408 HydrophobicContact CG-CZ 4.5Å
409	I	87.6	Confident	84.3	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	151.9	172.5	-157.9	170	0	0	0	109.1	Y378 K379 I381 M391 L400 L413 Y414	Y378-I409 CarbonylContact C-O 3.55Å; Y378-I409 WeakPolarHBondContact CA-O 3.45Å; Y378-I409 WeakPolarHBondContact CB-O 3.11Å; Y378-I409 VanDerWaalsContact CD1-C 3.42Å; Y378-I409 WeakPolarHBondContact CD1-O 3.21Å; K379-I409 HydrophobicContact CB-CG2 4.32Å; K379-I409 PolarHBondContact N-O 3.44Å; K379-I409 PolarHBondContact O-N 2.88Å; I381-I409 HydrophobicContact CD1-CB 4.17Å; I381-I409 HydrophobicContact CD1-CG2 3.35Å; I381-I409 HydrophobicContact CG1-CG2 4.16Å; M391-I409 HydrophobicContact CE-CD1 4.1Å; M391-I409 HydrophobicContact SD-CD1 3.54Å; M391-I409 VanDerWaalsContact SD-CD1 3.54Å; L400-I409 HydrophobicContact CD2-CB 3.72Å; L400-I409 HydrophobicContact CD2-CD1 3.81Å; L400-I409 HydrophobicContact CD2-CG1 3.72Å; I409-L413 HydrophobicContact CD1-CD2 3.54Å; I409-L413 HydrophobicContact CG1-CD2 3.96Å; I409-Y414 HydrophobicContact CG2-CD2 4.1Å; I409-Y414 HydrophobicContact CG2-CG 4.31Å
410	S	86.3	Confident	84.2	Confident	35 Å²	35	71.4 Å²	71.4	25%	0.245	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	139.3	174.5	66.8	0	0	0	0	110.6	N412 L413 Y414	S410-N412 PolarHBondContact O-N 3.3Å; S410-L413 PolarHBondContact O-N 3.21Å; S410-L413 VanDerWaalsContact O-N 3.14Å; S410-L413 WeakPolarHBondContact OG-CB 3.3Å; S410-Y414 PolarHBondContact O-N 2.91Å
411	A	83.7	Confident	83.7	Confident	28 Å²	28	74.3 Å²	74.3	23%	0.231	37%	0.374	C	S	.	.	H	α-helix	trans	-60	-35.2	-177.8	0	0	0	0	0	111.8	G377 Y414 N415	G377-A411 VanDerWaalsContact O-CB 3.25Å; G377-A411 WeakPolarHBondContact O-CB 3.33Å; G377-A411 PolarHBondContact O-N 2.68Å; A411-Y414 PolarHBondContact O-N 3.14Å; A411-N415 WeakPolarHBondContact O-CB 3.33Å; A411-N415 PolarHBondContact O-N 3Å; A411-N415 PolarHBondContact O-ND2 2.93Å; A411-N415 PolarHBondContact O-OD1 2.87Å
412	N	85.5	Confident	83	Confident	121 Å²	121	68.8 Å²	68.8	65%	0.647	37%	0.369	S	S	*	.	H	α-helix	trans	-63.3	-44.9	176.3	-64.9	-14.3	0	0	0	111.8	S410 N415 Q416	S410-N412 PolarHBondContact O-N 3.3Å; N412-N415 PolarHBondContact O-N 3.47Å; N412-Q416 WeakPolarHBondContact O-CG 3.42Å; N412-Q416 PolarHBondContact O-N 3.07Å
413	L	83.4	Confident	82.1	Confident	38 Å²	38	70 Å²	70	20%	0.199	36%	0.364	C	S	.	.	H	α-helix	trans	-72.3	-38.1	-179.1	-164.3	150.7	0	0	0	110.8	F399 I409 S410 N415 Q416 V417	F399-L413 HydrophobicContact CD1-CD1 3.98Å; F399-L413 HydrophobicContact CG-CD1 4.46Å; I409-L413 HydrophobicContact CD1-CD2 3.54Å; I409-L413 HydrophobicContact CG1-CD2 3.96Å; S410-L413 PolarHBondContact O-N 3.21Å; S410-L413 VanDerWaalsContact O-N 3.14Å; S410-L413 WeakPolarHBondContact OG-CB 3.3Å; L413-N415 PolarHBondContact O-N 3.35Å; L413-Q416 PolarHBondContact O-N 2.88Å; L413-V417 HydrophobicContact CD2-CG2 4.24Å; L413-V417 WeakPolarHBondContact O-CG2 3.26Å; L413-V417 PolarHBondContact O-N 2.91Å; L413-V417 VanDerWaalsContact O-N 3.07Å
414	Y	84.9	Confident	80.6	Confident	19 Å²	19	69 Å²	69	8%	0.075	37%	0.365	C	S	.	.	H	α-helix	trans	-58.1	-46.9	171.8	-176.3	-100.4	0	0	0	112.3	K379 I381 L389 I409 S410 A411 V417 Q418	K379-Y414 HydrophobicContact CD-CD1 3.51Å; K379-Y414 HydrophobicContact CD-CD2 4.24Å; K379-Y414 HydrophobicContact CD-CE1 3.43Å; K379-Y414 VanDerWaalsContact CD-CE1 3.43Å; K379-Y414 HydrophobicContact CD-CE2 4.12Å; K379-Y414 HydrophobicContact CD-CG 3.9Å; K379-Y414 PolarHBondContact NZ-OH 3.46Å; I381-Y414 HydrophobicContact CD1-CD2 3.33Å; I381-Y414 HydrophobicContact CD1-CE2 3.44Å; I381-Y414 VanDerWaalsContact CD1-CE2 3.44Å; I381-Y414 HydrophobicContact CD1-CG 4.44Å; I381-Y414 HydrophobicContact CG1-CD2 4.33Å; I381-Y414 HydrophobicContact CG1-CE2 4.14Å; L389-Y414 HydrophobicContact CD1-CD2 4.31Å; L389-Y414 HydrophobicContact CD1-CE2 3.63Å; I409-Y414 HydrophobicContact CG2-CD2 4.1Å; I409-Y414 HydrophobicContact CG2-CG 4.31Å; S410-Y414 PolarHBondContact O-N 2.91Å; A411-Y414 PolarHBondContact O-N 3.14Å; Y414-V417 PolarHBondContact O-N 2.81Å; Y414-Q418 HydrophobicContact CD1-CG 3.92Å; Y414-Q418 VanDerWaalsContact CE1-CD 3.48Å; Y414-Q418 HydrophobicContact CE1-CG 3.52Å; Y414-Q418 HydrophobicContact CE2-CG 4.3Å; Y414-Q418 HydrophobicContact CG-CG 4.44Å; Y414-Q418 WeakPolarHBondContact O-CG 3.15Å; Y414-Q418 PolarHBondContact O-N 3.04Å; Y414-Q418 PolarHBondContact OH-NE2 2.87Å
415	N	85.6	Confident	78.8	Confident	82 Å²	82	69.9 Å²	69.9	44%	0.439	37%	0.367	S	S	.	.	H	α-helix	trans	-64.4	-43.9	179.5	-67.6	-16.1	0	0	0	111.2	A411 N412 L413 V417 Q418 D419	A411-N415 WeakPolarHBondContact O-CB 3.33Å; A411-N415 PolarHBondContact O-N 3Å; A411-N415 PolarHBondContact O-ND2 2.93Å; A411-N415 PolarHBondContact O-OD1 2.87Å; N412-N415 PolarHBondContact O-N 3.47Å; L413-N415 PolarHBondContact O-N 3.35Å; N415-V417 VanDerWaalsContact C-N 3.27Å; N415-V417 PolarHBondContact O-N 3.13Å; N415-Q418 PolarHBondContact O-N 2.56Å; N415-D419 WeakPolarHBondContact O-CB 3.39Å; N415-D419 PolarHBondContact O-N 2.91Å
416	Q	84.8	Confident	76.8	Confident	132 Å²	132	73 Å²	73	62%	0.617	38%	0.379	S	S	*	.	H	α-helix	trans	-57.9	-39	176	-75.8	174.4	5.6	0	0	112.8	N412 L413 D419 H420	N412-Q416 WeakPolarHBondContact O-CG 3.42Å; N412-Q416 PolarHBondContact O-N 3.07Å; L413-Q416 PolarHBondContact O-N 2.88Å; Q416-D419 PolarHBondContact O-N 3.46Å; Q416-H420 WeakPolarHBondContact O-CB 3.47Å; Q416-H420 PolarHBondContact O-N 2.86Å
