A0A061IHH9_CRIGR Loading...

Zinc finger and BTB domain-containing protein 49

Transcription factor. Inhibits cell proliferation by activating either CDKN1A/p21 transcription or RB1 transcription.

AlphaFold DB , UniProt , Accession A0A061IHH9, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Zbtb49, Length 759 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	41.8	Very low	37.8	Very low	169 Å²	169	93.2 Å²	93.2	83%	0.833	52%	0.523	S	S	*	.				0	150.1	0	-71.5	-59.6	-141.6	0	0	108.7	I6	M1-I6 HydrophobicContact CB-CD1 3.9Å
2	D	33.4	Very low	38.2	Very low	97 Å²	97	94 Å²	94	52%	0.519	52%	0.524	S	S	.	.			trans	-75.2	122.4	173.9	-170.8	-31	0	0	0	109.4	V4 A5 I6	D2-V4 PolarHBondContact O-N 3.26Å; D2-V4 VanDerWaalsContact OD1-CB 3.29Å; D2-V4 WeakPolarHBondContact OD1-CB 3.36Å; D2-V4 WeakPolarHBondContact OD1-CG2 3.38Å; D2-V4 PolarHBondContact OD1-N 2.95Å; D2-A5 HydrophobicContact CB-CB 4.33Å; D2-A5 WeakPolarHBondContact O-CB 2.97Å; D2-A5 PolarHBondContact O-N 3.2Å; D2-A5 VanDerWaalsContact O-N 3.09Å; D2-I6 PolarHBondContact O-N 3.07Å
3	P	36.2	Very low	38.9	Very low	96 Å²	96	96 Å²	96	62%	0.623	53%	0.527	S	S	*	.	H	α-helix	trans	-60.5	-26	178.9	24.9	-33.9	0	0	0	112.7	A5 I6 H7	P3-A5 VanDerWaalsContact C-N 3.33Å; P3-A5 PolarHBondContact O-N 3.07Å; P3-I6 PolarHBondContact O-N 3.22Å; P3-H7 VanDerWaalsContact O-CB 3.27Å; P3-H7 WeakPolarHBondContact O-CB 3.43Å; P3-H7 PolarHBondContact O-N 2.73Å
4	V	34.5	Very low	39.4	Very low	101 Å²	101	95.1 Å²	95.1	61%	0.612	52%	0.517	S	S	*	.	H	α-helix	trans	-65.6	-36.6	176.2	-177.5	0	0	0	0	111.2	D2 S8	D2-V4 PolarHBondContact O-N 3.26Å; D2-V4 VanDerWaalsContact OD1-CB 3.29Å; D2-V4 WeakPolarHBondContact OD1-CB 3.36Å; D2-V4 WeakPolarHBondContact OD1-CG2 3.38Å; D2-V4 PolarHBondContact OD1-N 2.95Å; V4-S8 WeakPolarHBondContact O-CB 3.29Å; V4-S8 PolarHBondContact O-N 3.31Å; V4-S8 PolarHBondContact O-OG 3.01Å
5	A	34.7	Very low	39.7	Very low	51 Å²	51	90.4 Å²	90.4	42%	0.421	49%	0.491	S	S	.	.	H	α-helix	trans	-70.4	-37.8	178.3	0	0	0	0	0	112.2	D2 P3 S8 C9	D2-A5 HydrophobicContact CB-CB 4.33Å; D2-A5 WeakPolarHBondContact O-CB 2.97Å; D2-A5 PolarHBondContact O-N 3.2Å; D2-A5 VanDerWaalsContact O-N 3.09Å; P3-A5 VanDerWaalsContact C-N 3.33Å; P3-A5 PolarHBondContact O-N 3.07Å; A5-S8 WeakPolarHBondContact CA-OG 3.17Å; A5-S8 PolarHBondContact O-OG 3.34Å; A5-C9 PolarHBondContact O-N 3.01Å; A5-C9 PolarHBondContact O-SG 2.74Å
6	I	40.7	Very low	40.1	Very low	106 Å²	106	96.1 Å²	96.1	54%	0.544	50%	0.503	S	S	.	.	H	α-helix	trans	-71.3	-46.6	176.2	-61.4	175.6	0	0	0	110.1	M1 D2 P3 S8 C9 H10	M1-I6 HydrophobicContact CB-CD1 3.9Å; D2-I6 PolarHBondContact O-N 3.07Å; P3-I6 PolarHBondContact O-N 3.22Å; I6-S8 PolarHBondContact O-N 2.85Å; I6-C9 PolarHBondContact O-N 3.22Å; I6-H10 PolarHBondContact O-N 2.74Å
7	H	36.3	Very low	40.6	Very low	110 Å²	110	95.9 Å²	95.9	51%	0.509	50%	0.499	S	S	.	.	H	α-helix	trans	-60.9	-42.6	178.9	-175	64.5	0	0	0	111.9	P3 H10 L11	P3-H7 VanDerWaalsContact O-CB 3.27Å; P3-H7 WeakPolarHBondContact O-CB 3.43Å; P3-H7 PolarHBondContact O-N 2.73Å; H7-H10 PolarHBondContact O-N 3.3Å; H7-L11 WeakPolarHBondContact O-CB 3.25Å; H7-L11 PolarHBondContact O-N 3.38Å
8	S	36.7	Very low	41	Very low	49 Å²	49	93.1 Å²	93.1	34%	0.343	48%	0.483	S	S	.	.	H	α-helix	trans	-67.3	-36.8	177.5	50.5	0	0	0	0	113.3	V4 A5 I6 L12	V4-S8 WeakPolarHBondContact O-CB 3.29Å; V4-S8 PolarHBondContact O-N 3.31Å; V4-S8 PolarHBondContact O-OG 3.01Å; A5-S8 WeakPolarHBondContact CA-OG 3.17Å; A5-S8 PolarHBondContact O-OG 3.34Å; I6-S8 PolarHBondContact O-N 2.85Å; S8-L12 WeakPolarHBondContact O-CB 3.39Å; S8-L12 VanDerWaalsContact O-CG 3.29Å; S8-L12 WeakPolarHBondContact O-CG 3.46Å; S8-L12 PolarHBondContact O-N 2.86Å
9	C	38.8	Very low	41.3	Very low	87 Å²	87	94.7 Å²	94.7	59%	0.588	48%	0.483	S	S	*	.	H	α-helix	trans	-65.9	-43.4	173.1	-68.1	0	0	0	0	112.4	A5 I6 L12 Q13	A5-C9 PolarHBondContact O-N 3.01Å; A5-C9 PolarHBondContact O-SG 2.74Å; I6-C9 PolarHBondContact O-N 3.22Å; C9-L12 PolarHBondContact O-N 2.99Å; C9-Q13 PolarHBondContact O-N 2.79Å; C9-Q13 VanDerWaalsContact O-N 3.16Å
10	H	40.1	Very low	41.7	Very low	122 Å²	122	96.6 Å²	96.6	57%	0.565	49%	0.492	S	S	*	.	H	α-helix	trans	-61	-48.5	176.2	-161.5	-81.3	0	0	0	111.2	I6 H7 L12 Q13 E14	I6-H10 PolarHBondContact O-N 2.74Å; H7-H10 PolarHBondContact O-N 3.3Å; H10-L12 VanDerWaalsContact C-N 3.29Å; H10-L12 PolarHBondContact O-N 3.1Å; H10-Q13 PolarHBondContact O-N 2.89Å; H10-E14 IonicContact CE1-OE2 2.69Å; H10-E14 IonicContact ND1-OE2 3.13Å; H10-E14 PolarHBondContact ND1-OE2 3.2Å; H10-E14 VanDerWaalsContact ND1-OE2 3.08Å; H10-E14 VanDerWaalsContact O-CB 3.29Å; H10-E14 WeakPolarHBondContact O-CB 3.42Å; H10-E14 PolarHBondContact O-N 3.28Å
11	L	42	Very low	41.9	Very low	37 Å²	37	97.9 Å²	97.9	19%	0.194	50%	0.496	C	S	.	.	H	α-helix	trans	-58.6	-37.3	178.7	-171.4	64.4	0	0	0	112.5	H7 L15 A45	H7-L11 WeakPolarHBondContact O-CB 3.25Å; H7-L11 PolarHBondContact O-N 3.38Å; L11-L15 VanDerWaalsContact O-CB 3.3Å; L11-L15 WeakPolarHBondContact O-CB 3.12Å; L11-L15 WeakPolarHBondContact O-CG 3.44Å; L11-L15 PolarHBondContact O-N 3.02Å; L11-A45 HydrophobicContact CD1-CB 3.92Å; L11-A45 HydrophobicContact CD2-CB 3.63Å; L11-A45 HydrophobicContact CG-CB 3.76Å
12	L	42.9	Very low	42	Very low	103 Å²	103	92.9 Å²	92.9	54%	0.539	49%	0.488	S	S	.	.	H	α-helix	trans	-70.5	-33.7	174.8	-75.7	168.3	0	0	0	113.3	S8 C9 H10 R16	S8-L12 WeakPolarHBondContact O-CB 3.39Å; S8-L12 VanDerWaalsContact O-CG 3.29Å; S8-L12 WeakPolarHBondContact O-CG 3.46Å; S8-L12 PolarHBondContact O-N 2.86Å; C9-L12 PolarHBondContact O-N 2.99Å; H10-L12 VanDerWaalsContact C-N 3.29Å; H10-L12 PolarHBondContact O-N 3.1Å; L12-R16 WeakPolarHBondContact O-CB 3.39Å; L12-R16 PolarHBondContact O-N 3.19Å
13	Q	46.9	Very low	42.7	Very low	120 Å²	120	93.6 Å²	93.6	56%	0.561	49%	0.491	S	S	*	.	H	α-helix	trans	-73.3	-45.1	174.8	-177.8	169.2	-21.8	0	0	111.3	C9 H10 R16 E17	C9-Q13 PolarHBondContact O-N 2.79Å; C9-Q13 VanDerWaalsContact O-N 3.16Å; H10-Q13 PolarHBondContact O-N 2.89Å; Q13-R16 WeakPolarHBondContact O-CA 3.35Å; Q13-R16 WeakPolarHBondContact O-CB 3.43Å; Q13-R16 PolarHBondContact O-N 3.41Å; Q13-E17 PolarHBondContact NE2-OE1 2.96Å; Q13-E17 PolarHBondContact O-N 2.91Å
14	E	46.5	Very low	43.5	Very low	83 Å²	83	90.1 Å²	90.1	39%	0.388	47%	0.468	S	S	.	.	H	α-helix	trans	-64	-42.5	-179.8	-167.5	176.1	163.9	0	0	112	H10 R16 E17 Q18	H10-E14 IonicContact CE1-OE2 2.69Å; H10-E14 IonicContact ND1-OE2 3.13Å; H10-E14 PolarHBondContact ND1-OE2 3.2Å; H10-E14 VanDerWaalsContact ND1-OE2 3.08Å; H10-E14 VanDerWaalsContact O-CB 3.29Å; H10-E14 WeakPolarHBondContact O-CB 3.42Å; H10-E14 PolarHBondContact O-N 3.28Å; E14-R16 VanDerWaalsContact C-N 3.27Å; E14-R16 PolarHBondContact O-N 3.07Å; E14-E17 PolarHBondContact O-N 2.81Å; E14-Q18 WeakPolarHBondContact O-CB 3.48Å; E14-Q18 VanDerWaalsContact O-CG 3.32Å; E14-Q18 WeakPolarHBondContact O-CG 3.44Å; E14-Q18 PolarHBondContact O-N 2.94Å
15	L	44.1	Very low	44.5	Very low	25 Å²	25	86.8 Å²	86.8	13%	0.131	45%	0.448	C	S	.	.	H	α-helix	trans	-62.5	-32.1	171.1	-75.6	173.4	0	0	0	113.1	L11 R19 N41 V42 A45	L11-L15 VanDerWaalsContact O-CB 3.3Å; L11-L15 WeakPolarHBondContact O-CB 3.12Å; L11-L15 WeakPolarHBondContact O-CG 3.44Å; L11-L15 PolarHBondContact O-N 3.02Å; L15-R19 WeakPolarHBondContact O-CB 3.5Å; L15-R19 PolarHBondContact O-N 2.81Å; L15-N41 HydrophobicContact CD2-CB 3.8Å; L15-V42 HydrophobicContact CD1-CG2 4.41Å; L15-V42 HydrophobicContact CD2-CG2 4.02Å; L15-A45 HydrophobicContact CD1-CB 3.71Å
16	R	45.1	Very low	45.7	Very low	181 Å²	181	86.1 Å²	86.1	68%	0.683	44%	0.437	S	S	*	.	H	α-helix	trans	-72.3	-41.2	178	-174.8	-178.2	-179.6	-166.7	-1	111	L12 Q13 E14 R19 I20	L12-R16 WeakPolarHBondContact O-CB 3.39Å; L12-R16 PolarHBondContact O-N 3.19Å; Q13-R16 WeakPolarHBondContact O-CA 3.35Å; Q13-R16 WeakPolarHBondContact O-CB 3.43Å; Q13-R16 PolarHBondContact O-N 3.41Å; E14-R16 VanDerWaalsContact C-N 3.27Å; E14-R16 PolarHBondContact O-N 3.07Å; R16-R19 PolarHBondContact O-N 3.42Å; R16-I20 HydrophobicContact CG-CD1 4.26Å; R16-I20 WeakPolarHBondContact O-CD1 3.4Å; R16-I20 VanDerWaalsContact O-CG1 3.29Å; R16-I20 WeakPolarHBondContact O-CG1 3.15Å; R16-I20 PolarHBondContact O-N 3.27Å; R16-I20 VanDerWaalsContact O-N 3.1Å
17	E	49.5	Very low	46.7	Very low	93 Å²	93	81.1 Å²	81.1	44%	0.435	41%	0.412	S	S	.	.	H	α-helix	trans	-67.7	-44	175.5	-72.1	169.2	-171.2	0	0	111.2	Q13 E14 R19 I20 Q21	Q13-E17 PolarHBondContact NE2-OE1 2.96Å; Q13-E17 PolarHBondContact O-N 2.91Å; E14-E17 PolarHBondContact O-N 2.81Å; E17-R19 VanDerWaalsContact C-N 3.31Å; E17-R19 PolarHBondContact O-N 3.31Å; E17-I20 PolarHBondContact O-N 3.26Å; E17-I20 VanDerWaalsContact O-N 3.1Å; E17-Q21 WeakPolarHBondContact O-CG 3.49Å; E17-Q21 PolarHBondContact O-N 3.31Å