417	V	82.6	Confident	74.5	Confident	37 Å²	37	76.7 Å²	76.7	22%	0.224	40%	0.404	C	S	.	.	H	α-helix	trans	-78.6	-34.1	-179.6	178.1	0	0	0	0	111.5	M391 L413 Y414 N415 D419 H420 L421	M391-V417 HydrophobicContact CE-CB 3.27Å; M391-V417 HydrophobicContact CE-CG1 3.15Å; M391-V417 HydrophobicContact CE-CG2 3.6Å; L413-V417 HydrophobicContact CD2-CG2 4.24Å; L413-V417 WeakPolarHBondContact O-CG2 3.26Å; L413-V417 PolarHBondContact O-N 2.91Å; L413-V417 VanDerWaalsContact O-N 3.07Å; Y414-V417 PolarHBondContact O-N 2.81Å; N415-V417 VanDerWaalsContact C-N 3.27Å; N415-V417 PolarHBondContact O-N 3.13Å; V417-D419 VanDerWaalsContact C-N 3.29Å; V417-D419 PolarHBondContact O-N 2.98Å; V417-H420 PolarHBondContact O-N 2.87Å; V417-L421 HydrophobicContact CG1-CD1 3.69Å; V417-L421 HydrophobicContact CG1-CG 4.25Å; V417-L421 WeakPolarHBondContact O-CB 3.41Å; V417-L421 WeakPolarHBondContact O-CG 3.19Å; V417-L421 PolarHBondContact O-N 2.76Å
418	Q	82.3	Confident	72.2	Confident	25 Å²	25	82.3 Å²	82.3	12%	0.117	44%	0.435	C	S	.	.	H	α-helix	trans	-61.6	-39	169.7	-70.1	-117.3	-57.1	0	0	112	Y414 N415 L421 G422 I423	Y414-Q418 HydrophobicContact CD1-CG 3.92Å; Y414-Q418 VanDerWaalsContact CE1-CD 3.48Å; Y414-Q418 HydrophobicContact CE1-CG 3.52Å; Y414-Q418 HydrophobicContact CE2-CG 4.3Å; Y414-Q418 HydrophobicContact CG-CG 4.44Å; Y414-Q418 WeakPolarHBondContact O-CG 3.15Å; Y414-Q418 PolarHBondContact O-N 3.04Å; Y414-Q418 PolarHBondContact OH-NE2 2.87Å; N415-Q418 PolarHBondContact O-N 2.56Å; Q418-L421 PolarHBondContact O-N 2.63Å; Q418-G422 PolarHBondContact O-N 3.18Å; Q418-I423 PolarHBondContact O-N 3.16Å
419	D	81.7	Confident	69.8	Low	113 Å²	113	87 Å²	87	60%	0.604	47%	0.466	S	S	*	.	H	α-helix	trans	-65.7	-42.1	175.4	-66.5	-18.3	0	0	0	110.9	N415 Q416 V417 G422	N415-D419 WeakPolarHBondContact O-CB 3.39Å; N415-D419 PolarHBondContact O-N 2.91Å; Q416-D419 PolarHBondContact O-N 3.46Å; V417-D419 VanDerWaalsContact C-N 3.29Å; V417-D419 PolarHBondContact O-N 2.98Å; D419-G422 PolarHBondContact O-N 3.19Å
420	H	80.3	Confident	67.4	Low	167 Å²	167	94.3 Å²	94.3	77%	0.773	50%	0.5	S	S	*	.	H	α-helix	trans	-68	-34.3	177.6	-170.6	-80.8	0	0	0	113.3	Q416 V417 G422	Q416-H420 WeakPolarHBondContact O-CB 3.47Å; Q416-H420 PolarHBondContact O-N 2.86Å; V417-H420 PolarHBondContact O-N 2.87Å; H420-G422 VanDerWaalsContact C-N 3.29Å
421	L	74	Confident	65	Low	74 Å²	74	99.2 Å²	99.2	39%	0.387	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-5.5	178.2	-72.3	165.8	0	0	0	113.3	L389 V417 Q418 I423	L389-L421 HydrophobicContact CB-CD1 4.18Å; L389-L421 HydrophobicContact CD2-CD1 3.6Å; V417-L421 HydrophobicContact CG1-CD1 3.69Å; V417-L421 HydrophobicContact CG1-CG 4.25Å; V417-L421 WeakPolarHBondContact O-CB 3.41Å; V417-L421 WeakPolarHBondContact O-CG 3.19Å; V417-L421 PolarHBondContact O-N 2.76Å; Q418-L421 PolarHBondContact O-N 2.63Å; L421-I423 HydrophobicContact CB-CD1 3.82Å; L421-I423 HydrophobicContact CB-CG1 3.98Å; L421-I423 HydrophobicContact CD1-CD1 4.28Å; L421-I423 PolarHBondContact O-N 2.93Å
422	G	67	Low	62.6	Low	50 Å²	50	101.4 Å²	101.4	52%	0.515	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.7	16.6	177.1	0	0	0	0	0	114.8	Q418 D419 H420 N424	Q418-G422 PolarHBondContact O-N 3.18Å; D419-G422 PolarHBondContact O-N 3.19Å; H420-G422 VanDerWaalsContact C-N 3.29Å; G422-N424 VanDerWaalsContact C-N 3.25Å; G422-N424 PolarHBondContact O-N 2.97Å
423	I	64.2	Low	60.1	Low	100 Å²	100	104.4 Å²	104.4	51%	0.513	55%	0.546	S	S	.	.			trans	-77	-12.9	-173	-64.2	171.1	0	0	0	112	L389 Q418 L421 E425	L389-I423 HydrophobicContact CD2-CD1 4.25Å; Q418-I423 PolarHBondContact O-N 3.16Å; L421-I423 HydrophobicContact CB-CD1 3.82Å; L421-I423 HydrophobicContact CB-CG1 3.98Å; L421-I423 HydrophobicContact CD1-CD1 4.28Å; L421-I423 PolarHBondContact O-N 2.93Å; I423-E425 PolarHBondContact O-N 3.42Å
424	N	49.7	Very low	57.7	Low	72 Å²	72	106.9 Å²	106.9	39%	0.385	57%	0.565	S	S	.	*			trans	-91.8	61	176	-79.8	-25	0	0	0	113.3	G422 K426	G422-N424 VanDerWaalsContact C-N 3.25Å; G422-N424 PolarHBondContact O-N 2.97Å; N424-K426 VanDerWaalsContact C-N 3.25Å
425	E	44.7	Very low	55.2	Low	178 Å²	178	114.6 Å²	114.6	83%	0.832	60%	0.599	S	S	*	*			trans	-82.6	0.7	160.8	-76.7	-164.9	155.6	0	0	113.1	I423	I423-E425 PolarHBondContact O-N 3.42Å
426	K	41.7	Very low	52.7	Low	201 Å²	201	117.7 Å²	117.7	87%	0.874	61%	0.605	S	S	*	*	S	Bend	trans	-125.4	49.4	179.9	-71	-175.7	-179.9	174.4	0	114.3	N424	N424-K426 VanDerWaalsContact C-N 3.25Å
427	S	37.6	Very low	50.4	Low	80 Å²	80	115.5 Å²	115.5	56%	0.559	60%	0.603	S	S	*	*			trans	-175.9	63.6	143.8	55.8	0	0	0	0	110.5	T429	S427-T429 PolarHBondContact O-N 3.38Å
428	L	39.8	Very low	48.2	Very low	154 Å²	154	121.4 Å²	121.4	81%	0.806	63%	0.633	S	S	*	*			trans	-83.1	45.3	147.6	-82.7	156.2	0	0	0	109.4	Q430	L428-Q430 PolarHBondContact O-N 3.38Å
429	T	37.2	Very low	46	Very low	120 Å²	120	127.4 Å²	127.4	74%	0.736	67%	0.666	S	S	*	*			trans	-67.8	89.6	137.2	9.7	0	0	0	0	104.4	S427 T431	S427-T429 PolarHBondContact O-N 3.38Å; T429-T431 PolarHBondContact O-N 2.61Å
430	Q	38	Very low	44	Very low	154 Å²	154	126.5 Å²	126.5	72%	0.72	66%	0.664	S	S	*	*			trans	-22.2	89.9	145.4	-80.1	179.2	-2.1	0	0	110.4	L428 V432	L428-Q430 PolarHBondContact O-N 3.38Å; Q430-V432 HydrophobicContact CB-CB 4.2Å; Q430-V432 HydrophobicContact CB-CG2 3.57Å; Q430-V432 HydrophobicContact CG-CG2 3.73Å; Q430-V432 PolarHBondContact O-N 3.38Å
431	T	35.1	Very low	41.8	Very low	138 Å²	138	122.4 Å²	122.4	85%	0.847	65%	0.652	S	S	*	*			trans	-70.8	69.8	131	45.3	0	0	0	0	105.2	T429 K433	T429-T431 PolarHBondContact O-N 2.61Å; T431-K433 PolarHBondContact O-N 2.79Å
432	V	33.4	Very low	40	Very low	74 Å²	74	128.2 Å²	128.2	45%	0.448	67%	0.674	S	S	.	*			trans	-48.8	92.3	139.1	164.5	0	0	0	0	103.5	Q430 P434	Q430-V432 HydrophobicContact CB-CB 4.2Å; Q430-V432 HydrophobicContact CB-CG2 3.57Å; Q430-V432 HydrophobicContact CG-CG2 3.73Å; Q430-V432 PolarHBondContact O-N 3.38Å; V432-P434 VanDerWaalsContact C-N 3.27Å; V432-P434 HydrophobicContact CG1-CB 4.48Å; V432-P434 WeakPolarHBondContact O-CD 3.24Å; V432-P434 VanDerWaalsContact O-N 3.11Å
433	K	33.7	Very low	38.7	Very low	184 Å²	184	130.1 Å²	130.1	80%	0.8	69%	0.685	S	S	*	*				-42.4	115.8	126.6	-79.8	-176.3	179.6	176	0	102.3	T431 K435	T431-K433 PolarHBondContact O-N 2.79Å; K433-K435 VanDerWaalsContact C-N 3.29Å; K433-K435 PolarHBondContact O-N 3.35Å
434	P	33.1	Very low	37.9	Very low	90 Å²	90	128.3 Å²	128.3	58%	0.584	68%	0.682	S	S	*	*			trans	-43.7	106.8	178.3	16.9	-29.4	0	0	0	106.2	V432 Y436	V432-P434 VanDerWaalsContact C-N 3.27Å; V432-P434 HydrophobicContact CG1-CB 4.48Å; V432-P434 WeakPolarHBondContact O-CD 3.24Å; V432-P434 VanDerWaalsContact O-N 3.11Å; P434-Y436 WeakPolarHBondContact O-CD2 3.3Å; P434-Y436 PolarHBondContact O-N 2.99Å
435	K	32	Very low	37.9	Very low	182 Å²	182	127.4 Å²	127.4	79%	0.791	68%	0.681	S	S	*	*			trans	-63	92.7	160.6	-88.8	-176	173	-177.7	0	99.9	K433 P437	K433-K435 VanDerWaalsContact C-N 3.29Å; K433-K435 PolarHBondContact O-N 3.35Å; K435-P437 VanDerWaalsContact O-N 3.17Å
436	Y	34	Very low	38	Very low	146 Å²	146	127.2 Å²	127.2	57%	0.573	67%	0.673	S	S	*	*			trans	-44.6	124.9	156.9	-77.8	-89.6	0	0	0	104.2	P434 D438	P434-Y436 WeakPolarHBondContact O-CD2 3.3Å; P434-Y436 PolarHBondContact O-N 2.99Å; Y436-D438 PolarHBondContact O-N 3.3Å
437	P	36.3	Very low	38.5	Very low	87 Å²	87	119.4 Å²	119.4	57%	0.565	64%	0.643	S	S	*	*			trans	-55.5	121.9	-177.3	21.7	-31.1	0	0	0	107	K435 N439 V440	K435-P437 VanDerWaalsContact O-N 3.17Å; P437-N439 CarbonylContact O-C 3.48Å; P437-N439 PolarHBondContact O-N 3.05Å; P437-V440 WeakPolarHBondContact O-CG2 3.32Å; P437-V440 PolarHBondContact O-N 2.82Å
438	D	36.6	Very low	39.4	Very low	161 Å²	161	121.6 Å²	121.6	86%	0.861	64%	0.644	S	S	*	*	S	Bend	trans	-69.5	28.3	172.7	-75.7	-38	0	0	0	112.1	Y436	Y436-D438 PolarHBondContact O-N 3.3Å
439	N	36.2	Very low	40.2	Very low	151 Å²	151	119.4 Å²	119.4	81%	0.807	63%	0.633	S	S	*	*			trans	-134.8	56.9	164.6	-78.3	-30.6	0	0	0	107.6	P437	P437-N439 CarbonylContact O-C 3.48Å; P437-N439 PolarHBondContact O-N 3.05Å
440	V	38.2	Very low	41.3	Very low	93 Å²	93	117 Å²	117	56%	0.564	62%	0.615	S	S	*	*			trans	-76	123.8	156.5	-176.6	0	0	0	0	105.8	P437 K442	P437-V440 WeakPolarHBondContact O-CG2 3.32Å; P437-V440 PolarHBondContact O-N 2.82Å; V440-K442 PolarHBondContact O-N 2.81Å
441	P	35.1	Very low	42.6	Very low	82 Å²	82	114 Å²	114	53%	0.532	60%	0.603	S	S	.	*			trans	-55.7	119.8	172.4	23.2	-30.5	0	0	0	107.9	A443	P441-A443 PolarHBondContact O-N 2.81Å
442	K	35.4	Very low	44.1	Very low	195 Å²	195	110 Å²	110	85%	0.848	59%	0.585	S	S	*	*			trans	-46.2	111.6	177.3	-76.7	170.3	172.3	172.8	0	109.7	V440 S444	V440-K442 PolarHBondContact O-N 2.81Å; K442-S444 PolarHBondContact O-N 2.9Å
443	A	41	Very low	45.6	Very low	90 Å²	90	112 Å²	112	74%	0.744	59%	0.589	S	S	*	*	S	Bend	trans	53.4	-4.7	155.2	0	0	0	0	0	120.1	P441	P441-A443 PolarHBondContact O-N 2.81Å
444	S	46.1	Very low	47	Very low	63 Å²	63	106.8 Å²	106.8	44%	0.441	57%	0.567	S	S	.	*	S	Bend	trans	-88.5	-30.2	-175.3	60.4	0	0	0	0	114.2	K442 R446 S447	K442-S444 PolarHBondContact O-N 2.9Å; S444-R446 VanDerWaalsContact C-N 3.33Å; S444-R446 PolarHBondContact O-N 2.65Å; S444-S447 PolarHBondContact O-OG 2.98Å
445	S	49.6	Very low	48.7	Very low	52 Å²	52	107 Å²	107	36%	0.364	56%	0.563	S	S	.	*	H	α-helix	trans	-78.1	-16.6	179.6	60.2	0	0	0	0	113.9
446	R	48.3	Very low	50.6	Low	175 Å²	175	105.6 Å²	105.6	66%	0.66	56%	0.559	S	S	*	*	H	α-helix	trans	-76.8	-31.3	-178.7	-147.5	174.3	-171.6	165.5	1.5	111.9	S444 I450 E492	S444-R446 VanDerWaalsContact C-N 3.33Å; S444-R446 PolarHBondContact O-N 2.65Å; R446-I450 VanDerWaalsContact O-CD1 3.22Å; R446-I450 WeakPolarHBondContact O-CD1 3.23Å; R446-I450 VanDerWaalsContact O-CG1 3.29Å; R446-I450 WeakPolarHBondContact O-CG1 3.04Å; R446-E492 IonicContact NH2-OE1 3.31Å
447	S	51.8	Low	52	Low	36 Å²	36	100.8 Å²	100.8	25%	0.252	55%	0.55	S	S	.	.	H	α-helix	trans	-77.1	-36.8	175.5	40	0	0	0	0	112.9	S444 I450 I451	S444-S447 PolarHBondContact O-OG 2.98Å; S447-I450 PolarHBondContact O-N 2.78Å; S447-I451 WeakPolarHBondContact O-CD1 3.47Å; S447-I451 VanDerWaalsContact O-CG1 3.27Å; S447-I451 WeakPolarHBondContact O-CG1 3.45Å; S447-I451 PolarHBondContact O-N 2.84Å; S447-I451 VanDerWaalsContact O-N 3.13Å
448	E	55.5	Low	53.3	Low	126 Å²	126	99.1 Å²	99.1	59%	0.589	54%	0.54	S	S	*	.	H	α-helix	trans	-68.6	-39.4	-176	-70.2	173.5	178.4	0	0	112.5	I450 I451 A452	E448-I450 VanDerWaalsContact C-N 3.35Å; E448-I450 PolarHBondContact O-N 2.74Å; E448-I451 PolarHBondContact O-N 2.79Å; E448-A452 WeakPolarHBondContact O-CB 3.46Å; E448-A452 PolarHBondContact O-N 2.84Å
449	N	58.1	Low	54.8	Low	108 Å²	108	95.3 Å²	95.3	58%	0.578	53%	0.531	S	S	*	.	H	α-helix	trans	-68.1	-33.3	176.9	-70.4	-18.4	0	0	0	112.7	A452 E453	N449-A452 PolarHBondContact O-N 2.85Å; N449-E453 WeakPolarHBondContact O-CG 3.37Å; N449-E453 PolarHBondContact O-N 2.68Å
450	I	60.2	Low	56.6	Low	69 Å²	69	92 Å²	92	35%	0.354	51%	0.513	S	S	.	.	H	α-helix	trans	-72.2	-37.5	178.3	-64.7	170.4	0	0	0	110.6	R446 S447 E448 F454 Y474	R446-I450 VanDerWaalsContact O-CD1 3.22Å; R446-I450 WeakPolarHBondContact O-CD1 3.23Å; R446-I450 VanDerWaalsContact O-CG1 3.29Å; R446-I450 WeakPolarHBondContact O-CG1 3.04Å; S447-I450 PolarHBondContact O-N 2.78Å; E448-I450 VanDerWaalsContact C-N 3.35Å; E448-I450 PolarHBondContact O-N 2.74Å; I450-F454 WeakPolarHBondContact O-CB 3.5Å; I450-F454 PolarHBondContact O-N 3.05Å; I450-Y474 HydrophobicContact CD1-CE1 4.48Å; I450-Y474 HydrophobicContact CG2-CD1 3.99Å; I450-Y474 HydrophobicContact CG2-CE1 4.19Å