18	Q	47.4	Very low	47.8	Very low	46 Å²	46	78.4 Å²	78.4	22%	0.215	40%	0.4	C	S	.	.	H	α-helix	trans	-62.9	-33.1	174.4	-70.4	175.6	13.6	0	0	113.2	E14 G22 L23 L24 N41	E14-Q18 WeakPolarHBondContact O-CB 3.48Å; E14-Q18 VanDerWaalsContact O-CG 3.32Å; E14-Q18 WeakPolarHBondContact O-CG 3.44Å; E14-Q18 PolarHBondContact O-N 2.94Å; Q18-G22 PolarHBondContact O-N 2.88Å; Q18-L23 PolarHBondContact O-N 3.41Å; Q18-L24 HydrophobicContact CB-CD2 4.08Å; Q18-N41 PolarHBondContact OE1-ND2 2.82Å
19	R	46.5	Very low	48.9	Very low	124 Å²	124	76.7 Å²	76.7	47%	0.468	39%	0.387	S	S	.	.	H	α-helix	trans	-63.9	-45.7	170.2	178	178.4	-96	-172.2	-6.5	111.6	L15 R16 E17 Q21 G22 L24	L15-R19 WeakPolarHBondContact O-CB 3.5Å; L15-R19 PolarHBondContact O-N 2.81Å; R16-R19 PolarHBondContact O-N 3.42Å; E17-R19 VanDerWaalsContact C-N 3.31Å; E17-R19 PolarHBondContact O-N 3.31Å; R19-Q21 VanDerWaalsContact C-N 3.29Å; R19-Q21 PolarHBondContact O-N 2.87Å; R19-G22 PolarHBondContact O-N 2.86Å; R19-L24 HydrophobicContact CB-CD1 3.78Å; R19-L24 HydrophobicContact CG-CD1 4.29Å
20	I	49.5	Very low	49.7	Very low	132 Å²	132	72.9 Å²	72.9	68%	0.677	36%	0.361	S	S	*	.	H	α-helix	trans	-65.3	-34.5	179.8	-69	162.6	0	0	0	111.2	R16 E17 G22	R16-I20 HydrophobicContact CG-CD1 4.26Å; R16-I20 WeakPolarHBondContact O-CD1 3.4Å; R16-I20 VanDerWaalsContact O-CG1 3.29Å; R16-I20 WeakPolarHBondContact O-CG1 3.15Å; R16-I20 PolarHBondContact O-N 3.27Å; R16-I20 VanDerWaalsContact O-N 3.1Å; E17-I20 PolarHBondContact O-N 3.26Å; E17-I20 VanDerWaalsContact O-N 3.1Å; I20-G22 VanDerWaalsContact C-N 3.29Å; I20-G22 PolarHBondContact O-N 3.23Å
21	Q	45.5	Very low	50.3	Low	123 Å²	123	67.8 Å²	67.8	58%	0.575	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-3.4	177.7	-66.7	168.7	6.3	0	0	114.1	E17 R19 L23	E17-Q21 WeakPolarHBondContact O-CG 3.49Å; E17-Q21 PolarHBondContact O-N 3.31Å; R19-Q21 VanDerWaalsContact C-N 3.29Å; R19-Q21 PolarHBondContact O-N 2.87Å; Q21-L23 HydrophobicContact CB-CD1 4.05Å; Q21-L23 HydrophobicContact CB-CG 4.03Å; Q21-L23 PolarHBondContact O-N 2.79Å
22	G	45.1	Very low	50.7	Low	64 Å²	64	74.2 Å²	74.2	66%	0.66	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.9	13.7	179	0	0	0	0	0	115.3	Q18 R19 I20 L24	Q18-G22 PolarHBondContact O-N 2.88Å; R19-G22 PolarHBondContact O-N 2.86Å; I20-G22 VanDerWaalsContact C-N 3.29Å; I20-G22 PolarHBondContact O-N 3.23Å; G22-L24 VanDerWaalsContact C-N 3.29Å; G22-L24 PolarHBondContact O-N 3.12Å
23	L	47.4	Very low	50.9	Low	112 Å²	112	72.2 Å²	72.2	59%	0.586	36%	0.364	S	S	*	.			trans	-83.9	1.4	-174.1	-65.3	175.9	0	0	0	114.1	Q18 Q21 C25	Q18-L23 PolarHBondContact O-N 3.41Å; Q21-L23 HydrophobicContact CB-CD1 4.05Å; Q21-L23 HydrophobicContact CB-CG 4.03Å; Q21-L23 PolarHBondContact O-N 2.79Å; L23-C25 PolarHBondContact O-N 2.93Å
24	L	53.3	Low	50.8	Low	24 Å²	24	68.1 Å²	68.1	13%	0.126	35%	0.347	C	S	.	.			trans	-76.2	105.9	179.5	-63.4	-178.6	0	0	0	110.9	Q18 R19 G22 H39 N41	Q18-L24 HydrophobicContact CB-CD2 4.08Å; R19-L24 HydrophobicContact CB-CD1 3.78Å; R19-L24 HydrophobicContact CG-CD1 4.29Å; G22-L24 VanDerWaalsContact C-N 3.29Å; G22-L24 PolarHBondContact O-N 3.12Å; L24-H39 HydrophobicContact CB-CB 4.24Å; L24-H39 HydrophobicContact CD1-CB 4.2Å; L24-N41 HydrophobicContact CD2-CB 3.96Å
25	C	55.5	Low	50.9	Low	30 Å²	30	67.8 Å²	67.8	20%	0.203	35%	0.353	C	S	.	.			trans	-69.3	130.9	163.9	-71.3	0	0	0	0	110.2	L23 K40	L23-C25 PolarHBondContact O-N 2.93Å; C25-K40 WeakPolarHBondContact O-CB 3.2Å; C25-K40 PolarHBondContact O-N 2.74Å
26	D	59	Low	51.4	Low	37 Å²	37	68.7 Å²	68.7	20%	0.198	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	149.4	168.4	-63.3	-32	0	0	0	110.4	K37 H39 K61	D26-K37 HydrophobicContact CB-CD 4.19Å; D26-K37 HydrophobicContact CB-CG 3.87Å; D26-K37 WeakPolarHBondContact OD2-CE 3.49Å; D26-K37 IonicContact OD2-NZ 3.15Å; D26-K37 PolarHBondContact OD2-NZ 3.33Å; D26-H39 IonicContact OD1-CE1 2.68Å; D26-H39 PolarHBondContact OD1-CE1 2.84Å; D26-H39 IonicContact OD1-CG 2.74Å; D26-H39 IonicContact OD1-ND1 2.69Å; D26-H39 PolarHBondContact OD1-ND1 3.42Å; D26-K61 CarbonylContact O-C 3.44Å
27	C	62.5	Low	51.7	Low	1 Å²	1	66.1 Å²	66.1	1%	0.007	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	159	163	59.7	0	0	0	0	109.9	A38 D63 F65	C27-A38 PolarHBondContact N-O 3.5Å; C27-A38 PolarHBondContact O-N 3.3Å; C27-A38 PolarHBondContact SG-O 3.03Å; C27-D63 HydrophobicContact CB-CB 4.4Å; C27-F65 HydrophobicContact CB-CD2 4.26Å; C27-F65 HydrophobicContact CB-CE2 4.07Å
28	M	59.2	Low	52.1	Low	53 Å²	53	62.2 Å²	62.2	26%	0.261	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	110.7	179.7	-66.3	-59.4	-57.9	0	0	109.4	C35 F36 K37 D63 V64 F65	M28-C35 HydrophobicContact CE-CB 3.74Å; M28-F36 CarbonylContact C-O 3.59Å; M28-F36 WeakPolarHBondContact CA-O 3.43Å; M28-K37 HydrophobicContact CE-CB 4.34Å; M28-K37 HydrophobicContact SD-CB 3.62Å; M28-K37 HydrophobicContact SD-CD 4.35Å; M28-K37 HydrophobicContact SD-CG 3.65Å; M28-D63 PolarHBondContact N-O 2.88Å; M28-V64 HydrophobicContact CB-CG1 4.41Å; M28-V64 HydrophobicContact CB-CG2 4.24Å; M28-V64 CarbonylContact O-C 3.07Å; M28-V64 WeakPolarHBondContact O-CA 3.45Å; M28-F65 PolarHBondContact O-N 3.26Å
29	L	60.6	Low	53	Low	14 Å²	14	62.6 Å²	62.6	7%	0.073	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	121.8	173.6	-61.7	-168.8	0	0	0	110	C35 F36 L43 F65 L67	L29-C35 CarbonylContact O-C 3.54Å; L29-C35 WeakPolarHBondContact O-CA 3.39Å; L29-F36 PolarHBondContact N-O 2.97Å; L29-F36 PolarHBondContact O-N 2.92Å; L29-L43 HydrophobicContact CD1-CD1 3.59Å; L29-L43 HydrophobicContact CD1-CD2 3.83Å; L29-L43 HydrophobicContact CD1-CG 4.37Å; L29-L43 HydrophobicContact CD2-CD1 4.12Å; L29-L43 HydrophobicContact CG-CD1 3.93Å; L29-F65 HydrophobicContact CD2-CB 3.92Å; L29-F65 HydrophobicContact CD2-CD2 4.27Å; L29-F65 HydrophobicContact CD2-CG 4.47Å; L29-L67 HydrophobicContact CB-CD1 4.12Å; L29-L67 HydrophobicContact CD1-CD1 3.83Å; L29-L67 HydrophobicContact CD2-CD1 3.97Å; L29-L67 HydrophobicContact CG-CD1 4.2Å
30	V	54.4	Low	53.8	Low	7 Å²	7	57.5 Å²	57.5	4%	0.042	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	100.9	176.4	-169.8	0	0	0	0	109.3	V34 C35 V64 F65 H66 L67	V30-V34 CarbonylContact C-O 3.55Å; V30-V34 WeakPolarHBondContact CA-O 3.35Å; V30-C35 HydrophobicContact CG2-CB 4.48Å; V30-V64 HydrophobicContact CG2-CG1 3.44Å; V30-V64 VanDerWaalsContact CG2-CG1 3.44Å; V30-F65 PolarHBondContact N-O 3.17Å; V30-H66 WeakPolarHBondContact O-CA 3.34Å; V30-L67 PolarHBondContact O-N 2.98Å
31	V	53.4	Low	54.2	Low	14 Å²	14	53.9 Å²	53.9	9%	0.085	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	110.7	-179.6	-173.1	0	0	0	0	108.3	G33 V34 F36 L67 V69	V31-G33 PolarHBondContact O-N 3.28Å; V31-G33 VanDerWaalsContact O-N 3.12Å; V31-V34 PolarHBondContact N-O 2.8Å; V31-V34 PolarHBondContact O-N 2.9Å; V31-F36 HydrophobicContact CB-CE2 4.16Å; V31-F36 HydrophobicContact CG2-CD2 4.24Å; V31-F36 HydrophobicContact CG2-CE2 4.33Å; V31-L67 HydrophobicContact CG2-CB 4.24Å; V31-L67 HydrophobicContact CG2-CD1 4.19Å; V31-V69 HydrophobicContact CG1-CG2 3.94Å
32	R	51.1	Low	54.9	Low	173 Å²	173	49.4 Å²	49.4	65%	0.653	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	34.6	-178.2	-47.2	-173.9	91.4	177.7	7.2	114.2	V69 C103	R32-V69 HydrophobicContact CG-CG2 3.79Å; R32-C103 PolarHBondContact NH1-O 2.6Å
33	G	46	Very low	55.7	Low	60 Å²	60	46.7 Å²	46.7	62%	0.619	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	96.7	-11	-180	0	0	0	0	0	115.6	V31	V31-G33 PolarHBondContact O-N 3.28Å; V31-G33 VanDerWaalsContact O-N 3.12Å
34	V	44.5	Very low	56.4	Low	34 Å²	34	42.3 Å²	42.3	21%	0.206	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	128	177.2	-173.8	0	0	0	0	110.9	V30 V31 F36 V96	V30-V34 CarbonylContact C-O 3.55Å; V30-V34 WeakPolarHBondContact CA-O 3.35Å; V31-V34 PolarHBondContact N-O 2.8Å; V31-V34 PolarHBondContact O-N 2.9Å; V34-F36 HydrophobicContact CB-CE2 3.76Å; V34-F36 HydrophobicContact CB-CZ 3.92Å; V34-F36 HydrophobicContact CG1-CD2 4.46Å; V34-F36 HydrophobicContact CG1-CE1 4.08Å; V34-F36 HydrophobicContact CG1-CE2 3.62Å; V34-F36 HydrophobicContact CG1-CZ 3.38Å; V34-F36 WeakPolarHBondContact O-CD2 3.36Å; V34-F36 WeakPolarHBondContact O-CE2 3.49Å; V34-V96 HydrophobicContact CG1-CG1 3.4Å
35	C	48.6	Very low	56.5	Low	77 Å²	77	41.9 Å²	41.9	52%	0.52	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	117.9	-173.6	-55.8	0	0	0	0	112.1	M28 L29 V30	M28-C35 HydrophobicContact CE-CB 3.74Å; L29-C35 CarbonylContact O-C 3.54Å; L29-C35 WeakPolarHBondContact O-CA 3.39Å; V30-C35 HydrophobicContact CG2-CB 4.48Å