451	I	63.9	Low	58.3	Low	91 Å²	91	96.1 Å²	96.1	47%	0.467	53%	0.526	S	S	.	.	H	α-helix	trans	-69.5	-38.1	175.4	-63.9	162.3	0	0	0	110.5	S447 E448 F454 N455	S447-I451 WeakPolarHBondContact O-CD1 3.47Å; S447-I451 VanDerWaalsContact O-CG1 3.27Å; S447-I451 WeakPolarHBondContact O-CG1 3.45Å; S447-I451 PolarHBondContact O-N 2.84Å; S447-I451 VanDerWaalsContact O-N 3.13Å; E448-I451 PolarHBondContact O-N 2.79Å; I451-F454 PolarHBondContact O-N 2.98Å; I451-N455 WeakPolarHBondContact O-CB 3.33Å; I451-N455 PolarHBondContact O-N 2.82Å; I451-N455 PolarHBondContact O-ND2 3.28Å
452	A	67.2	Low	59.8	Low	56 Å²	56	102.4 Å²	102.4	46%	0.463	54%	0.54	S	S	.	.	H	α-helix	trans	-65.3	-45.2	175.2	0	0	0	0	0	112.5	E448 N449 F454 N455 E456	E448-A452 WeakPolarHBondContact O-CB 3.46Å; E448-A452 PolarHBondContact O-N 2.84Å; N449-A452 PolarHBondContact O-N 2.85Å; A452-F454 PolarHBondContact O-N 3.48Å; A452-N455 PolarHBondContact O-N 2.88Å; A452-E456 WeakPolarHBondContact O-CB 3.24Å; A452-E456 PolarHBondContact O-N 2.76Å
453	E	64.5	Low	61.1	Low	115 Å²	115	97.6 Å²	97.6	54%	0.537	52%	0.519	S	S	.	.	H	α-helix	trans	-66.1	-35.7	176.2	-75	-176	178.7	0	0	112.3	N449 E456 A457	N449-E453 WeakPolarHBondContact O-CG 3.37Å; N449-E453 PolarHBondContact O-N 2.68Å; E453-E456 PolarHBondContact O-N 3.24Å; E453-A457 WeakPolarHBondContact O-CB 3.06Å; E453-A457 PolarHBondContact O-N 3.36Å
454	F	65	Low	62.3	Low	74 Å²	74	96 Å²	96	33%	0.325	50%	0.502	S	S	.	.	H	α-helix	trans	-67.6	-37.1	174.4	-171.8	-98	0	0	0	111.9	I450 I451 A452 S458 T473	I450-F454 WeakPolarHBondContact O-CB 3.5Å; I450-F454 PolarHBondContact O-N 3.05Å; I451-F454 PolarHBondContact O-N 2.98Å; A452-F454 PolarHBondContact O-N 3.48Å; F454-S458 WeakPolarHBondContact O-CB 3.46Å; F454-S458 PolarHBondContact O-N 3.21Å; F454-S458 PolarHBondContact O-OG 3.32Å; F454-T473 HydrophobicContact CZ-CG2 4.37Å
455	N	67.6	Low	63.3	Low	96 Å²	96	100.8 Å²	100.8	51%	0.513	52%	0.515	S	S	.	.	H	α-helix	trans	-73.5	-29	175.8	-72.4	-18.9	0	0	0	113.2	I451 A452 S458	I451-N455 WeakPolarHBondContact O-CB 3.33Å; I451-N455 PolarHBondContact O-N 2.82Å; I451-N455 PolarHBondContact O-ND2 3.28Å; A452-N455 PolarHBondContact O-N 2.88Å; N455-S458 WeakPolarHBondContact CA-OG 3.15Å; N455-S458 PolarHBondContact O-OG 3.33Å
456	E	71.5	Confident	63.7	Low	151 Å²	151	101.6 Å²	101.6	71%	0.706	52%	0.515	S	S	*	.	H	α-helix	trans	-75.3	-37.6	173.5	-165.5	175.2	-172.1	0	0	111.2	A452 E453 A459	A452-E456 WeakPolarHBondContact O-CB 3.24Å; A452-E456 PolarHBondContact O-N 2.76Å; E453-E456 PolarHBondContact O-N 3.24Å; E456-A459 WeakPolarHBondContact O-CB 3.48Å; E456-A459 PolarHBondContact O-N 3.3Å
457	A	63.8	Low	64.1	Low	46 Å²	46	95.7 Å²	95.7	38%	0.38	50%	0.501	S	S	.	.	H	α-helix	trans	-71.9	-30	174.6	0	0	0	0	0	113.3	E453 A459 D460	E453-A457 WeakPolarHBondContact O-CB 3.06Å; E453-A457 PolarHBondContact O-N 3.36Å; A457-A459 PolarHBondContact O-N 2.82Å; A457-D460 PolarHBondContact O-N 2.86Å
458	S	64.2	Low	64.8	Low	51 Å²	51	99.9 Å²	99.9	36%	0.357	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-15.7	176.4	67.9	0	0	0	0	113.4	F454 N455 D460	F454-S458 WeakPolarHBondContact O-CB 3.46Å; F454-S458 PolarHBondContact O-N 3.21Å; F454-S458 PolarHBondContact O-OG 3.32Å; N455-S458 WeakPolarHBondContact CA-OG 3.15Å; N455-S458 PolarHBondContact O-OG 3.33Å; S458-D460 VanDerWaalsContact C-N 3.3Å
459	A	68.3	Low	65	Low	82 Å²	82	97.8 Å²	97.8	68%	0.678	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-19.1	173	0	0	0	0	0	113.2	E456 A457	E456-A459 WeakPolarHBondContact O-CB 3.48Å; E456-A459 PolarHBondContact O-N 3.3Å; A457-A459 PolarHBondContact O-N 2.82Å
460	D	72.4	Confident	65.2	Low	81 Å²	81	97.8 Å²	97.8	43%	0.433	52%	0.519	S	S	.	.	S	Bend	trans	-88	123.6	180	-163.1	-3.3	0	0	0	110.4	A457 S458 R462 F463	A457-D460 PolarHBondContact O-N 2.86Å; S458-D460 VanDerWaalsContact C-N 3.3Å; D460-R462 PolarHBondContact O-N 2.95Å; D460-F463 HydrophobicContact CB-CD2 4.18Å; D460-F463 PolarHBondContact O-N 2.99Å
461	Q	74.7	Confident	65	Low	179 Å²	179	104.1 Å²	104.1	84%	0.836	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-57.6	-22.2	-168.6	-69	-172.2	-4.3	0	0	113.8	F463 S464	Q461-F463 VanDerWaalsContact C-N 3.3Å; Q461-F463 PolarHBondContact O-N 2.88Å; Q461-S464 PolarHBondContact O-OG 2.89Å; Q461-S464 VanDerWaalsContact O-OG 3.05Å
462	R	67.6	Low	64.4	Low	214 Å²	214	104.6 Å²	104.6	81%	0.808	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-68.6	-23.5	177	-66.5	-177.8	-161.8	170.3	7.9	114	D460	D460-R462 PolarHBondContact O-N 2.95Å
463	F	62.6	Low	63.8	Low	95 Å²	95	104.9 Å²	104.9	42%	0.417	54%	0.543	S	S	.	.	G	3₁₀ helix	trans	-110.3	8.4	-173.4	-59.6	-70.4	0	0	0	114.2	D460 Q461 K465 L466	D460-F463 HydrophobicContact CB-CD2 4.18Å; D460-F463 PolarHBondContact O-N 2.99Å; Q461-F463 VanDerWaalsContact C-N 3.3Å; Q461-F463 PolarHBondContact O-N 2.88Å; F463-K465 PolarHBondContact O-N 2.82Å; F463-K465 VanDerWaalsContact O-N 3.15Å; F463-L466 HydrophobicContact CD1-CD1 3.94Å; F463-L466 VanDerWaalsContact O-CB 3.23Å; F463-L466 WeakPolarHBondContact O-CB 3.39Å; F463-L466 PolarHBondContact O-N 2.92Å
464	S	65.9	Low	62.9	Low	56 Å²	56	106.4 Å²	106.4	39%	0.392	55%	0.545	S	S	.	.	H	α-helix	trans	-51.8	-35.2	173.6	50.9	0	0	0	0	113.7	Q461 L466 S467	Q461-S464 PolarHBondContact O-OG 2.89Å; Q461-S464 VanDerWaalsContact O-OG 3.05Å; S464-L466 PolarHBondContact O-N 3.05Å; S464-S467 PolarHBondContact O-N 3.47Å; S464-S467 PolarHBondContact O-OG 3.41Å
465	K	65.8	Low	62.2	Low	164 Å²	164	105.3 Å²	105.3	71%	0.713	55%	0.546	S	S	*	.	H	α-helix	trans	-72.2	-11.9	177.9	-64.8	-173.4	178.5	-177.6	0	114.8	F463 N469	F463-K465 PolarHBondContact O-N 2.82Å; F463-K465 VanDerWaalsContact O-N 3.15Å; K465-N469 PolarHBondContact O-ND2 2.87Å; K465-N469 VanDerWaalsContact O-ND2 3.1Å
466	L	58.3	Low	61.5	Low	69 Å²	69	105.5 Å²	105.5	36%	0.361	55%	0.551	S	S	.	*	H	α-helix	trans	-87.3	-29.5	-178.7	-124.6	142.3	0	0	0	111.2	F463 S464 L472	F463-L466 HydrophobicContact CD1-CD1 3.94Å; F463-L466 VanDerWaalsContact O-CB 3.23Å; F463-L466 WeakPolarHBondContact O-CB 3.39Å; F463-L466 PolarHBondContact O-N 2.92Å; S464-L466 PolarHBondContact O-N 3.05Å; L466-L472 HydrophobicContact CD2-CB 4.21Å; L466-L472 HydrophobicContact CD2-CD2 3.96Å; L466-L472 HydrophobicContact CG-CD2 4.34Å
467	S	58.3	Low	60.7	Low	51 Å²	51	104 Å²	104	36%	0.357	55%	0.552	S	S	.	*	H	α-helix	trans	-74.3	-29.6	172.1	51.9	0	0	0	0	113.1	S464 N469	S464-S467 PolarHBondContact O-N 3.47Å; S464-S467 PolarHBondContact O-OG 3.41Å; S467-N469 VanDerWaalsContact C-N 3.31Å; S467-N469 PolarHBondContact O-N 3.24Å
468	D	64.4	Low	59.7	Low	124 Å²	124	108 Å²	108	66%	0.663	57%	0.567	S	S	*	*	S	Bend	trans	-80.7	-10.9	-173.9	-63.3	-12.4	0	0	0	113.6	P470	D468-P470 WeakPolarHBondContact O-CD 3.12Å
469	N	61.4	Low	58.7	Low	81 Å²	81	108 Å²	108	43%	0.433	58%	0.575	S	S	.	*			trans	-102.7	107.6	-178	-84.1	-56.1	0	0	0	111.7	K465 S467 K471 L472	K465-N469 PolarHBondContact O-ND2 2.87Å; K465-N469 VanDerWaalsContact O-ND2 3.1Å; S467-N469 VanDerWaalsContact C-N 3.31Å; S467-N469 PolarHBondContact O-N 3.24Å; N469-K471 PolarHBondContact O-N 3.22Å; N469-L472 HydrophobicContact CB-CB 4.2Å; N469-L472 HydrophobicContact CB-CD1 3.67Å; N469-L472 PolarHBondContact O-N 2.8Å
470	P	60.7	Low	57.5	Low	108 Å²	108	111.9 Å²	111.9	70%	0.701	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-8.6	-178.8	25.5	-33.7	0	0	0	114.2	D468 T473	D468-P470 WeakPolarHBondContact O-CD 3.12Å; P470-T473 PolarHBondContact O-OG1 2.62Å; P470-T473 VanDerWaalsContact O-OG1 3.12Å
471	K	57.1	Low	56.6	Low	203 Å²	203	110.2 Å²	110.2	88%	0.883	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-13.7	172.3	-66.1	-175.5	179.6	-179.9	0	113.7	N469	N469-K471 PolarHBondContact O-N 3.22Å
472	L	51.1	Low	55.7	Low	101 Å²	101	107.3 Å²	107.3	53%	0.529	57%	0.569	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.1	-5.3	-178.4	-85.4	126.6	0	0	0	112.8	L466 N469	L466-L472 HydrophobicContact CD2-CB 4.21Å; L466-L472 HydrophobicContact CD2-CD2 3.96Å; L466-L472 HydrophobicContact CG-CD2 4.34Å; N469-L472 HydrophobicContact CB-CB 4.2Å; N469-L472 HydrophobicContact CB-CD1 3.67Å; N469-L472 PolarHBondContact O-N 2.8Å
473	T	54.1	Low	55.1	Low	61 Å²	61	103.7 Å²	103.7	37%	0.374	57%	0.565	S	S	.	*	S	Bend	trans	-79.7	131.4	173.5	50.8	0	0	0	0	110.6	F454 P470 S475	F454-T473 HydrophobicContact CZ-CG2 4.37Å; P470-T473 PolarHBondContact O-OG1 2.62Å; P470-T473 VanDerWaalsContact O-OG1 3.12Å; T473-S475 PolarHBondContact O-N 3.4Å
474	Y	46.4	Very low	55.2	Low	148 Å²	148	103.8 Å²	103.8	58%	0.58	57%	0.569	S	S	*	*			trans	-68.3	112.8	177.1	177.1	-108.9	0	0	0	110.6	I450 T476	I450-Y474 HydrophobicContact CD1-CE1 4.48Å; I450-Y474 HydrophobicContact CG2-CD1 3.99Å; I450-Y474 HydrophobicContact CG2-CE1 4.19Å; Y474-T476 HydrophobicContact CD1-CG2 4.45Å; Y474-T476 HydrophobicContact CE1-CG2 3.84Å
475	S	50.3	Low	55	Low	50 Å²	50	106.6 Å²	106.6	35%	0.35	58%	0.576	S	S	.	*			trans	-87.9	134.7	165	75.2	0	0	0	0	108.2	T473 V477 D478	T473-S475 PolarHBondContact O-N 3.4Å; S475-V477 PolarHBondContact O-N 2.83Å; S475-V477 VanDerWaalsContact O-N 3.16Å; S475-D478 PolarHBondContact OG-OD2 2.82Å
476	T	52.4	Low	55.2	Low	101 Å²	101	103.7 Å²	103.7	62%	0.62	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	1.3	175.6	41.5	0	0	0	0	113.3	Y474	Y474-T476 HydrophobicContact CD1-CG2 4.45Å; Y474-T476 HydrophobicContact CE1-CG2 3.84Å
477	V	54.9	Low	55.6	Low	119 Å²	119	105.9 Å²	105.9	72%	0.721	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	-19.1	-168.8	-172	0	0	0	0	112.4	S475 G479	S475-V477 PolarHBondContact O-N 2.83Å; S475-V477 VanDerWaalsContact O-N 3.16Å; V477-G479 PolarHBondContact O-N 3.33Å
478	D	42.5	Very low	56.2	Low	130 Å²	130	108.1 Å²	108.1	70%	0.695	58%	0.58	S	S	*	*			trans	-98	82.4	-174.1	-62.7	-36.7	0	0	0	111.9	S475 D480	S475-D478 PolarHBondContact OG-OD2 2.82Å; D478-D480 VanDerWaalsContact C-N 3.27Å; D478-D480 PolarHBondContact O-N 3.29Å
479	G	42.8	Very low	56.6	Low	51 Å²	51	104.8 Å²	104.8	53%	0.526	57%	0.57	S	S	.	*			trans	-76.6	6.3	178.8	0	0	0	0	0	116.3	V477 S481	V477-G479 PolarHBondContact O-N 3.33Å; G479-S481 PolarHBondContact O-N 3.49Å
480	D	44.1	Very low	57.3	Low	163 Å²	163	110.1 Å²	110.1	87%	0.872	58%	0.584	S	S	*	*			trans	-102.9	28	-155.9	-72.9	-7.4	0	0	0	116.4	D478	D478-D480 VanDerWaalsContact C-N 3.27Å; D478-D480 PolarHBondContact O-N 3.29Å
481	S	54.1	Low	58	Low	46 Å²	46	108.8 Å²	108.8	32%	0.322	57%	0.571	S	S	.	*			trans	-128.5	93.8	170.5	-159.2	0	0	0	0	113	G479 L483 I484 Q485	G479-S481 PolarHBondContact O-N 3.49Å; S481-L483 PolarHBondContact O-N 3.29Å; S481-I484 WeakPolarHBondContact O-CB 3.47Å; S481-I484 PolarHBondContact O-N 3.04Å; S481-Q485 PolarHBondContact O-N 3.22Å