36	F	54.8	Low	56.3	Low	44 Å²	44	45.4 Å²	45.4	19%	0.193	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	127.2	178.9	-58.4	-85	0	0	0	111.1	M28 L29 V31 V34 T100	M28-F36 CarbonylContact C-O 3.59Å; M28-F36 WeakPolarHBondContact CA-O 3.43Å; L29-F36 PolarHBondContact N-O 2.97Å; L29-F36 PolarHBondContact O-N 2.92Å; V31-F36 HydrophobicContact CB-CE2 4.16Å; V31-F36 HydrophobicContact CG2-CD2 4.24Å; V31-F36 HydrophobicContact CG2-CE2 4.33Å; V34-F36 HydrophobicContact CB-CE2 3.76Å; V34-F36 HydrophobicContact CB-CZ 3.92Å; V34-F36 HydrophobicContact CG1-CD2 4.46Å; V34-F36 HydrophobicContact CG1-CE1 4.08Å; V34-F36 HydrophobicContact CG1-CE2 3.62Å; V34-F36 HydrophobicContact CG1-CZ 3.38Å; V34-F36 WeakPolarHBondContact O-CD2 3.36Å; V34-F36 WeakPolarHBondContact O-CE2 3.49Å; F36-T100 HydrophobicContact CZ-CG2 3.77Å
37	K	51.1	Low	56	Low	126 Å²	126	45.3 Å²	45.3	55%	0.548	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	121.4	171.4	-158.8	178.9	-153.1	-141.4	0	109.9	D26 M28	D26-K37 HydrophobicContact CB-CD 4.19Å; D26-K37 HydrophobicContact CB-CG 3.87Å; D26-K37 WeakPolarHBondContact OD2-CE 3.49Å; D26-K37 IonicContact OD2-NZ 3.15Å; D26-K37 PolarHBondContact OD2-NZ 3.33Å; M28-K37 HydrophobicContact CE-CB 4.34Å; M28-K37 HydrophobicContact SD-CB 3.62Å; M28-K37 HydrophobicContact SD-CD 4.35Å; M28-K37 HydrophobicContact SD-CG 3.65Å
38	A	59.7	Low	55.6	Low	12 Å²	12	53.1 Å²	53.1	10%	0.099	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	148.7	-177.2	0	0	0	0	0	111.4	C27 K40 L43	C27-A38 PolarHBondContact N-O 3.5Å; C27-A38 PolarHBondContact O-N 3.3Å; C27-A38 PolarHBondContact SG-O 3.03Å; A38-K40 PolarHBondContact O-N 3.32Å; A38-L43 HydrophobicContact CB-CD1 3.7Å; A38-L43 HydrophobicContact CB-CG 4.19Å
39	H	64.4	Low	55.6	Low	54 Å²	54	57 Å²	57	25%	0.25	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	126.5	-177.8	-53.4	-49	0	0	0	111.5	L24 D26 N41 V42 L43	L24-H39 HydrophobicContact CB-CB 4.24Å; L24-H39 HydrophobicContact CD1-CB 4.2Å; D26-H39 IonicContact OD1-CE1 2.68Å; D26-H39 PolarHBondContact OD1-CE1 2.84Å; D26-H39 IonicContact OD1-CG 2.74Å; D26-H39 IonicContact OD1-ND1 2.69Å; D26-H39 PolarHBondContact OD1-ND1 3.42Å; H39-N41 VanDerWaalsContact C-N 3.33Å; H39-N41 PolarHBondContact O-N 3.24Å; H39-V42 HydrophobicContact CB-CB 4.21Å; H39-V42 HydrophobicContact CB-CG2 3.87Å; H39-V42 PolarHBondContact O-N 3.32Å; H39-V42 VanDerWaalsContact O-N 3.09Å; H39-L43 PolarHBondContact O-N 3.11Å; H39-L43 VanDerWaalsContact O-N 3.17Å
40	K	64.4	Low	55.7	Low	16 Å²	16	57.3 Å²	57.3	7%	0.07	29%	0.294	C	S	.	.	H	α-helix	trans	-50.8	-47.6	-177.1	-165.4	164.6	179.5	166.6	0	112.3	C25 A38 V42 L43 A44 F54 S57 S58 D63	C25-K40 WeakPolarHBondContact O-CB 3.2Å; C25-K40 PolarHBondContact O-N 2.74Å; A38-K40 PolarHBondContact O-N 3.32Å; K40-V42 PolarHBondContact O-N 2.83Å; K40-L43 PolarHBondContact O-N 2.7Å; K40-A44 WeakPolarHBondContact O-CB 3.5Å; K40-A44 PolarHBondContact O-N 2.69Å; K40-F54 HydrophobicContact CD-CD1 4.17Å; K40-F54 HydrophobicContact CD-CG 4.43Å; K40-F54 HydrophobicContact CG-CB 4.06Å; K40-F54 HydrophobicContact CG-CD1 3.64Å; K40-F54 HydrophobicContact CG-CD2 4Å; K40-F54 HydrophobicContact CG-CE1 4.04Å; K40-F54 HydrophobicContact CG-CE2 4.37Å; K40-F54 HydrophobicContact CG-CG 3.61Å; K40-F54 HydrophobicContact CG-CZ 4.39Å; K40-F54 WeakPolarHBondContact O-CD2 3.35Å; K40-F54 WeakPolarHBondContact O-CE2 3.35Å; K40-S57 WeakPolarHBondContact CE-OG 3.16Å; K40-S57 PolarHBondContact NZ-O 3.13Å; K40-S57 PolarHBondContact NZ-OG 3.08Å; K40-S58 PolarHBondContact NZ-O 3.16Å; K40-D63 IonicContact NZ-OD2 2.7Å; K40-D63 PolarHBondContact NZ-OD2 3.02Å
41	N	58.7	Low	56.2	Low	57 Å²	57	60.7 Å²	60.7	31%	0.305	31%	0.306	S	S	.	.	H	α-helix	trans	-70.2	-32.5	-177.3	-57.6	8.8	0	0	0	112.9	L15 Q18 L24 H39 A44 A45	L15-N41 HydrophobicContact CD2-CB 3.8Å; Q18-N41 PolarHBondContact OE1-ND2 2.82Å; L24-N41 HydrophobicContact CD2-CB 3.96Å; H39-N41 VanDerWaalsContact C-N 3.33Å; H39-N41 PolarHBondContact O-N 3.24Å; N41-A44 PolarHBondContact O-N 3.02Å; N41-A45 WeakPolarHBondContact O-CB 3.48Å; N41-A45 PolarHBondContact O-N 3.1Å
42	V	58.9	Low	56.5	Low	28 Å²	28	63.6 Å²	63.6	17%	0.17	33%	0.327	C	S	.	.	H	α-helix	trans	-70.2	-44.9	178.5	176.6	0	0	0	0	110.2	L15 H39 K40 A45 F46 F81	L15-V42 HydrophobicContact CD1-CG2 4.41Å; L15-V42 HydrophobicContact CD2-CG2 4.02Å; H39-V42 HydrophobicContact CB-CB 4.21Å; H39-V42 HydrophobicContact CB-CG2 3.87Å; H39-V42 PolarHBondContact O-N 3.32Å; H39-V42 VanDerWaalsContact O-N 3.09Å; K40-V42 PolarHBondContact O-N 2.83Å; V42-A45 WeakPolarHBondContact O-CB 3.45Å; V42-A45 PolarHBondContact O-N 3.43Å; V42-F46 HydrophobicContact CG1-CD2 4.05Å; V42-F46 HydrophobicContact CG1-CE2 3.73Å; V42-F46 WeakPolarHBondContact O-CD2 3.36Å; V42-F46 PolarHBondContact O-N 2.86Å; V42-F81 HydrophobicContact CG1-CE1 4.4Å
43	L	62.1	Low	57.1	Low	7 Å²	7	58 Å²	58	4%	0.037	31%	0.31	C	S	.	.	H	α-helix	trans	-62.1	-44.8	173.7	-71	167	0	0	0	111.3	L29 A38 H39 K40 A45 F46 S47 F50 F54 I78	L29-L43 HydrophobicContact CD1-CD1 3.59Å; L29-L43 HydrophobicContact CD1-CD2 3.83Å; L29-L43 HydrophobicContact CD1-CG 4.37Å; L29-L43 HydrophobicContact CD2-CD1 4.12Å; L29-L43 HydrophobicContact CG-CD1 3.93Å; A38-L43 HydrophobicContact CB-CD1 3.7Å; A38-L43 HydrophobicContact CB-CG 4.19Å; H39-L43 PolarHBondContact O-N 3.11Å; H39-L43 VanDerWaalsContact O-N 3.17Å; K40-L43 PolarHBondContact O-N 2.7Å; L43-A45 VanDerWaalsContact C-N 3.3Å; L43-A45 PolarHBondContact O-N 3.12Å; L43-F46 PolarHBondContact O-N 3.37Å; L43-S47 PolarHBondContact O-N 3.22Å; L43-F50 HydrophobicContact CB-CB 4.38Å; L43-F50 HydrophobicContact CB-CD2 4.24Å; L43-F50 HydrophobicContact CB-CG 4.2Å; L43-F50 HydrophobicContact CD2-CD2 4.41Å; L43-F50 HydrophobicContact CD2-CE2 4.18Å; L43-F50 HydrophobicContact CD2-CZ 4.45Å; L43-F50 WeakPolarHBondContact O-CB 3.25Å; L43-F50 WeakPolarHBondContact O-CD2 3.42Å; L43-F54 HydrophobicContact CB-CE2 3.6Å; L43-F54 HydrophobicContact CB-CZ 4.11Å; L43-F54 HydrophobicContact CD1-CE2 4.32Å; L43-F54 HydrophobicContact CD1-CZ 4Å; L43-I78 HydrophobicContact CD2-CD1 4.48Å
44	A	62.2	Low	58	Low	20 Å²	20	56 Å²	56	17%	0.165	28%	0.284	C	S	.	.	H	α-helix	trans	-53.9	-47.2	173.7	0	0	0	0	0	111.3	K40 N41 F46 S47 R51 F54	K40-A44 WeakPolarHBondContact O-CB 3.5Å; K40-A44 PolarHBondContact O-N 2.69Å; N41-A44 PolarHBondContact O-N 3.02Å; A44-F46 VanDerWaalsContact C-N 3.31Å; A44-F46 PolarHBondContact O-N 3.32Å; A44-S47 PolarHBondContact O-N 3.28Å; A44-S47 VanDerWaalsContact O-O 3.05Å; A44-R51 HydrophobicContact CB-CG 4.26Å; A44-R51 WeakPolarHBondContact O-CG 3.27Å; A44-R51 PolarHBondContact O-NH1 3.28Å; A44-F54 HydrophobicContact CB-CD2 3.95Å
45	A	56.2	Low	58.6	Low	15 Å²	15	61.9 Å²	61.9	12%	0.124	31%	0.309	C	S	.	.	H	α-helix	trans	-56.1	-42.3	-179.9	0	0	0	0	0	113.2	L11 L15 N41 V42 L43 R51	L11-A45 HydrophobicContact CD1-CB 3.92Å; L11-A45 HydrophobicContact CD2-CB 3.63Å; L11-A45 HydrophobicContact CG-CB 3.76Å; L15-A45 HydrophobicContact CD1-CB 3.71Å; N41-A45 WeakPolarHBondContact O-CB 3.48Å; N41-A45 PolarHBondContact O-N 3.1Å; V42-A45 WeakPolarHBondContact O-CB 3.45Å; V42-A45 PolarHBondContact O-N 3.43Å; L43-A45 VanDerWaalsContact C-N 3.3Å; L43-A45 PolarHBondContact O-N 3.12Å; A45-R51 PolarHBondContact O-NH1 3.18Å; A45-R51 PolarHBondContact O-NH2 3.41Å
46	F	50.3	Low	58.7	Low	104 Å²	104	65.4 Å²	65.4	46%	0.456	32%	0.323	S	S	.	.	H	α-helix	trans	-75.5	-23.1	-174.9	-77.4	-64.4	0	0	0	115.8	V42 L43 A44 I78 F81	V42-F46 HydrophobicContact CG1-CD2 4.05Å; V42-F46 HydrophobicContact CG1-CE2 3.73Å; V42-F46 WeakPolarHBondContact O-CD2 3.36Å; V42-F46 PolarHBondContact O-N 2.86Å; L43-F46 PolarHBondContact O-N 3.37Å; A44-F46 VanDerWaalsContact C-N 3.31Å; A44-F46 PolarHBondContact O-N 3.32Å; F46-I78 HydrophobicContact CD2-CG1 4.36Å; F46-F81 HydrophobicContact CE2-CD1 4.11Å; F46-F81 HydrophobicContact CE2-CE1 4.19Å; F46-F81 HydrophobicContact CZ-CD1 4.15Å; F46-F81 HydrophobicContact CZ-CE1 4.25Å; F46-F81 HydrophobicContact CZ-CG 4.34Å
47	S	52.5	Low	58.8	Low	35 Å²	35	64.7 Å²	64.7	25%	0.245	32%	0.324	C	S	.	.			trans	-149.9	149	174.9	84.9	0	0	0	0	114.9	L43 A44 Y49 F50 R51	L43-S47 PolarHBondContact O-N 3.22Å; A44-S47 PolarHBondContact O-N 3.28Å; A44-S47 VanDerWaalsContact O-O 3.05Å; S47-Y49 PolarHBondContact O-N 3.5Å; S47-Y49 PolarHBondContact OG-N 2.8Å; S47-F50 PolarHBondContact O-N 2.88Å; S47-F50 WeakPolarHBondContact OG-CD2 3.44Å; S47-F50 WeakPolarHBondContact OG-CG 3.37Å; S47-F50 PolarHBondContact OG-N 3.24Å; S47-R51 PolarHBondContact O-N 3.27Å