482	D	54.9	Low	59	Low	118 Å²	118	103.4 Å²	103.4	63%	0.631	55%	0.549	S	S	*	.	H	α-helix	trans	-47.8	-31.7	169.6	-75.2	-19.6	0	0	0	112.6	I484 Q485 I486	D482-I484 PolarHBondContact O-N 3.29Å; D482-Q485 PolarHBondContact O-N 3.41Å; D482-I486 WeakPolarHBondContact O-CD1 3.44Å; D482-I486 WeakPolarHBondContact O-CG1 3.49Å; D482-I486 PolarHBondContact O-N 2.85Å
483	L	55.6	Low	60.5	Low	138 Å²	138	105.1 Å²	105.1	72%	0.723	55%	0.552	S	S	*	*	H	α-helix	trans	-66	-36.7	178	-69	169.9	0	0	0	112.5	S481 H487	S481-L483 PolarHBondContact O-N 3.29Å; L483-H487 WeakPolarHBondContact O-CB 3.39Å; L483-H487 PolarHBondContact O-N 2.89Å
484	I	63	Low	61.9	Low	97 Å²	97	108.8 Å²	108.8	50%	0.497	56%	0.562	S	S	.	*	H	α-helix	trans	-70.8	-42	177.4	-63.9	177.1	0	0	0	109.7	S481 D482 I486 H487 Q488	S481-I484 WeakPolarHBondContact O-CB 3.47Å; S481-I484 PolarHBondContact O-N 3.04Å; D482-I484 PolarHBondContact O-N 3.29Å; I484-I486 PolarHBondContact O-N 2.78Å; I484-H487 PolarHBondContact O-N 2.79Å; I484-Q488 HydrophobicContact CG2-CG 4.25Å; I484-Q488 WeakPolarHBondContact O-CB 3.32Å; I484-Q488 WeakPolarHBondContact O-CG 3.25Å; I484-Q488 PolarHBondContact O-N 3.35Å
485	Q	63.8	Low	63.5	Low	115 Å²	115	109.5 Å²	109.5	54%	0.537	56%	0.564	S	S	.	*	H	α-helix	trans	-61.8	-43.4	175.7	-67.1	-171.7	14.2	0	0	112.1	S481 D482 H487 Q488 A489	S481-Q485 PolarHBondContact O-N 3.22Å; D482-Q485 PolarHBondContact O-N 3.41Å; Q485-H487 PolarHBondContact O-N 2.87Å; Q485-Q488 PolarHBondContact O-N 3.2Å; Q485-A489 WeakPolarHBondContact O-CB 3.32Å; Q485-A489 PolarHBondContact O-N 3.07Å
486	I	68.4	Low	65	Low	103 Å²	103	114 Å²	114	53%	0.528	57%	0.573	S	S	.	*	H	α-helix	trans	-65	-40.2	178	-67.6	164	0	0	0	111.1	D482 I484 R490	D482-I486 WeakPolarHBondContact O-CD1 3.44Å; D482-I486 WeakPolarHBondContact O-CG1 3.49Å; D482-I486 PolarHBondContact O-N 2.85Å; I484-I486 PolarHBondContact O-N 2.78Å; I486-R490 PolarHBondContact O-N 3.49Å; I486-R490 VanDerWaalsContact O-N 3.13Å
487	H	67.8	Low	66.4	Low	116 Å²	116	117.7 Å²	117.7	54%	0.537	58%	0.576	S	S	.	*	H	α-helix	trans	-67	-43.1	177.3	-171.9	76.5	0	0	0	111.9	L483 I484 Q485 R490 L491	L483-H487 WeakPolarHBondContact O-CB 3.39Å; L483-H487 PolarHBondContact O-N 2.89Å; I484-H487 PolarHBondContact O-N 2.79Å; Q485-H487 PolarHBondContact O-N 2.87Å; H487-R490 WeakPolarHBondContact O-CB 3.35Å; H487-R490 PolarHBondContact O-N 2.98Å; H487-L491 PolarHBondContact O-N 3.23Å
488	Q	70.4	Confident	67.9	Low	97 Å²	97	118.8 Å²	118.8	45%	0.453	57%	0.571	S	S	.	*	H	α-helix	trans	-62.7	-44.8	176.2	-74.1	173.6	-7.5	0	0	111.7	I484 Q485 R490 L491 E492	I484-Q488 HydrophobicContact CG2-CG 4.25Å; I484-Q488 WeakPolarHBondContact O-CB 3.32Å; I484-Q488 WeakPolarHBondContact O-CG 3.25Å; I484-Q488 PolarHBondContact O-N 3.35Å; Q485-Q488 PolarHBondContact O-N 3.2Å; Q488-R490 VanDerWaalsContact C-N 3.28Å; Q488-R490 PolarHBondContact O-N 3.22Å; Q488-L491 PolarHBondContact O-N 3.39Å; Q488-L491 VanDerWaalsContact O-N 3.12Å; Q488-E492 PolarHBondContact O-N 2.94Å
489	A	73.6	Confident	69.9	Low	55 Å²	55	118.4 Å²	118.4	46%	0.455	57%	0.565	S	S	.	*	H	α-helix	trans	-60.7	-36	175.7	0	0	0	0	0	112.5	Q485 K493	Q485-A489 WeakPolarHBondContact O-CB 3.32Å; Q485-A489 PolarHBondContact O-N 3.07Å; A489-K493 WeakPolarHBondContact O-CB 3.26Å; A489-K493 PolarHBondContact O-N 3.15Å
490	R	74.6	Confident	71.9	Confident	192 Å²	192	120.1 Å²	120.1	73%	0.725	56%	0.562	S	S	*	*	H	α-helix	trans	-66.5	-42.6	173.6	-88.4	-176.2	174	-178.1	-0.1	112.5	I486 H487 Q488 K493 K494	I486-R490 PolarHBondContact O-N 3.49Å; I486-R490 VanDerWaalsContact O-N 3.13Å; H487-R490 WeakPolarHBondContact O-CB 3.35Å; H487-R490 PolarHBondContact O-N 2.98Å; Q488-R490 VanDerWaalsContact C-N 3.28Å; Q488-R490 PolarHBondContact O-N 3.22Å; R490-K493 PolarHBondContact O-N 3.46Å; R490-K494 PolarHBondContact O-N 2.81Å
491	L	75.5	Confident	73.7	Confident	81 Å²	81	119 Å²	119	42%	0.424	55%	0.551	S	S	.	*	H	α-helix	trans	-65.8	-43.5	177.7	-77.6	170.2	0	0	0	111.6	H487 Q488 K493 K494 R495	H487-L491 PolarHBondContact O-N 3.23Å; Q488-L491 PolarHBondContact O-N 3.39Å; Q488-L491 VanDerWaalsContact O-N 3.12Å; L491-K493 VanDerWaalsContact C-N 3.35Å; L491-K493 PolarHBondContact O-N 2.83Å; L491-K494 WeakPolarHBondContact O-CB 3.5Å; L491-K494 PolarHBondContact O-N 3.49Å; L491-K494 VanDerWaalsContact O-N 3.13Å; L491-R495 PolarHBondContact O-N 3.17Å
492	E	79	Confident	75.3	Confident	90 Å²	90	124.7 Å²	124.7	42%	0.421	57%	0.57	S	S	.	*	H	α-helix	trans	-59.1	-44.5	174.3	-77.2	-175.3	172.8	0	0	111.6	R446 Q488 K494 R495 R496	R446-E492 IonicContact NH2-OE1 3.31Å; Q488-E492 PolarHBondContact O-N 2.94Å; E492-K494 VanDerWaalsContact C-N 3.27Å; E492-K494 PolarHBondContact O-N 3.06Å; E492-R495 PolarHBondContact O-N 3.5Å; E492-R496 PolarHBondContact O-N 3.46Å
493	K	81.6	Confident	76.8	Confident	137 Å²	137	125.6 Å²	125.6	60%	0.596	57%	0.57	S	S	*	*	H	α-helix	trans	-61.9	-35.5	176.4	-165.6	173.8	-173.5	172.9	0	112.1	A489 R490 L491 R497	A489-K493 WeakPolarHBondContact O-CB 3.26Å; A489-K493 PolarHBondContact O-N 3.15Å; R490-K493 PolarHBondContact O-N 3.46Å; L491-K493 VanDerWaalsContact C-N 3.35Å; L491-K493 PolarHBondContact O-N 2.83Å; K493-R497 WeakPolarHBondContact O-CG 3.13Å; K493-R497 PolarHBondContact O-N 3.29Å
494	K	83.4	Confident	78.1	Confident	137 Å²	137	127.7 Å²	127.7	60%	0.596	57%	0.569	S	S	*	*	H	α-helix	trans	-71	-39.3	175.7	-165.8	177.4	-178.3	179.9	0	111.7	R490 L491 E492 R497 K498	R490-K494 PolarHBondContact O-N 2.81Å; L491-K494 WeakPolarHBondContact O-CB 3.5Å; L491-K494 PolarHBondContact O-N 3.49Å; L491-K494 VanDerWaalsContact O-N 3.13Å; E492-K494 VanDerWaalsContact C-N 3.27Å; E492-K494 PolarHBondContact O-N 3.06Å; K494-R497 PolarHBondContact O-N 3.46Å; K494-K498 PolarHBondContact O-N 2.91Å; K494-K498 VanDerWaalsContact O-N 3.16Å
495	R	80.5	Confident	79.2	Confident	163 Å²	163	125.6 Å²	125.6	62%	0.615	57%	0.566	S	S	*	*	H	α-helix	trans	-63.9	-50.6	174.7	-73.8	-177.8	179	-174	-0.5	111.4	L491 E492 R497 K498 E499	L491-R495 PolarHBondContact O-N 3.17Å; E492-R495 PolarHBondContact O-N 3.5Å; R495-R497 VanDerWaalsContact C-N 3.27Å; R495-R497 PolarHBondContact O-N 3.05Å; R495-K498 WeakPolarHBondContact O-CA 3.42Å; R495-K498 WeakPolarHBondContact O-CB 3.13Å; R495-K498 PolarHBondContact O-N 2.77Å; R495-E499 PolarHBondContact O-N 3.01Å
496	R	82.5	Confident	80.2	Confident	146 Å²	146	122.8 Å²	122.8	55%	0.551	56%	0.562	S	S	*	*	H	α-helix	trans	-55.9	-40.1	175.8	-75.2	-174.1	179.9	-174.9	0.3	112.6	E492 E499 L500	E492-R496 PolarHBondContact O-N 3.46Å; R496-E499 PolarHBondContact O-N 3.43Å; R496-L500 WeakPolarHBondContact O-CB 3.24Å; R496-L500 PolarHBondContact O-N 2.57Å
497	R	80.9	Confident	80.8	Confident	177 Å²	177	127.2 Å²	127.2	67%	0.668	57%	0.572	S	S	*	*	H	α-helix	trans	-62.8	-41.5	174.9	-81.7	-179.5	173.6	-174.4	-3.1	112.6	K493 K494 R495 Q501	K493-R497 WeakPolarHBondContact O-CG 3.13Å; K493-R497 PolarHBondContact O-N 3.29Å; K494-R497 PolarHBondContact O-N 3.46Å; R495-R497 VanDerWaalsContact C-N 3.27Å; R495-R497 PolarHBondContact O-N 3.05Å; R497-Q501 WeakPolarHBondContact O-CB 3.47Å; R497-Q501 PolarHBondContact O-N 3.05Å; R497-Q501 VanDerWaalsContact O-N 3.09Å
498	K	86.4	Confident	81.4	Confident	142 Å²	142	124.3 Å²	124.3	62%	0.617	57%	0.568	S	S	*	*	H	α-helix	trans	-66.2	-41.8	177	-80.3	-172.1	171.7	-170	0	112.1	K494 R495 Q501 K502	K494-K498 PolarHBondContact O-N 2.91Å; K494-K498 VanDerWaalsContact O-N 3.16Å; R495-K498 WeakPolarHBondContact O-CA 3.42Å; R495-K498 WeakPolarHBondContact O-CB 3.13Å; R495-K498 PolarHBondContact O-N 2.77Å; K498-Q501 WeakPolarHBondContact O-CB 3.44Å; K498-Q501 PolarHBondContact O-N 3.06Å; K498-K502 PolarHBondContact O-N 3.08Å
499	E	86.1	Confident	82	Confident	123 Å²	123	126 Å²	126	58%	0.575	58%	0.576	S	S	*	*	H	α-helix	trans	-62.1	-47.5	176.5	-74.8	171	171.2	0	0	111.6	R495 R496 Q501 K502 E503	R495-E499 PolarHBondContact O-N 3.01Å; R496-E499 PolarHBondContact O-N 3.43Å; E499-Q501 PolarHBondContact O-N 2.75Å; E499-K502 WeakPolarHBondContact O-CB 3.43Å; E499-K502 PolarHBondContact O-N 3.3Å; E499-E503 PolarHBondContact O-N 2.83Å
500	L	84.3	Confident	82.4	Confident	87 Å²	87	126 Å²	126	46%	0.455	58%	0.576	S	S	.	*	H	α-helix	trans	-58.8	-35	175.2	-121.5	160	0	0	0	112.2	R496 R504	R496-L500 WeakPolarHBondContact O-CB 3.24Å; R496-L500 PolarHBondContact O-N 2.57Å; L500-R504 WeakPolarHBondContact O-CB 3.13Å; L500-R504 VanDerWaalsContact O-CG 3.27Å; L500-R504 WeakPolarHBondContact O-CG 3.39Å; L500-R504 PolarHBondContact O-N 2.77Å
501	Q	81.2	Confident	82.6	Confident	139 Å²	139	122.3 Å²	122.3	65%	0.65	57%	0.57	S	S	*	*	H	α-helix	trans	-69.6	-40.3	175.7	-137.3	173.1	9.4	0	0	111.7	R497 K498 E499 R504 A505	R497-Q501 WeakPolarHBondContact O-CB 3.47Å; R497-Q501 PolarHBondContact O-N 3.05Å; R497-Q501 VanDerWaalsContact O-N 3.09Å; K498-Q501 WeakPolarHBondContact O-CB 3.44Å; K498-Q501 PolarHBondContact O-N 3.06Å; E499-Q501 PolarHBondContact O-N 2.75Å; Q501-R504 PolarHBondContact O-N 2.87Å; Q501-A505 WeakPolarHBondContact O-CB 3.23Å; Q501-A505 PolarHBondContact O-N 2.87Å
502	K	88.3	Confident	82.7	Confident	165 Å²	165	123 Å²	123	72%	0.717	58%	0.578	S	S	*	*	H	α-helix	trans	-66.2	-42.6	176.4	-167.9	178.7	179.4	-175.7	0	111.6	K498 E499 A505 A506	K498-K502 PolarHBondContact O-N 3.08Å; E499-K502 WeakPolarHBondContact O-CB 3.43Å; E499-K502 PolarHBondContact O-N 3.3Å; K502-A505 PolarHBondContact O-N 3.29Å; K502-A506 WeakPolarHBondContact O-CB 3.31Å; K502-A506 PolarHBondContact O-N 2.87Å
503	E	86.3	Confident	82.7	Confident	137 Å²	137	123.5 Å²	123.5	64%	0.64	58%	0.583	S	S	*	*	H	α-helix	trans	-61.9	-44	174.2	-75.2	-175.2	158.9	0	0	112	E499 A505 A506 R507	E499-E503 PolarHBondContact O-N 2.83Å; E503-A505 VanDerWaalsContact C-N 3.34Å; E503-A505 PolarHBondContact O-N 3.14Å; E503-A506 PolarHBondContact O-N 3.47Å; E503-R507 WeakPolarHBondContact O-CB 3.19Å; E503-R507 PolarHBondContact O-N 3.49Å
504	R	82.7	Confident	82.4	Confident	183 Å²	183	124.4 Å²	124.4	69%	0.691	59%	0.587	S	S	*	*	H	α-helix	trans	-61.7	-42.1	175.6	-77.1	177.6	-178.7	-165.2	-0.6	111.9	L500 Q501 R507 A508	L500-R504 WeakPolarHBondContact O-CB 3.13Å; L500-R504 VanDerWaalsContact O-CG 3.27Å; L500-R504 WeakPolarHBondContact O-CG 3.39Å; L500-R504 PolarHBondContact O-N 2.77Å; Q501-R504 PolarHBondContact O-N 2.87Å; R504-R507 PolarHBondContact O-N 2.92Å; R504-A508 WeakPolarHBondContact O-CB 3.45Å; R504-A508 PolarHBondContact O-N 3.48Å
505	A	85.6	Confident	81.7	Confident	53 Å²	53	120.7 Å²	120.7	44%	0.438	58%	0.582	S	S	.	*	H	α-helix	trans	-64.3	-44	177	0	0	0	0	0	112	Q501 K502 E503 R507 A508 Q509	Q501-A505 WeakPolarHBondContact O-CB 3.23Å; Q501-A505 PolarHBondContact O-N 2.87Å; K502-A505 PolarHBondContact O-N 3.29Å; E503-A505 VanDerWaalsContact C-N 3.34Å; E503-A505 PolarHBondContact O-N 3.14Å; A505-R507 PolarHBondContact O-N 3.2Å; A505-A508 PolarHBondContact O-N 3.43Å; A505-Q509 PolarHBondContact O-N 3.43Å
506	A	85.9	Confident	81.1	Confident	55 Å²	55	115.7 Å²	115.7	46%	0.455	57%	0.572	S	S	.	*	H	α-helix	trans	-63.1	-41.2	176.4	0	0	0	0	0	111.9	K502 E503 A508 Q509 A510	K502-A506 WeakPolarHBondContact O-CB 3.31Å; K502-A506 PolarHBondContact O-N 2.87Å; E503-A506 PolarHBondContact O-N 3.47Å; A506-A508 VanDerWaalsContact C-N 3.35Å; A506-A508 PolarHBondContact O-N 3.06Å; A506-Q509 PolarHBondContact O-N 3.37Å; A506-A510 WeakPolarHBondContact O-CB 3.37Å; A506-A510 PolarHBondContact O-N 3.48Å