48	Q	54.1	Low	58.7	Low	166 Å²	166	62.6 Å²	62.6	78%	0.776	33%	0.325	S	S	*	.	H	α-helix	trans	-63.5	-30.7	172.1	-72	177.7	-21.9	0	0	112.5	R51 S52	Q48-R51 PolarHBondContact O-N 3.36Å; Q48-S52 WeakPolarHBondContact O-CB 3.5Å; Q48-S52 PolarHBondContact O-N 3.41Å
49	Y	59.8	Low	58.3	Low	135 Å²	135	67.3 Å²	67.3	53%	0.529	36%	0.357	S	S	.	.	H	α-helix	trans	-60.8	-46.3	173.8	173.6	-103.9	0	0	0	111.4	S47 S52 L53 L67	S47-Y49 PolarHBondContact O-N 3.5Å; S47-Y49 PolarHBondContact OG-N 2.8Å; Y49-S52 PolarHBondContact O-N 3.48Å; Y49-L53 HydrophobicContact CD1-CD1 3.99Å; Y49-L53 HydrophobicContact CE1-CD1 3.51Å; Y49-L53 HydrophobicContact CE2-CD1 4.37Å; Y49-L53 PolarHBondContact O-N 3.45Å; Y49-L67 HydrophobicContact CE1-CD2 3.78Å
50	F	62.2	Low	57.7	Low	19 Å²	19	71.1 Å²	71.1	8%	0.083	38%	0.375	C	S	.	.	H	α-helix	trans	-69.6	-37.3	173.8	-69.6	-47.4	0	0	0	112.7	L43 S47 S52 L53 F54 L67 I78	L43-F50 HydrophobicContact CB-CB 4.38Å; L43-F50 HydrophobicContact CB-CD2 4.24Å; L43-F50 HydrophobicContact CB-CG 4.2Å; L43-F50 HydrophobicContact CD2-CD2 4.41Å; L43-F50 HydrophobicContact CD2-CE2 4.18Å; L43-F50 HydrophobicContact CD2-CZ 4.45Å; L43-F50 WeakPolarHBondContact O-CB 3.25Å; L43-F50 WeakPolarHBondContact O-CD2 3.42Å; S47-F50 PolarHBondContact O-N 2.88Å; S47-F50 WeakPolarHBondContact OG-CD2 3.44Å; S47-F50 WeakPolarHBondContact OG-CG 3.37Å; S47-F50 PolarHBondContact OG-N 3.24Å; F50-S52 VanDerWaalsContact C-N 3.31Å; F50-S52 PolarHBondContact O-N 3.24Å; F50-L53 HydrophobicContact CD1-CD1 3.93Å; F50-L53 HydrophobicContact CE1-CD1 4.35Å; F50-L53 PolarHBondContact O-N 3Å; F50-F54 HydrophobicContact CB-CD2 4.26Å; F50-F54 HydrophobicContact CB-CE2 3.86Å; F50-F54 HydrophobicContact CD1-CE2 4.34Å; F50-F54 HydrophobicContact CD1-CZ 4.47Å; F50-F54 HydrophobicContact CG-CE2 4.37Å; F50-F54 WeakPolarHBondContact O-CD2 3.5Å; F50-F54 WeakPolarHBondContact O-CG 3.45Å; F50-F54 PolarHBondContact O-N 3.36Å; F50-L67 HydrophobicContact CE1-CD1 4.06Å; F50-L67 HydrophobicContact CE1-CD2 4.14Å; F50-L67 HydrophobicContact CZ-CD1 4.34Å; F50-I78 HydrophobicContact CE2-CD1 4.41Å
51	R	64.8	Low	57	Low	78 Å²	78	77.4 Å²	77.4	29%	0.294	40%	0.402	S	S	.	.	H	α-helix	trans	-54.3	-48.7	170.8	-68.1	-177.2	171.4	74.8	-13.3	111	A44 A45 S47 Q48 F54 Q55	A44-R51 HydrophobicContact CB-CG 4.26Å; A44-R51 WeakPolarHBondContact O-CG 3.27Å; A44-R51 PolarHBondContact O-NH1 3.28Å; A45-R51 PolarHBondContact O-NH1 3.18Å; A45-R51 PolarHBondContact O-NH2 3.41Å; S47-R51 PolarHBondContact O-N 3.27Å; Q48-R51 PolarHBondContact O-N 3.36Å; R51-F54 PolarHBondContact O-N 3.47Å; R51-Q55 WeakPolarHBondContact O-CB 3.5Å; R51-Q55 PolarHBondContact O-N 3.29Å
52	S	60.7	Low	56.7	Low	75 Å²	75	80.9 Å²	80.9	52%	0.524	42%	0.421	S	S	.	.	H	α-helix	trans	-64.2	-42	-179.8	178.6	0	0	0	0	113	Q48 Y49 F50 F54	Q48-S52 WeakPolarHBondContact O-CB 3.5Å; Q48-S52 PolarHBondContact O-N 3.41Å; Y49-S52 PolarHBondContact O-N 3.48Å; F50-S52 VanDerWaalsContact C-N 3.31Å; F50-S52 PolarHBondContact O-N 3.24Å; S52-F54 VanDerWaalsContact C-N 3.31Å; S52-F54 PolarHBondContact O-N 3.38Å
53	L	62.6	Low	56.6	Low	57 Å²	57	81 Å²	81	30%	0.298	42%	0.421	S	S	.	.	H	α-helix	trans	-59.4	-40.9	174.2	-80.2	168.3	0	0	0	112.2	Y49 F50 F65 L67	Y49-L53 HydrophobicContact CD1-CD1 3.99Å; Y49-L53 HydrophobicContact CE1-CD1 3.51Å; Y49-L53 HydrophobicContact CE2-CD1 4.37Å; Y49-L53 PolarHBondContact O-N 3.45Å; F50-L53 HydrophobicContact CD1-CD1 3.93Å; F50-L53 HydrophobicContact CE1-CD1 4.35Å; F50-L53 PolarHBondContact O-N 3Å; L53-F65 HydrophobicContact CD2-CD1 4.46Å; L53-L67 HydrophobicContact CD1-CD2 4.47Å
54	F	64.6	Low	56.4	Low	18 Å²	18	84.6 Å²	84.6	8%	0.079	44%	0.443	C	S	.	.	H	α-helix	trans	-87.8	-19.2	-175.4	-57.9	-46.1	0	0	0	114.6	K40 L43 A44 F50 R51 S52 N56 S57 F65	K40-F54 HydrophobicContact CD-CD1 4.17Å; K40-F54 HydrophobicContact CD-CG 4.43Å; K40-F54 HydrophobicContact CG-CB 4.06Å; K40-F54 HydrophobicContact CG-CD1 3.64Å; K40-F54 HydrophobicContact CG-CD2 4Å; K40-F54 HydrophobicContact CG-CE1 4.04Å; K40-F54 HydrophobicContact CG-CE2 4.37Å; K40-F54 HydrophobicContact CG-CG 3.61Å; K40-F54 HydrophobicContact CG-CZ 4.39Å; K40-F54 WeakPolarHBondContact O-CD2 3.35Å; K40-F54 WeakPolarHBondContact O-CE2 3.35Å; L43-F54 HydrophobicContact CB-CE2 3.6Å; L43-F54 HydrophobicContact CB-CZ 4.11Å; L43-F54 HydrophobicContact CD1-CE2 4.32Å; L43-F54 HydrophobicContact CD1-CZ 4Å; A44-F54 HydrophobicContact CB-CD2 3.95Å; F50-F54 HydrophobicContact CB-CD2 4.26Å; F50-F54 HydrophobicContact CB-CE2 3.86Å; F50-F54 HydrophobicContact CD1-CE2 4.34Å; F50-F54 HydrophobicContact CD1-CZ 4.47Å; F50-F54 HydrophobicContact CG-CE2 4.37Å; F50-F54 WeakPolarHBondContact O-CD2 3.5Å; F50-F54 WeakPolarHBondContact O-CG 3.45Å; F50-F54 PolarHBondContact O-N 3.36Å; R51-F54 PolarHBondContact O-N 3.47Å; S52-F54 VanDerWaalsContact C-N 3.31Å; S52-F54 PolarHBondContact O-N 3.38Å; F54-N56 PolarHBondContact O-N 3.38Å; F54-S57 WeakPolarHBondContact CA-OG 3.36Å; F54-S57 PolarHBondContact O-N 2.87Å; F54-S57 PolarHBondContact O-OG 2.93Å; F54-F65 AromaticContact CD1-CE2 3.99Å; F54-F65 HydrophobicContact CD1-CE2 3.99Å; F54-F65 AromaticContact CD1-CZ 3.86Å; F54-F65 HydrophobicContact CD1-CZ 3.86Å; F54-F65 AromaticContact CE1-CD2 3.96Å; F54-F65 HydrophobicContact CE1-CD2 3.96Å; F54-F65 HydrophobicContact CE1-CE1 4.46Å; F54-F65 AromaticContact CE1-CE2 3.45Å; F54-F65 HydrophobicContact CE1-CE2 3.45Å; F54-F65 VanDerWaalsContact CE1-CE2 3.45Å; F54-F65 AromaticContact CE1-CZ 3.75Å; F54-F65 HydrophobicContact CE1-CZ 3.75Å
55	Q	57.2	Low	56.3	Low	156 Å²	156	85.3 Å²	85.3	73%	0.729	44%	0.442	S	S	*	.	H	α-helix	trans	-61.5	-27.1	-176.6	-124	166.8	-29	0	0	114.3	R51	R51-Q55 WeakPolarHBondContact O-CB 3.5Å; R51-Q55 PolarHBondContact O-N 3.29Å
56	N	52.6	Low	56.2	Low	151 Å²	151	91.5 Å²	91.5	81%	0.807	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	-8.8	-177.9	-63.8	-17.6	0	0	0	113.6	F54	F54-N56 PolarHBondContact O-N 3.38Å
57	S	54.9	Low	56.5	Low	30 Å²	30	87.4 Å²	87.4	21%	0.21	45%	0.451	C	S	.	.	S	Bend	trans	-84.4	120	180	57.8	0	0	0	0	111	K40 F54	K40-S57 WeakPolarHBondContact CE-OG 3.16Å; K40-S57 PolarHBondContact NZ-O 3.13Å; K40-S57 PolarHBondContact NZ-OG 3.08Å; F54-S57 WeakPolarHBondContact CA-OG 3.36Å; F54-S57 PolarHBondContact O-N 2.87Å; F54-S57 PolarHBondContact O-OG 2.93Å
58	S	49.9	Very low	56.5	Low	82 Å²	82	93.3 Å²	93.3	57%	0.573	48%	0.48	S	S	*	.			trans	-63.6	169.4	178.7	65	0	0	0	0	112.4	K40 Q60	K40-S58 PolarHBondContact NZ-O 3.16Å; S58-Q60 PolarHBondContact O-N 3.2Å
59	S	51.1	Low	56.3	Low	111 Å²	111	87.6 Å²	87.6	78%	0.776	46%	0.456	S	S	*	.	S	Bend	trans	-77.1	36.7	-166.3	-50.1	0	0	0	0	115.4
60	Q	52.5	Low	55.7	Low	133 Å²	133	90.6 Å²	90.6	62%	0.621	47%	0.472	S	S	*	.			trans	-79.9	143.5	173.5	-64.6	-165.7	-6.3	0	0	111	S58 N62	S58-Q60 PolarHBondContact O-N 3.2Å; Q60-N62 VanDerWaalsContact C-N 3.29Å; Q60-N62 PolarHBondContact O-N 3Å
61	K	50.2	Low	55.1	Low	148 Å²	148	96 Å²	96	64%	0.643	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	7.2	-171.3	-64.9	-173.9	175.5	-175	0	114.6	D26	D26-K61 CarbonylContact O-C 3.44Å
62	N	51.3	Low	54.3	Low	130 Å²	130	94.9 Å²	94.9	70%	0.695	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.9	21.5	-166.8	-67.1	-26.6	0	0	0	112.7	Q60 V64	Q60-N62 VanDerWaalsContact C-N 3.29Å; Q60-N62 PolarHBondContact O-N 3Å; N62-V64 WeakPolarHBondContact O-CG2 3.46Å; N62-V64 PolarHBondContact O-N 3.26Å
63	D	57.6	Low	53.5	Low	31 Å²	31	95.7 Å²	95.7	17%	0.166	51%	0.509	C	S	.	.			trans	-61.9	123.4	178.1	-62.6	-24	0	0	0	110.5	C27 M28 K40 F65	C27-D63 HydrophobicContact CB-CB 4.4Å; M28-D63 PolarHBondContact N-O 2.88Å; K40-D63 IonicContact NZ-OD2 2.7Å; K40-D63 PolarHBondContact NZ-OD2 3.02Å; D63-F65 HydrophobicContact CB-CD2 4.12Å; D63-F65 HydrophobicContact CB-CE2 3.26Å; D63-F65 HydrophobicContact CB-CZ 3.71Å
64	V	58.2	Low	52.9	Low	83 Å²	83	94.5 Å²	94.5	50%	0.503	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	115.4	-179.4	-171.6	0	0	0	0	109.9	M28 V30 N62	M28-V64 HydrophobicContact CB-CG1 4.41Å; M28-V64 HydrophobicContact CB-CG2 4.24Å; M28-V64 CarbonylContact O-C 3.07Å; M28-V64 WeakPolarHBondContact O-CA 3.45Å; V30-V64 HydrophobicContact CG2-CG1 3.44Å; V30-V64 VanDerWaalsContact CG2-CG1 3.44Å; N62-V64 WeakPolarHBondContact O-CG2 3.46Å; N62-V64 PolarHBondContact O-N 3.26Å
65	F	59.3	Low	52.3	Low	35 Å²	35	95.7 Å²	95.7	15%	0.154	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	113.8	-175.7	-63.3	-86.5	0	0	0	111.8	C27 M28 L29 V30 L53 F54 D63	C27-F65 HydrophobicContact CB-CD2 4.26Å; C27-F65 HydrophobicContact CB-CE2 4.07Å; M28-F65 PolarHBondContact O-N 3.26Å; L29-F65 HydrophobicContact CD2-CB 3.92Å; L29-F65 HydrophobicContact CD2-CD2 4.27Å; L29-F65 HydrophobicContact CD2-CG 4.47Å; V30-F65 PolarHBondContact N-O 3.17Å; L53-F65 HydrophobicContact CD2-CD1 4.46Å; F54-F65 AromaticContact CD1-CE2 3.99Å; F54-F65 HydrophobicContact CD1-CE2 3.99Å; F54-F65 AromaticContact CD1-CZ 3.86Å; F54-F65 HydrophobicContact CD1-CZ 3.86Å; F54-F65 AromaticContact CE1-CD2 3.96Å; F54-F65 HydrophobicContact CE1-CD2 3.96Å; F54-F65 HydrophobicContact CE1-CE1 4.46Å; F54-F65 AromaticContact CE1-CE2 3.45Å; F54-F65 HydrophobicContact CE1-CE2 3.45Å; F54-F65 VanDerWaalsContact CE1-CE2 3.45Å; F54-F65 AromaticContact CE1-CZ 3.75Å; F54-F65 HydrophobicContact CE1-CZ 3.75Å; D63-F65 HydrophobicContact CB-CD2 4.12Å; D63-F65 HydrophobicContact CB-CE2 3.26Å; D63-F65 HydrophobicContact CB-CZ 3.71Å
66	H	54.6	Low	52.1	Low	145 Å²	145	89.8 Å²	89.8	67%	0.671	50%	0.499	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	125.5	173.1	-68.3	-103.6	0	0	0	110.3	V30	V30-H66 WeakPolarHBondContact O-CA 3.34Å
67	L	56.6	Low	52	Low	17 Å²	17	89.3 Å²	89.3	9%	0.089	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	103.5	-172	-76.6	168.9	0	0	0	111.8	L29 V30 V31 Y49 F50 L53	L29-L67 HydrophobicContact CB-CD1 4.12Å; L29-L67 HydrophobicContact CD1-CD1 3.83Å; L29-L67 HydrophobicContact CD2-CD1 3.97Å; L29-L67 HydrophobicContact CG-CD1 4.2Å; V30-L67 PolarHBondContact O-N 2.98Å; V31-L67 HydrophobicContact CG2-CB 4.24Å; V31-L67 HydrophobicContact CG2-CD1 4.19Å; Y49-L67 HydrophobicContact CE1-CD2 3.78Å; F50-L67 HydrophobicContact CE1-CD1 4.06Å; F50-L67 HydrophobicContact CE1-CD2 4.14Å; F50-L67 HydrophobicContact CZ-CD1 4.34Å; L53-L67 HydrophobicContact CD1-CD2 4.47Å
68	D	51.1	Low	51.7	Low	159 Å²	159	89.2 Å²	89.2	85%	0.85	49%	0.489	S	S	*	.			trans	-77.5	133.7	172.4	-95.8	-41.1	0	0	0	112.4	K70	D68-K70 PolarHBondContact O-N 2.99Å
69	V	50.2	Low	51.9	Low	46 Å²	46	88.1 Å²	88.1	28%	0.279	48%	0.476	S	S	.	.			trans	-90.3	105	-154	-179.9	0	0	0	0	112.1	V31 R32 V72	V31-V69 HydrophobicContact CG1-CG2 3.94Å; R32-V69 HydrophobicContact CG-CG2 3.79Å; V69-V72 HydrophobicContact CG1-CG2 3.36Å
70	K	47.3	Very low	51.7	Low	199 Å²	199	88 Å²	88	87%	0.865	47%	0.466	S	S	*	.	S	Bend	trans	-121.9	-0.3	167.2	-71.3	-172.7	177.6	177.6	0	115.5	D68	D68-K70 PolarHBondContact O-N 2.99Å
71	N	49.2	Very low	51.4	Low	133 Å²	133	85.5 Å²	85.5	71%	0.711	45%	0.454	S	S	*	.			trans	-144.8	67.6	179.1	-105.2	-38.6	0	0	0	113.2	S73	N71-S73 VanDerWaalsContact C-N 3.28Å; N71-S73 PolarHBondContact O-N 2.86Å
72	V	48.5	Very low	51.3	Low	54 Å²	54	81.1 Å²	81.1	33%	0.327	44%	0.436	S	S	.	.	H	α-helix	trans	-59	-37	179.7	-176.7	0	0	0	0	112.7	V69 G74 I75 G76 L104	V69-V72 HydrophobicContact CG1-CG2 3.36Å; V72-G74 VanDerWaalsContact C-N 3.34Å; V72-G74 PolarHBondContact O-N 3.03Å; V72-I75 PolarHBondContact O-N 3.25Å; V72-I75 VanDerWaalsContact O-N 3.1Å; V72-G76 PolarHBondContact O-N 2.6Å; V72-L104 HydrophobicContact CG1-CD2 4.47Å
73	S	45.3	Very low	51	Low	91 Å²	91	80.9 Å²	80.9	64%	0.636	43%	0.426	S	S	*	.	H	α-helix	trans	-57.9	-40.8	-171.9	-168.5	0	0	0	0	113.6	N71	N71-S73 VanDerWaalsContact C-N 3.28Å; N71-S73 PolarHBondContact O-N 2.86Å
74	G	48.7	Very low	50.2	Low	33 Å²	33	83.8 Å²	83.8	34%	0.34	45%	0.446	S	S	.	.	H	α-helix	trans	-70.7	-34.5	177.6	0	0	0	0	0	113.4	V72 G76 Q77 I78	V72-G74 VanDerWaalsContact C-N 3.34Å; V72-G74 PolarHBondContact O-N 3.03Å; G74-G76 VanDerWaalsContact C-N 3.33Å; G74-G76 PolarHBondContact O-N 2.74Å; G74-Q77 PolarHBondContact O-N 2.88Å; G74-I78 WeakPolarHBondContact O-CG1 3.23Å; G74-I78 PolarHBondContact O-N 3.45Å; G74-I78 VanDerWaalsContact O-N 3.13Å
75	I	52.9	Low	49.2	Very low	42 Å²	42	81.7 Å²	81.7	22%	0.215	43%	0.434	C	S	.	.	H	α-helix	trans	-65.8	-39	179.2	-58.4	174.2	0	0	0	110.3	V72 Q77 I78 L79	V72-I75 PolarHBondContact O-N 3.25Å; V72-I75 VanDerWaalsContact O-N 3.1Å; I75-Q77 VanDerWaalsContact C-N 3.3Å; I75-Q77 PolarHBondContact O-N 3.11Å; I75-I78 PolarHBondContact O-N 3.1Å; I75-L79 HydrophobicContact CG2-CD1 4.18Å; I75-L79 HydrophobicContact CG2-CG 4.45Å; I75-L79 WeakPolarHBondContact O-CG 3.4Å; I75-L79 PolarHBondContact O-N 2.71Å
76	G	51.7	Low	48.3	Very low	33 Å²	33	88.4 Å²	88.4	34%	0.34	47%	0.466	S	S	.	.	H	α-helix	trans	-58.7	-38.3	174.5	0	0	0	0	0	113.5	V72 G74 D80	V72-G76 PolarHBondContact O-N 2.6Å; G74-G76 VanDerWaalsContact C-N 3.33Å; G74-G76 PolarHBondContact O-N 2.74Å; G76-D80 PolarHBondContact O-N 3.12Å; G76-D80 VanDerWaalsContact O-N 3.09Å
77	Q	51.3	Low	47.7	Very low	140 Å²	140	85.7 Å²	85.7	65%	0.654	46%	0.456	S	S	*	.	H	α-helix	trans	-71.5	-34.9	176.4	-63.2	178.8	4.1	0	0	112.3	G74 I75 F81	G74-Q77 PolarHBondContact O-N 2.88Å; I75-Q77 VanDerWaalsContact C-N 3.3Å; I75-Q77 PolarHBondContact O-N 3.11Å; Q77-F81 WeakPolarHBondContact O-CB 3.39Å; Q77-F81 PolarHBondContact O-N 2.79Å
78	I	48.9	Very low	46.7	Very low	29 Å²	29	92.4 Å²	92.4	15%	0.149	49%	0.492	C	S	.	.	H	α-helix	trans	-67.6	-39.5	175.3	-66.6	165.8	0	0	0	110.8	L43 F46 F50 G74 I75 F81 M82	L43-I78 HydrophobicContact CD2-CD1 4.48Å; F46-I78 HydrophobicContact CD2-CG1 4.36Å; F50-I78 HydrophobicContact CE2-CD1 4.41Å; G74-I78 WeakPolarHBondContact O-CG1 3.23Å; G74-I78 PolarHBondContact O-N 3.45Å; G74-I78 VanDerWaalsContact O-N 3.13Å; I75-I78 PolarHBondContact O-N 3.1Å; I78-F81 PolarHBondContact O-N 2.98Å; I78-M82 HydrophobicContact CG2-SD 4.37Å; I78-M82 WeakPolarHBondContact O-CG 3.32Å; I78-M82 PolarHBondContact O-N 3.25Å
79	L	52.8	Low	46.6	Very low	58 Å²	58	87.7 Å²	87.7	30%	0.304	47%	0.466	S	S	.	.	H	α-helix	trans	-66.9	-41.7	175.7	-69	170.6	0	0	0	112.2	I75 F81 M82 Y83	I75-L79 HydrophobicContact CG2-CD1 4.18Å; I75-L79 HydrophobicContact CG2-CG 4.45Å; I75-L79 WeakPolarHBondContact O-CG 3.4Å; I75-L79 PolarHBondContact O-N 2.71Å; L79-F81 VanDerWaalsContact C-N 3.31Å; L79-F81 PolarHBondContact O-N 3.06Å; L79-M82 PolarHBondContact O-N 3.4Å; L79-Y83 PolarHBondContact O-N 3.35Å
80	D	47.6	Very low	46.7	Very low	108 Å²	108	90.7 Å²	90.7	58%	0.578	48%	0.481	S	S	*	.	H	α-helix	trans	-63.3	-37.2	174.2	-163.5	44.9	0	0	0	111.7	G76 Y83 T84	G76-D80 PolarHBondContact O-N 3.12Å; G76-D80 VanDerWaalsContact O-N 3.09Å; D80-Y83 PolarHBondContact O-N 3.03Å; D80-T84 WeakPolarHBondContact O-CB 3.49Å; D80-T84 WeakPolarHBondContact O-CG2 3.34Å; D80-T84 PolarHBondContact O-N 3.41Å; D80-T84 PolarHBondContact O-OG1 3.26Å
81	F	47.4	Very low	46.6	Very low	82 Å²	82	87.2 Å²	87.2	36%	0.36	47%	0.468	S	S	.	.	H	α-helix	trans	-66.9	-39.6	172.3	-178.8	-103	0	0	0	113.3	V42 F46 Q77 I78 L79 T84 S85	V42-F81 HydrophobicContact CG1-CE1 4.4Å; F46-F81 HydrophobicContact CE2-CD1 4.11Å; F46-F81 HydrophobicContact CE2-CE1 4.19Å; F46-F81 HydrophobicContact CZ-CD1 4.15Å; F46-F81 HydrophobicContact CZ-CE1 4.25Å; F46-F81 HydrophobicContact CZ-CG 4.34Å; Q77-F81 WeakPolarHBondContact O-CB 3.39Å; Q77-F81 PolarHBondContact O-N 2.79Å; I78-F81 PolarHBondContact O-N 2.98Å; L79-F81 VanDerWaalsContact C-N 3.31Å; L79-F81 PolarHBondContact O-N 3.06Å; F81-T84 WeakPolarHBondContact CA-OG1 3.48Å; F81-T84 PolarHBondContact O-OG1 3.04Å; F81-S85 WeakPolarHBondContact O-CB 3.41Å; F81-S85 PolarHBondContact O-N 3.21Å; F81-S85 PolarHBondContact O-OG 2.94Å
82	M	46.5	Very low	46.3	Very low	55 Å²	55	86.7 Å²	86.7	27%	0.271	47%	0.465	S	S	.	.	H	α-helix	trans	-66.2	-39	174.2	-74.5	179	69.4	0	0	111.9	I78 L79 S85 L87	I78-M82 HydrophobicContact CG2-SD 4.37Å; I78-M82 WeakPolarHBondContact O-CG 3.32Å; I78-M82 PolarHBondContact O-N 3.25Å; L79-M82 PolarHBondContact O-N 3.4Å; M82-S85 WeakPolarHBondContact O-CB 3.44Å; M82-S85 PolarHBondContact O-N 3.46Å; M82-L87 HydrophobicContact CB-CD1 4.35Å; M82-L87 HydrophobicContact CE-CD1 4.07Å
83	Y	46.3	Very low	46.4	Very low	125 Å²	125	87.9 Å²	87.9	49%	0.49	47%	0.47	S	S	.	.	H	α-helix	trans	-70.1	-43.6	177.9	-171.6	-108.1	0	0	0	112.6	L79 D80 S85 H86 L89	L79-Y83 PolarHBondContact O-N 3.35Å; D80-Y83 PolarHBondContact O-N 3.03Å; Y83-S85 PolarHBondContact O-N 3.02Å; Y83-S85 VanDerWaalsContact O-N 3.14Å; Y83-H86 PolarHBondContact O-N 3.23Å; Y83-L89 HydrophobicContact CD2-CD1 3.83Å; Y83-L89 HydrophobicContact CE2-CD1 4.05Å
84	T	40.7	Very low	46.8	Very low	93 Å²	93	84 Å²	84	57%	0.571	44%	0.441	S	S	*	.	H	α-helix	trans	-66.6	-9.9	174.1	49.3	0	0	0	0	114	D80 F81	D80-T84 WeakPolarHBondContact O-CB 3.49Å; D80-T84 WeakPolarHBondContact O-CG2 3.34Å; D80-T84 PolarHBondContact O-N 3.41Å; D80-T84 PolarHBondContact O-OG1 3.26Å; F81-T84 WeakPolarHBondContact CA-OG1 3.48Å; F81-T84 PolarHBondContact O-OG1 3.04Å
85	S	37.3	Very low	46.7	Very low	38 Å²	38	86 Å²	86	27%	0.266	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	0.6	176.1	-65.8	0	0	0	0	115	F81 M82 Y83	F81-S85 WeakPolarHBondContact O-CB 3.41Å; F81-S85 PolarHBondContact O-N 3.21Å; F81-S85 PolarHBondContact O-OG 2.94Å; M82-S85 WeakPolarHBondContact O-CB 3.44Å; M82-S85 PolarHBondContact O-N 3.46Å; Y83-S85 PolarHBondContact O-N 3.02Å; Y83-S85 VanDerWaalsContact O-N 3.14Å