507	R	81.1	Confident	80.2	Confident	197 Å²	197	114.3 Å²	114.3	74%	0.743	58%	0.575	S	S	*	*	H	α-helix	trans	-66.3	-37.1	177.1	-158.7	175.1	-174.1	173.3	1	111.9	E503 R504 A505 L511	E503-R507 WeakPolarHBondContact O-CB 3.19Å; E503-R507 PolarHBondContact O-N 3.49Å; R504-R507 PolarHBondContact O-N 2.92Å; A505-R507 PolarHBondContact O-N 3.2Å; R507-L511 WeakPolarHBondContact O-CG 3.45Å; R507-L511 PolarHBondContact O-N 2.68Å; R507-L511 VanDerWaalsContact O-N 3.16Å
508	A	80.2	Confident	79.2	Confident	54 Å²	54	111.3 Å²	111.3	45%	0.446	58%	0.577	S	S	.	*	H	α-helix	trans	-65.5	-45.2	173.9	0	0	0	0	0	111.9	R504 A505 A506 A510 L511 V512	R504-A508 WeakPolarHBondContact O-CB 3.45Å; R504-A508 PolarHBondContact O-N 3.48Å; A505-A508 PolarHBondContact O-N 3.43Å; A506-A508 VanDerWaalsContact C-N 3.35Å; A506-A508 PolarHBondContact O-N 3.06Å; A508-A510 VanDerWaalsContact C-N 3.34Å; A508-A510 PolarHBondContact O-N 3.4Å; A508-L511 PolarHBondContact O-N 3.38Å; A508-V512 WeakPolarHBondContact O-CG2 3.27Å; A508-V512 PolarHBondContact O-N 3.22Å
509	Q	82.7	Confident	77.6	Confident	134 Å²	134	113 Å²	113	63%	0.626	59%	0.586	S	S	*	*	H	α-helix	trans	-61.3	-40.6	175.6	-75.5	179.2	-17.2	0	0	112.3	A505 A506 L511 V512 N513	A505-Q509 PolarHBondContact O-N 3.43Å; A506-Q509 PolarHBondContact O-N 3.37Å; Q509-L511 VanDerWaalsContact C-N 3.3Å; Q509-L511 PolarHBondContact O-N 3.32Å; Q509-V512 PolarHBondContact O-N 3.41Å; Q509-N513 VanDerWaalsContact O-CG 3.31Å; Q509-N513 PolarHBondContact O-N 3.09Å
510	A	81.4	Confident	75.5	Confident	54 Å²	54	116.6 Å²	116.6	45%	0.446	61%	0.607	S	S	.	*	H	α-helix	trans	-63.8	-34	176.2	0	0	0	0	0	113	A506 A508 K514	A506-A510 WeakPolarHBondContact O-CB 3.37Å; A506-A510 PolarHBondContact O-N 3.48Å; A508-A510 VanDerWaalsContact C-N 3.34Å; A508-A510 PolarHBondContact O-N 3.4Å; A510-K514 PolarHBondContact O-N 3.01Å; A510-K514 VanDerWaalsContact O-N 3.09Å
511	L	79.5	Confident	75	Confident	114 Å²	114	118.1 Å²	118.1	60%	0.597	62%	0.615	S	S	*	*	H	α-helix	trans	-71.5	-39.7	174.8	-73.5	171.9	0	0	0	112	R507 A508 Q509 K514 A515	R507-L511 WeakPolarHBondContact O-CG 3.45Å; R507-L511 PolarHBondContact O-N 2.68Å; R507-L511 VanDerWaalsContact O-N 3.16Å; A508-L511 PolarHBondContact O-N 3.38Å; Q509-L511 VanDerWaalsContact C-N 3.3Å; Q509-L511 PolarHBondContact O-N 3.32Å; L511-K514 PolarHBondContact O-N 2.95Å; L511-A515 PolarHBondContact O-N 3.11Å
512	V	78.4	Confident	74.7	Confident	97 Å²	97	117 Å²	117	59%	0.588	61%	0.613	S	S	*	*	H	α-helix	trans	-62.2	-44.7	174.9	173.9	0	0	0	0	110.8	A508 Q509 K514 A515 S516	A508-V512 WeakPolarHBondContact O-CG2 3.27Å; A508-V512 PolarHBondContact O-N 3.22Å; Q509-V512 PolarHBondContact O-N 3.41Å; V512-K514 VanDerWaalsContact C-N 3.3Å; V512-K514 PolarHBondContact O-N 3.32Å; V512-A515 PolarHBondContact O-N 2.94Å; V512-A515 VanDerWaalsContact O-N 3.15Å; V512-S516 PolarHBondContact O-N 2.84Å; V512-S516 PolarHBondContact O-OG 2.98Å
513	N	77.4	Confident	74	Confident	100 Å²	100	114.3 Å²	114.3	54%	0.535	61%	0.607	S	S	.	*	H	α-helix	trans	-66.6	-30.6	177.4	-67.6	-6.6	0	0	0	112.8	Q509 S516 N517	Q509-N513 VanDerWaalsContact O-CG 3.31Å; Q509-N513 PolarHBondContact O-N 3.09Å; N513-S516 WeakPolarHBondContact CA-OG 3.4Å; N513-S516 PolarHBondContact O-OG 3.36Å; N513-N517 PolarHBondContact O-N 3.1Å
514	K	75.2	Confident	73.2	Confident	155 Å²	155	113 Å²	113	67%	0.674	61%	0.606	S	S	*	*	H	α-helix	trans	-70.7	-37.9	171.5	-87.9	-174.8	173.5	-175	0	112.1	A510 L511 V512 V518	A510-K514 PolarHBondContact O-N 3.01Å; A510-K514 VanDerWaalsContact O-N 3.09Å; L511-K514 PolarHBondContact O-N 2.95Å; V512-K514 VanDerWaalsContact C-N 3.3Å; V512-K514 PolarHBondContact O-N 3.32Å; K514-V518 WeakPolarHBondContact O-CG2 3.34Å
515	A	69.9	Low	72.7	Confident	59 Å²	59	108.6 Å²	108.6	49%	0.488	60%	0.6	S	S	.	*	H	α-helix	trans	-70.1	-35.6	177.6	0	0	0	0	0	112.4	L511 V512 N517 V518	L511-A515 PolarHBondContact O-N 3.11Å; V512-A515 PolarHBondContact O-N 2.94Å; V512-A515 VanDerWaalsContact O-N 3.15Å; A515-N517 VanDerWaalsContact C-N 3.33Å; A515-N517 PolarHBondContact O-N 3.26Å; A515-V518 PolarHBondContact O-N 3.42Å
516	S	67.5	Low	71.8	Confident	58 Å²	58	112.3 Å²	112.3	41%	0.406	61%	0.611	S	S	.	*	H	α-helix	trans	-68.1	-31.1	176.6	59.3	0	0	0	0	113.3	V512 N513 V518	V512-S516 PolarHBondContact O-N 2.84Å; V512-S516 PolarHBondContact O-OG 2.98Å; N513-S516 WeakPolarHBondContact CA-OG 3.4Å; N513-S516 PolarHBondContact O-OG 3.36Å; S516-V518 VanDerWaalsContact C-N 3.27Å; S516-V518 PolarHBondContact O-N 3.29Å
517	N	63.2	Low	70.8	Confident	117 Å²	117	116.4 Å²	116.4	63%	0.626	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-4.2	179.2	-73.2	-4.4	0	0	0	114.1	N513 A515	N513-N517 PolarHBondContact O-N 3.1Å; A515-N517 VanDerWaalsContact C-N 3.33Å; A515-N517 PolarHBondContact O-N 3.26Å
518	V	60.5	Low	70	Confident	115 Å²	115	110.2 Å²	110.2	70%	0.697	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	-6.4	176.6	177.2	0	0	0	0	111.5	K514 A515 S516	K514-V518 WeakPolarHBondContact O-CG2 3.34Å; A515-V518 PolarHBondContact O-N 3.42Å; S516-V518 VanDerWaalsContact C-N 3.27Å; S516-V518 PolarHBondContact O-N 3.29Å
519	H	52.4	Low	69.1	Low	177 Å²	177	114.9 Å²	114.9	82%	0.819	63%	0.627	S	S	*	*			trans	-112.2	14.3	177.4	-74.8	-46.3	0	0	0	114.3
520	I	41.7	Very low	67.9	Low	199 Å²	199	113.2 Å²	113.2	100%	1.021	63%	0.627	S	S	*	*			trans	-115.4	0	164.2	-54.3	172	0	0	0	106.2

Retrieved 520 of 520 residues in 107.4 ms (Link to these results)

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