86	H	39.6	Very low	46.5	Very low	176 Å²	176	87.2 Å²	87.2	82%	0.815	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	59.1	-173.6	-78.5	-88.3	0	0	0	113.2	Y83	Y83-H86 PolarHBondContact O-N 3.23Å
87	L	41.7	Very low	46.2	Very low	89 Å²	89	88 Å²	88	47%	0.466	45%	0.446	S	S	.	.			trans	-88.7	126.3	162.2	-68.7	170.3	0	0	0	108.9	M82 L89	M82-L87 HydrophobicContact CB-CD1 4.35Å; M82-L87 HydrophobicContact CE-CD1 4.07Å; L87-L89 PolarHBondContact O-N 3.39Å
88	D	36.8	Very low	46.3	Very low	157 Å²	157	81.8 Å²	81.8	84%	0.84	42%	0.418	S	S	*	.			trans	-67.6	128.5	179	-70.7	-51.9	0	0	0	111.3
89	L	47.8	Very low	46.1	Very low	61 Å²	61	83.9 Å²	83.9	32%	0.319	43%	0.429	S	S	.	.			trans	-116.5	100.9	-173.1	-77.2	162.2	0	0	0	110.4	Y83 L87 N93 I94 M97	Y83-L89 HydrophobicContact CD2-CD1 3.83Å; Y83-L89 HydrophobicContact CE2-CD1 4.05Å; L87-L89 PolarHBondContact O-N 3.39Å; L89-N93 HydrophobicContact CD2-CB 3.98Å; L89-I94 HydrophobicContact CB-CG1 4.28Å; L89-M97 HydrophobicContact CD1-CE 3.86Å; L89-M97 HydrophobicContact CD1-SD 4.36Å; L89-M97 HydrophobicContact CD2-CE 4.32Å; L89-M97 HydrophobicContact CD2-SD 4.4Å
90	N	52.6	Low	45.6	Very low	109 Å²	109	81.7 Å²	81.7	58%	0.583	42%	0.418	S	S	*	.			trans	-62.3	157.5	172.2	-68.1	-6.1	0	0	0	111.6	D92 N93 I94	N90-D92 VanDerWaalsContact C-N 3.27Å; N90-D92 PolarHBondContact O-N 2.98Å; N90-N93 WeakPolarHBondContact O-CB 3.47Å; N90-N93 PolarHBondContact O-N 3.19Å; N90-I94 PolarHBondContact O-N 3.15Å
91	Q	45.6	Very low	45.7	Very low	126 Å²	126	76.8 Å²	76.8	59%	0.589	39%	0.392	S	S	*	.	H	α-helix	trans	-58.4	-35.7	-172.6	-170.6	165.1	-19.6	0	0	113.5	I94 Q95	Q91-I94 WeakPolarHBondContact O-CB 3.49Å; Q91-I94 PolarHBondContact O-N 3.27Å; Q91-Q95 PolarHBondContact O-N 3.39Å
92	D	43.4	Very low	45.8	Very low	122 Å²	122	77.6 Å²	77.6	65%	0.652	40%	0.398	S	S	*	.	H	α-helix	trans	-64.8	-40.7	176.3	-45.3	-65.2	0	0	0	111.9	N90 I94 Q95 V96	N90-D92 VanDerWaalsContact C-N 3.27Å; N90-D92 PolarHBondContact O-N 2.98Å; D92-I94 PolarHBondContact O-N 2.89Å; D92-Q95 PolarHBondContact O-N 2.97Å; D92-V96 WeakPolarHBondContact O-CG2 3.47Å; D92-V96 PolarHBondContact O-N 2.98Å
93	N	50.7	Low	45.7	Very low	79 Å²	79	78.6 Å²	78.6	42%	0.422	41%	0.409	S	S	.	.	H	α-helix	trans	-63.9	-32.1	175.8	-62.8	-18.9	0	0	0	111.2	L89 N90 V96 M97	L89-N93 HydrophobicContact CD2-CB 3.98Å; N90-N93 WeakPolarHBondContact O-CB 3.47Å; N90-N93 PolarHBondContact O-N 3.19Å; N93-V96 PolarHBondContact O-N 3.35Å; N93-M97 WeakPolarHBondContact O-CB 3.37Å; N93-M97 WeakPolarHBondContact O-CG 3.41Å; N93-M97 PolarHBondContact O-N 3.48Å
94	I	52.9	Low	45.5	Very low	9 Å²	9	74 Å²	74	5%	0.046	39%	0.392	C	S	.	.	H	α-helix	trans	-70.7	-36.8	177.4	-61.9	175.5	0	0	0	111	L89 N90 Q91 D92 M97 L98 C113 F116 L117	L89-I94 HydrophobicContact CB-CG1 4.28Å; N90-I94 PolarHBondContact O-N 3.15Å; Q91-I94 WeakPolarHBondContact O-CB 3.49Å; Q91-I94 PolarHBondContact O-N 3.27Å; D92-I94 PolarHBondContact O-N 2.89Å; I94-M97 HydrophobicContact CG1-CE 4.24Å; I94-M97 PolarHBondContact O-N 2.84Å; I94-L98 PolarHBondContact O-N 3.42Å; I94-C113 HydrophobicContact CG2-CB 4.3Å; I94-F116 HydrophobicContact CD1-CD1 3.51Å; I94-F116 HydrophobicContact CD1-CE1 3.44Å; I94-F116 VanDerWaalsContact CD1-CE1 3.44Å; I94-F116 HydrophobicContact CD1-CG 4.19Å; I94-F116 HydrophobicContact CD1-CZ 4.08Å; I94-L117 HydrophobicContact CG2-CG 4.46Å
95	Q	46.9	Very low	45.7	Very low	76 Å²	76	77.8 Å²	77.8	36%	0.355	40%	0.404	S	S	.	.	H	α-helix	trans	-66.7	-44.1	172.6	-171.6	60.4	45.1	0	0	111.2	Q91 D92 M97 L98 D99	Q91-Q95 PolarHBondContact O-N 3.39Å; D92-Q95 PolarHBondContact O-N 2.97Å; Q95-M97 VanDerWaalsContact C-N 3.29Å; Q95-M97 PolarHBondContact O-N 3.4Å; Q95-L98 VanDerWaalsContact NE2-CD2 3.32Å; Q95-L98 WeakPolarHBondContact O-CB 3.27Å; Q95-L98 PolarHBondContact O-N 3.21Å; Q95-D99 PolarHBondContact NE2-OD1 2.83Å; Q95-D99 PolarHBondContact O-N 2.84Å
96	V	48	Very low	46.4	Very low	67 Å²	67	78.2 Å²	78.2	41%	0.406	41%	0.405	S	S	.	.	H	α-helix	trans	-60.6	-37.9	174.8	174.1	0	0	0	0	111.8	V34 D92 N93 T100	V34-V96 HydrophobicContact CG1-CG1 3.4Å; D92-V96 WeakPolarHBondContact O-CG2 3.47Å; D92-V96 PolarHBondContact O-N 2.98Å; N93-V96 PolarHBondContact O-N 3.35Å; V96-T100 VanDerWaalsContact O-CB 3.29Å; V96-T100 WeakPolarHBondContact O-CB 3.46Å; V96-T100 PolarHBondContact O-N 2.96Å; V96-T100 PolarHBondContact O-OG1 2.9Å
97	M	46.5	Very low	46.6	Very low	48 Å²	48	75.1 Å²	75.1	24%	0.236	39%	0.391	C	S	.	.	H	α-helix	trans	-67	-36.7	171.9	-75.8	-161.7	-51.7	0	0	113.2	L89 N93 I94 Q95 A101	L89-M97 HydrophobicContact CD1-CE 3.86Å; L89-M97 HydrophobicContact CD1-SD 4.36Å; L89-M97 HydrophobicContact CD2-CE 4.32Å; L89-M97 HydrophobicContact CD2-SD 4.4Å; N93-M97 WeakPolarHBondContact O-CB 3.37Å; N93-M97 WeakPolarHBondContact O-CG 3.41Å; N93-M97 PolarHBondContact O-N 3.48Å; I94-M97 HydrophobicContact CG1-CE 4.24Å; I94-M97 PolarHBondContact O-N 2.84Å; Q95-M97 VanDerWaalsContact C-N 3.29Å; Q95-M97 PolarHBondContact O-N 3.4Å; M97-A101 VanDerWaalsContact O-CB 3.25Å; M97-A101 WeakPolarHBondContact O-CB 3.37Å; M97-A101 PolarHBondContact O-N 3.11Å
98	L	51.4	Low	46.8	Very low	10 Å²	10	77.4 Å²	77.4	5%	0.052	40%	0.403	C	S	.	.	H	α-helix	trans	-62.1	-52	176.6	-172.5	97.9	0	0	0	110.5	I94 Q95 T100 A101 Q102 L110 C113 L117	I94-L98 PolarHBondContact O-N 3.42Å; Q95-L98 VanDerWaalsContact NE2-CD2 3.32Å; Q95-L98 WeakPolarHBondContact O-CB 3.27Å; Q95-L98 PolarHBondContact O-N 3.21Å; L98-T100 VanDerWaalsContact C-N 3.32Å; L98-T100 PolarHBondContact O-N 2.8Å; L98-A101 PolarHBondContact O-N 3.05Å; L98-A101 VanDerWaalsContact O-N 3.15Å; L98-Q102 PolarHBondContact O-N 2.96Å; L98-L110 HydrophobicContact CD1-CD2 4.3Å; L98-L110 HydrophobicContact CG-CD2 4.22Å; L98-L110 VanDerWaalsContact O-CD2 3.32Å; L98-L110 WeakPolarHBondContact O-CD2 3.47Å; L98-C113 HydrophobicContact CB-CB 4.14Å; L98-C113 HydrophobicContact CD1-CB 3.47Å; L98-C113 VanDerWaalsContact CD1-CB 3.47Å; L98-C113 HydrophobicContact CG-CB 4.43Å; L98-L117 HydrophobicContact CD1-CD1 4.27Å; L98-L117 HydrophobicContact CD2-CD1 4.35Å
99	D	45.4	Very low	47.3	Very low	74 Å²	74	72.4 Å²	72.4	40%	0.396	38%	0.379	S	S	.	.	H	α-helix	trans	-62.5	-41.1	179.5	-65.2	8.6	0	0	0	110.5	Q95 Q102 C103	Q95-D99 PolarHBondContact NE2-OD1 2.83Å; Q95-D99 PolarHBondContact O-N 2.84Å; D99-Q102 WeakPolarHBondContact O-CB 3.49Å; D99-Q102 PolarHBondContact O-N 2.78Å; D99-C103 WeakPolarHBondContact O-CB 3.46Å; D99-C103 PolarHBondContact O-N 2.9Å; D99-C103 PolarHBondContact O-SG 3.34Å; D99-C103 VanDerWaalsContact O-SG 3.34Å
100	T	43.5	Very low	47.3	Very low	12 Å²	12	70 Å²	70	7%	0.074	37%	0.366	C	S	.	.	H	α-helix	trans	-60	-46.3	172.7	-59.7	0	0	0	0	111.8	F36 V96 L98 Q102 C103 L104	F36-T100 HydrophobicContact CZ-CG2 3.77Å; V96-T100 VanDerWaalsContact O-CB 3.29Å; V96-T100 WeakPolarHBondContact O-CB 3.46Å; V96-T100 PolarHBondContact O-N 2.96Å; V96-T100 PolarHBondContact O-OG1 2.9Å; L98-T100 VanDerWaalsContact C-N 3.32Å; L98-T100 PolarHBondContact O-N 2.8Å; T100-Q102 VanDerWaalsContact C-N 3.26Å; T100-Q102 PolarHBondContact O-N 3.47Å; T100-C103 CarbonylContact O-C 3.55Å; T100-C103 PolarHBondContact O-N 3.1Å; T100-L104 HydrophobicContact CG2-CD1 3.87Å; T100-L104 HydrophobicContact CG2-CG 4.37Å; T100-L104 WeakPolarHBondContact O-CB 3.44Å; T100-L104 WeakPolarHBondContact O-CG 3.16Å; T100-L104 PolarHBondContact O-N 3.33Å
101	A	49.4	Very low	47.2	Very low	4 Å²	4	68.9 Å²	68.9	3%	0.033	36%	0.36	C	S	.	.	H	α-helix	trans	-67.6	-28.2	-179	0	0	0	0	0	112.2	M97 L98 Q105 V106 V109 L110	M97-A101 VanDerWaalsContact O-CB 3.25Å; M97-A101 WeakPolarHBondContact O-CB 3.37Å; M97-A101 PolarHBondContact O-N 3.11Å; L98-A101 PolarHBondContact O-N 3.05Å; L98-A101 VanDerWaalsContact O-N 3.15Å; A101-Q105 CarbonylContact O-C 3.55Å; A101-Q105 WeakPolarHBondContact O-CA 3.25Å; A101-Q105 PolarHBondContact O-N 3.27Å; A101-V106 PolarHBondContact O-N 3.46Å; A101-V109 HydrophobicContact CB-CB 3.9Å; A101-V109 HydrophobicContact CB-CG1 3.78Å; A101-L110 HydrophobicContact CB-CD2 3.91Å; A101-L110 HydrophobicContact CB-CG 3.76Å
102	Q	49.4	Very low	47.4	Very low	100 Å²	100	67.1 Å²	67.1	47%	0.467	35%	0.354	S	S	.	.	H	α-helix	trans	-67.9	-50.6	167.6	-108.8	159.3	49.6	0	0	111	L98 D99 T100 L104 Q105 L110	L98-Q102 PolarHBondContact O-N 2.96Å; D99-Q102 WeakPolarHBondContact O-CB 3.49Å; D99-Q102 PolarHBondContact O-N 2.78Å; T100-Q102 VanDerWaalsContact C-N 3.26Å; T100-Q102 PolarHBondContact O-N 3.47Å; Q102-L104 PolarHBondContact O-N 2.67Å; Q102-L104 VanDerWaalsContact O-N 3.15Å; Q102-Q105 PolarHBondContact O-N 3.03Å; Q102-L110 HydrophobicContact CB-CD2 4.09Å; Q102-L110 HydrophobicContact CG-CD1 4.04Å; Q102-L110 HydrophobicContact CG-CD2 3.68Å; Q102-L110 HydrophobicContact CG-CG 4.5Å
103	C	43.6	Very low	47.7	Very low	75 Å²	75	61.5 Å²	61.5	51%	0.507	32%	0.324	S	S	.	.	H	α-helix	trans	-62.3	-19	177.1	-73.1	0	0	0	0	115	R32 D99 T100	R32-C103 PolarHBondContact NH1-O 2.6Å; D99-C103 WeakPolarHBondContact O-CB 3.46Å; D99-C103 PolarHBondContact O-N 2.9Å; D99-C103 PolarHBondContact O-SG 3.34Å; D99-C103 VanDerWaalsContact O-SG 3.34Å; T100-C103 CarbonylContact O-C 3.55Å; T100-C103 PolarHBondContact O-N 3.1Å
104	L	43.1	Very low	47.9	Very low	28 Å²	28	61.9 Å²	61.9	15%	0.147	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-0	175.1	-62.4	179.2	0	0	0	113.8	V72 T100 Q102 V106	V72-L104 HydrophobicContact CG1-CD2 4.47Å; T100-L104 HydrophobicContact CG2-CD1 3.87Å; T100-L104 HydrophobicContact CG2-CG 4.37Å; T100-L104 WeakPolarHBondContact O-CB 3.44Å; T100-L104 WeakPolarHBondContact O-CG 3.16Å; T100-L104 PolarHBondContact O-N 3.33Å; Q102-L104 PolarHBondContact O-N 2.67Å; Q102-L104 VanDerWaalsContact O-N 3.15Å; L104-V106 HydrophobicContact CB-CG2 3.83Å; L104-V106 WeakPolarHBondContact O-CG2 3.33Å; L104-V106 PolarHBondContact O-N 3.49Å
105	Q	44.7	Very low	47.9	Very low	174 Å²	174	65.7 Å²	65.7	81%	0.813	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	29.3	-177.9	-58	-177	-5.2	0	0	115	A101 Q102 Q107	A101-Q105 CarbonylContact O-C 3.55Å; A101-Q105 WeakPolarHBondContact O-CA 3.25Å; A101-Q105 PolarHBondContact O-N 3.27Å; Q102-Q105 PolarHBondContact O-N 3.03Å; Q105-Q107 PolarHBondContact O-N 2.93Å
106	V	50.7	Low	48.1	Very low	46 Å²	46	67.1 Å²	67.1	28%	0.279	35%	0.352	S	S	.	.			trans	-87.1	80.1	-176.9	-170.8	0	0	0	0	110.4	A101 L104 N108 V109 L110	A101-V106 PolarHBondContact O-N 3.46Å; L104-V106 HydrophobicContact CB-CG2 3.83Å; L104-V106 WeakPolarHBondContact O-CG2 3.33Å; L104-V106 PolarHBondContact O-N 3.49Å; V106-N108 PolarHBondContact O-N 2.83Å; V106-V109 HydrophobicContact CG1-CB 4.34Å; V106-V109 HydrophobicContact CG1-CG2 3.83Å; V106-V109 PolarHBondContact O-N 3.42Å; V106-L110 PolarHBondContact O-N 3.15Å
107	Q	44.4	Very low	48.5	Very low	112 Å²	112	65.9 Å²	65.9	52%	0.523	34%	0.343	S	S	.	.	H	α-helix	trans	-51.6	-32.7	-171.8	-160.8	64.2	45	0	0	114.9	Q105 N111	Q105-Q107 PolarHBondContact O-N 2.93Å; Q107-N111 PolarHBondContact NE2-OD1 3.13Å; Q107-N111 WeakPolarHBondContact O-CB 3.38Å; Q107-N111 PolarHBondContact O-N 3.35Å; Q107-N111 PolarHBondContact O-ND2 3.08Å; Q107-N111 PolarHBondContact O-OD1 2.99Å
108	N	46.2	Very low	48.9	Very low	136 Å²	136	71.2 Å²	71.2	73%	0.727	37%	0.365	S	S	*	.	H	α-helix	trans	-65.4	-40.1	178.8	-66.6	-19.4	0	0	0	112.7	V106 L112	V106-N108 PolarHBondContact O-N 2.83Å; N108-L112 PolarHBondContact O-N 3.33Å
109	V	47.1	Very low	48.7	Very low	53 Å²	53	74.2 Å²	74.2	32%	0.321	39%	0.387	S	S	.	.	H	α-helix	trans	-75.7	-37.7	179.8	179.8	0	0	0	0	110.3	A101 V106 L112 C113	A101-V109 HydrophobicContact CB-CB 3.9Å; A101-V109 HydrophobicContact CB-CG1 3.78Å; V106-V109 HydrophobicContact CG1-CB 4.34Å; V106-V109 HydrophobicContact CG1-CG2 3.83Å; V106-V109 PolarHBondContact O-N 3.42Å; V109-L112 PolarHBondContact O-N 2.59Å; V109-C113 PolarHBondContact O-N 2.83Å; V109-C113 PolarHBondContact O-SG 2.75Å
110	L	48.8	Very low	48.8	Very low	10 Å²	10	72.8 Å²	72.8	5%	0.052	39%	0.386	C	S	.	.	H	α-helix	trans	-56.6	-50.8	171.8	-77.7	170.4	0	0	0	112.2	L98 A101 Q102 V106 L112 C113 H114	L98-L110 HydrophobicContact CD1-CD2 4.3Å; L98-L110 HydrophobicContact CG-CD2 4.22Å; L98-L110 VanDerWaalsContact O-CD2 3.32Å; L98-L110 WeakPolarHBondContact O-CD2 3.47Å; A101-L110 HydrophobicContact CB-CD2 3.91Å; A101-L110 HydrophobicContact CB-CG 3.76Å; Q102-L110 HydrophobicContact CB-CD2 4.09Å; Q102-L110 HydrophobicContact CG-CD1 4.04Å; Q102-L110 HydrophobicContact CG-CD2 3.68Å; Q102-L110 HydrophobicContact CG-CG 4.5Å; V106-L110 PolarHBondContact O-N 3.15Å; L110-L112 PolarHBondContact O-N 2.93Å; L110-C113 PolarHBondContact O-N 3.25Å; L110-H114 WeakPolarHBondContact O-CB 3.2Å; L110-H114 PolarHBondContact O-CD2 3.2Å; L110-H114 PolarHBondContact O-N 3.22Å
111	N	49.2	Very low	48.8	Very low	85 Å²	85	76.7 Å²	76.7	46%	0.455	41%	0.413	S	S	.	.	H	α-helix	trans	-61.3	-32	179.9	-66.8	-13.2	0	0	0	112	Q107 T115	Q107-N111 PolarHBondContact NE2-OD1 3.13Å; Q107-N111 WeakPolarHBondContact O-CB 3.38Å; Q107-N111 PolarHBondContact O-N 3.35Å; Q107-N111 PolarHBondContact O-ND2 3.08Å; Q107-N111 PolarHBondContact O-OD1 2.99Å; N111-T115 WeakPolarHBondContact O-CG2 3.18Å; N111-T115 PolarHBondContact O-N 3.2Å; N111-T115 PolarHBondContact O-OG1 3.34Å
112	L	50.1	Low	48.4	Very low	89 Å²	89	80.6 Å²	80.6	47%	0.466	45%	0.445	S	S	.	.	H	α-helix	trans	-73	-47.4	175.9	-173.1	63.3	0	0	0	112.1	N108 V109 L110 T115 F116	N108-L112 PolarHBondContact O-N 3.33Å; V109-L112 PolarHBondContact O-N 2.59Å; L110-L112 PolarHBondContact O-N 2.93Å; L112-T115 WeakPolarHBondContact CA-OG1 3.16Å; L112-T115 PolarHBondContact O-N 3.15Å; L112-T115 PolarHBondContact O-OG1 3.1Å; L112-F116 PolarHBondContact O-N 3.39Å
113	C	49.4	Very low	47.9	Very low	5 Å²	5	80.1 Å²	80.1	3%	0.034	46%	0.458	C	S	.	.	H	α-helix	trans	-67	-40.5	179.5	-63.5	0	0	0	0	111.7	I94 L98 V109 L110 T115 F116 L117	I94-C113 HydrophobicContact CG2-CB 4.3Å; L98-C113 HydrophobicContact CB-CB 4.14Å; L98-C113 HydrophobicContact CD1-CB 3.47Å; L98-C113 VanDerWaalsContact CD1-CB 3.47Å; L98-C113 HydrophobicContact CG-CB 4.43Å; V109-C113 PolarHBondContact O-N 2.83Å; V109-C113 PolarHBondContact O-SG 2.75Å; L110-C113 PolarHBondContact O-N 3.25Å; C113-T115 VanDerWaalsContact C-N 3.33Å; C113-T115 PolarHBondContact O-N 3.03Å; C113-F116 PolarHBondContact O-N 3.23Å; C113-L117 WeakPolarHBondContact O-CG 3.4Å; C113-L117 PolarHBondContact O-N 3.08Å
114	H	55.1	Low	47.5	Very low	87 Å²	87	84.8 Å²	84.8	40%	0.403	47%	0.473	S	S	.	.	H	α-helix	trans	-62.8	-35.1	172.7	-77.1	-61.8	0	0	0	113.1	L110 K118	L110-H114 WeakPolarHBondContact O-CB 3.2Å; L110-H114 PolarHBondContact O-CD2 3.2Å; L110-H114 PolarHBondContact O-N 3.22Å; H114-K118 WeakPolarHBondContact O-CB 3.43Å; H114-K118 PolarHBondContact O-N 3.11Å; H114-K118 VanDerWaalsContact O-N 3.09Å
115	T	53.8	Low	46.8	Very low	88 Å²	88	91.8 Å²	91.8	54%	0.54	51%	0.507	S	S	.	.	H	α-helix	trans	-74.1	-31.7	176	42.5	0	0	0	0	112.5	N111 L112 C113 S119	N111-T115 WeakPolarHBondContact O-CG2 3.18Å; N111-T115 PolarHBondContact O-N 3.2Å; N111-T115 PolarHBondContact O-OG1 3.34Å; L112-T115 WeakPolarHBondContact CA-OG1 3.16Å; L112-T115 PolarHBondContact O-N 3.15Å; L112-T115 PolarHBondContact O-OG1 3.1Å; C113-T115 VanDerWaalsContact C-N 3.33Å; C113-T115 PolarHBondContact O-N 3.03Å; T115-S119 PolarHBondContact O-N 3.06Å; T115-S119 VanDerWaalsContact O-N 3.14Å
116	F	50.9	Low	46.8	Very low	107 Å²	107	89 Å²	89	47%	0.469	50%	0.504	S	S	.	.	H	α-helix	trans	-66.6	-51.8	172.4	-159.4	-84.5	0	0	0	111.8	I94 L112 C113 K118 S119 A120	I94-F116 HydrophobicContact CD1-CD1 3.51Å; I94-F116 HydrophobicContact CD1-CE1 3.44Å; I94-F116 VanDerWaalsContact CD1-CE1 3.44Å; I94-F116 HydrophobicContact CD1-CG 4.19Å; I94-F116 HydrophobicContact CD1-CZ 4.08Å; L112-F116 PolarHBondContact O-N 3.39Å; C113-F116 PolarHBondContact O-N 3.23Å; F116-K118 VanDerWaalsContact C-N 3.27Å; F116-K118 PolarHBondContact O-N 3.2Å; F116-S119 WeakPolarHBondContact O-CA 3.27Å; F116-S119 WeakPolarHBondContact O-CB 3.33Å; F116-S119 PolarHBondContact O-N 3.16Å; F116-S119 PolarHBondContact O-OG 3.17Å; F116-A120 PolarHBondContact O-N 2.89Å; F116-A120 VanDerWaalsContact O-N 3.12Å
117	L	56.1	Low	45.6	Very low	40 Å²	40	90.5 Å²	90.5	21%	0.209	53%	0.528	C	S	.	.	H	α-helix	trans	-57.5	-39.6	176.8	-69.3	170.8	0	0	0	112.2	I94 L98 C113 S119 A120 S121	I94-L117 HydrophobicContact CG2-CG 4.46Å; L98-L117 HydrophobicContact CD1-CD1 4.27Å; L98-L117 HydrophobicContact CD2-CD1 4.35Å; C113-L117 WeakPolarHBondContact O-CG 3.4Å; C113-L117 PolarHBondContact O-N 3.08Å; L117-S119 VanDerWaalsContact C-N 3.26Å; L117-S119 PolarHBondContact O-N 2.99Å; L117-A120 PolarHBondContact O-N 2.93Å; L117-S121 PolarHBondContact O-N 3.05Å; L117-S121 VanDerWaalsContact O-N 3.13Å; L117-S121 PolarHBondContact O-OG 3.34Å
118	K	54	Low	45.1	Very low	160 Å²	160	93.1 Å²	93.1	70%	0.696	55%	0.545	S	S	*	.	H	α-helix	trans	-69.7	-18.7	175.5	-171.4	166.9	-176.8	171	0	114.1	H114 F116	H114-K118 WeakPolarHBondContact O-CB 3.43Å; H114-K118 PolarHBondContact O-N 3.11Å; H114-K118 VanDerWaalsContact O-N 3.09Å; F116-K118 VanDerWaalsContact C-N 3.27Å; F116-K118 PolarHBondContact O-N 3.2Å
119	S	48.3	Very low	45.1	Very low	74 Å²	74	92 Å²	92	52%	0.517	55%	0.545	S	S	.	.	H	α-helix	trans	-83.8	-30.6	171.2	73.7	0	0	0	0	112.7	T115 F116 L117	T115-S119 PolarHBondContact O-N 3.06Å; T115-S119 VanDerWaalsContact O-N 3.14Å; F116-S119 WeakPolarHBondContact O-CA 3.27Å; F116-S119 WeakPolarHBondContact O-CB 3.33Å; F116-S119 PolarHBondContact O-N 3.16Å; F116-S119 PolarHBondContact O-OG 3.17Å; L117-S119 VanDerWaalsContact C-N 3.26Å; L117-S119 PolarHBondContact O-N 2.99Å
120	A	47.3	Very low	44.1	Very low	44 Å²	44	95 Å²	95	36%	0.364	57%	0.567	S	S	.	*	H	α-helix	trans	-71.8	-41.5	175.3	0	0	0	0	0	112.5	F116 L117 A122	F116-A120 PolarHBondContact O-N 2.89Å; F116-A120 VanDerWaalsContact O-N 3.12Å; L117-A120 PolarHBondContact O-N 2.93Å; A120-A122 VanDerWaalsContact C-N 3.25Å; A120-A122 PolarHBondContact O-N 3.4Å
121	S	42.3	Very low	43	Very low	94 Å²	94	99.3 Å²	99.3	66%	0.657	61%	0.605	S	S	*	*	G	3₁₀ helix	trans	-73.6	-9.9	-178.3	61.4	0	0	0	0	115.1	L117 A123	L117-S121 PolarHBondContact O-N 3.05Å; L117-S121 VanDerWaalsContact O-N 3.13Å; L117-S121 PolarHBondContact O-OG 3.34Å; S121-A123 VanDerWaalsContact C-N 3.31Å; S121-A123 PolarHBondContact O-N 3.41Å
122	A	42.8	Very low	41.9	Very low	85 Å²	85	98.6 Å²	98.6	70%	0.702	62%	0.617	S	S	*	*	G	3₁₀ helix	trans	-83.7	-1	179.6	0	0	0	0	0	114.2	A120	A120-A122 VanDerWaalsContact C-N 3.25Å; A120-A122 PolarHBondContact O-N 3.4Å
123	A	37.6	Very low	40.7	Very low	90 Å²	90	100.1 Å²	100.1	74%	0.744	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-98.4	10.2	-168.6	0	0	0	0	0	115.4	S121	S121-A123 VanDerWaalsContact C-N 3.31Å; S121-A123 PolarHBondContact O-N 3.41Å
124	Q	34.9	Very low	39.5	Very low	174 Å²	174	109.4 Å²	109.4	81%	0.813	67%	0.67	S	S	*	*			trans	-149	114.7	-168.4	-171.9	175.3	99.4	0	0	113.8
125	M	29.8	Very low	37.9	Very low	174 Å²	174	109.1 Å²	109.1	86%	0.857	68%	0.678	S	S	*	*			trans	-176.2	157.6	154.7	-87.4	-41.8	-104.4	0	0	108.6
126	P	43.3	Very low	36.5	Very low	116 Å²	116	111.7 Å²	111.7	75%	0.753	69%	0.688	S	S	*	*			cis	-124.7	158	-20.4	38.4	-24.6	0	0	0	113.5
127	G	26.3	Very low	35.4	Very low	77 Å²	77	114.4 Å²	114.4	79%	0.794	70%	0.702	S	S	*	*			trans	178.5	126.5	170.6	0	0	0	0	0	114.4
128	L	34.3	Very low	33.9	Very low	168 Å²	168	116.4 Å²	116.4	88%	0.88	72%	0.72	S	S	*	*			trans	-148.1	168	179.6	-87.6	170.5	0	0	0	108.2
129	P	46.6	Very low	32.4	Very low	112 Å²	112	115.8 Å²	115.8	73%	0.727	73%	0.729	S	S	*	*			cis	-115.3	-159.4	-3.9	36	-15.8	0	0	0	110.5
130	C	26.1	Very low	31.3	Very low	115 Å²	115	117.3 Å²	117.3	78%	0.777	74%	0.735	S	S	*	*			cis	-165.8	152	21.9	-152.8	0	0	0	0	114.8
131	A	24.7	Very low	30.3	Very low	102 Å²	102	123.5 Å²	123.5	84%	0.843	76%	0.761	S	S	*	*			trans	49.5	131	149.3	0	0	0	0	0	122.6
132	G	25.5	Very low	29.6	Very low	69 Å²	69	126.1 Å²	126.1	71%	0.711	77%	0.768	S	S	*	*			trans	-173.2	21.6	177.8	0	0	0	0	0	119.3
133	T	25	Very low	28.8	Very low	122 Å²	122	125.5 Å²	125.5	75%	0.748	77%	0.769	S	S	*	*			trans	51.4	121.3	156.2	56.6	0	0	0	0	123.9
134	F	24	Very low	28.4	Very low	199 Å²	199	126.7 Å²	126.7	87%	0.873	77%	0.772	S	S	*	*			trans	61.3	146.1	135.3	-76.2	-106.7	0	0	0	120.3
135	S	23.2	Very low	27.9	Very low	81 Å²	81	124.1 Å²	124.1	57%	0.566	77%	0.772	S	S	*	*			cis	-166.2	171.4	-7.7	-130.8	0	0	0	0	112.7
136	L	24.5	Very low	27.7	Very low	142 Å²	142	120.3 Å²	120.3	74%	0.743	77%	0.769	S	S	*	*			trans	36.6	144.8	141.2	-61.8	167.6	0	0	0	121.2
137	Q	26	Very low	26.9	Very low	164 Å²	164	121.9 Å²	121.9	77%	0.766	78%	0.776	S	S	*	*			cis	-159.5	175.8	-0.3	-141.1	166.3	-14.4	0	0	112.7
138	S	24.5	Very low	26.7	Very low	83 Å²	83	123.3 Å²	123.3	58%	0.58	77%	0.774	S	S	*	*			trans	-46.2	157.3	173.6	53.3	0	0	0	0	119.4
139	V	24	Very low	26.3	Very low	147 Å²	147	123.3 Å²	123.3	89%	0.891	77%	0.769	S	S	*	*			trans	-126.4	129.5	133.7	179.3	0	0	0	0	109.1
140	T	25.5	Very low	25.2	Very low	105 Å²	105	124.9 Å²	124.9	64%	0.644	77%	0.766	S	S	*	*			trans	-119	164.8	165.3	46.2	0	0	0	0	109
141	L	26.1	Very low	25	Very low	175 Å²	175	128.9 Å²	128.9	92%	0.916	77%	0.767	S	S	*	*			trans	-138.4	138.8	164.1	-155.2	76.7	0	0	0	109.7
142	D	26.2	Very low	25.5	Very low	149 Å²	149	129.3 Å²	129.3	80%	0.797	76%	0.761	S	S	*	*			trans	-105.1	166.5	-159	-70	-73.1	0	0	0	115.5
143	G	27.1	Very low	26.7	Very low	71 Å²	71	131 Å²	131	73%	0.732	76%	0.759	S	S	*	*			trans	153.8	134.6	136.7	0	0	0	0	0	115.4
144	S	29	Very low	26.6	Very low	115 Å²	115	134.2 Å²	134.2	80%	0.804	77%	0.765	S	S	*	*			cis	-165.8	-179.3	-13	56	0	0	0	0	110.6
145	C	24.2	Very low	26.8	Very low	120 Å²	120	129.3 Å²	129.3	81%	0.811	76%	0.756	S	S	*	*			trans	85.4	108.5	-174.7	-58.6	0	0	0	0	114.2
146	A	25.5	Very low	26.8	Very low	95 Å²	95	132.9 Å²	132.9	79%	0.785	77%	0.768	S	S	*	*			cis	68.3	135.3	46.6	0	0	0	0	0	112.7
147	V	26.3	Very low	26.9	Very low	148 Å²	148	133.1 Å²	133.1	90%	0.897	77%	0.765	S	S	*	*			cis	-125.3	166.8	23	172.3	0	0	0	0	112.2
148	S	22.7	Very low	26.7	Very low	108 Å²	108	132.1 Å²	132.1	76%	0.755	76%	0.76	S	S	*	*			trans	-133.4	-173.3	-172.1	-165.9	0	0	0	0	113.5
149	E	26.1	Very low	26.7	Very low	168 Å²	168	132.9 Å²	132.9	79%	0.785	76%	0.764	S	S	*	*			trans	84.9	139.6	165.8	-75.6	-170.3	-106.9	0	0	119.4
150	H	23.4	Very low	27.8	Very low	144 Å²	144	131.1 Å²	131.1	67%	0.667	76%	0.756	S	S	*	*			cis	-147.5	-88	-13.5	-157.1	-26.8	0	0	0	116.2
151	Y	21.4	Very low	27.8	Very low	200 Å²	200	132 Å²	132	78%	0.784	76%	0.761	S	S	*	*			trans	-155.6	175.9	-151.6	-112.1	-141.6	0	0	0	111
152	P	35.4	Very low	27.9	Very low	110 Å²	110	132.8 Å²	132.8	71%	0.714	76%	0.76	S	S	*	*			cis	-136.3	-126.5	-33.8	43.4	-22.2	0	0	0	112.8
153	P	50.2	Low	27.9	Very low	105 Å²	105	128.9 Å²	128.9	68%	0.682	76%	0.755	S	S	*	*			trans	-117.7	180	-152.4	43.7	-24.9	0	0	0	116.2
154	H	24.3	Very low	27.8	Very low	189 Å²	189	130.5 Å²	130.5	88%	0.875	76%	0.755	S	S	*	*			trans	-164.4	-174	143.6	-110.3	-61.6	0	0	0	113.5
155	S	26.4	Very low	27.7	Very low	97 Å²	97	134.1 Å²	134.1	68%	0.678	76%	0.759	S	S	*	*			trans	-144.8	165.5	-144.8	54.5	0	0	0	0	116.1
156	L	24.8	Very low	27.7	Very low	156 Å²	156	132.6 Å²	132.6	82%	0.817	76%	0.755	S	S	*	*			trans	-152.4	163.3	170.9	-73	-178.5	0	0	0	108
157	Q	25.2	Very low	27.6	Very low	146 Å²	146	137.9 Å²	137.9	68%	0.682	76%	0.76	S	S	*	*			cis	179	137.7	-16.8	177	166.6	35.7	0	0	106.4
158	E	22.6	Very low	27.3	Very low	143 Å²	143	136.8 Å²	136.8	67%	0.668	75%	0.753	S	S	*	*			cis	-162.4	164	-7.7	-123.5	-177.2	-88.1	0	0	111.5
159	C	23.6	Very low	28.1	Very low	99 Å²	99	137 Å²	137	67%	0.669	75%	0.752	S	S	*	*			trans	50.6	157.4	139.8	-72.8	0	0	0	0	125.2
160	P	48.4	Very low	28	Very low	110 Å²	110	133.2 Å²	133.2	71%	0.714	75%	0.75	S	S	*	*			cis	-144	-173.5	-42	37.6	-17.9	0	0	0	115.9
161	V	25.9	Very low	27.9	Very low	123 Å²	123	134.3 Å²	134.3	75%	0.745	76%	0.755	S	S	*	*			trans	110.3	109.4	156.7	-171.3	0	0	0	0	118.4
162	E	27.5	Very low	28	Very low	193 Å²	193	131.9 Å²	131.9	90%	0.902	76%	0.755	S	S	*	*			trans	27.5	144.4	144.7	-55	-178.6	170.2	0	0	123.1
163	G	26	Very low	27.4	Very low	67 Å²	67	131.9 Å²	131.9	69%	0.691	76%	0.757	S	S	*	*			cis	174	169.9	-2.9	0	0	0	0	0	116.8
164	S	24.8	Very low	27.2	Very low	104 Å²	104	131.4 Å²	131.4	73%	0.727	75%	0.754	S	S	*	*			trans	57.6	115	158.3	60.1	0	0	0	0	123.8
165	H	26.5	Very low	27.1	Very low	192 Å²	192	131.2 Å²	131.2	89%	0.889	75%	0.753	S	S	*	*			trans	63.5	161.5	141.6	-57.7	-51.6	0	0	0	121.3
166	A	24.1	Very low	27.1	Very low	87 Å²	87	130.9 Å²	130.9	72%	0.719	76%	0.756	S	S	*	*			cis	-172.7	163.7	-36.6	0	0	0	0	0	111.5
167	K	24	Very low	27.7	Very low	207 Å²	207	128.9 Å²	128.9	90%	0.9	75%	0.753	S	S	*	*			trans	91.7	160.9	151.6	-134.3	179.2	179.4	179.8	0	120.2
168	V	21	Very low	27.9	Very low	125 Å²	125	127.3 Å²	127.3	76%	0.758	76%	0.758	S	S	*	*			trans	-130	162.1	-166	159.2	0	0	0	0	106.4
169	P	39.3	Very low	28.1	Very low	113 Å²	113	125.3 Å²	125.3	73%	0.734	77%	0.766	S	S	*	*			cis	-132.7	-170.8	1.4	38.7	-19.2	0	0	0	116
170	A	23.1	Very low	28.1	Very low	88 Å²	88	123.6 Å²	123.6	73%	0.727	77%	0.765	S	S	*	*			trans	85.8	146.6	131.6	0	0	0	0	0	124.3
171	E	21.3	Very low	26.9	Very low	167 Å²	167	128.5 Å²	128.5	78%	0.78	78%	0.776	S	S	*	*			trans	76.3	132.9	151.4	-80.5	-156.6	122.5	0	0	124.5
172	L	22.8	Very low	26.8	Very low	149 Å²	149	127.9 Å²	127.9	78%	0.78	78%	0.777	S	S	*	*			trans	69.2	121.6	145.8	-64.4	166.9	0	0	0	122
173	S	24.2	Very low	26.8	Very low	109 Å²	109	129.6 Å²	129.6	76%	0.762	78%	0.775	S	S	*	*			trans	-70	173.9	152.5	-142.4	0	0	0	0	109.9
174	P	44.4	Very low	27.4	Very low	95 Å²	95	131.8 Å²	131.8	62%	0.617	78%	0.777	S	S	*	*			cis	-144.8	-165.1	14.6	30.3	-3.1	0	0	0	116.8
175	H	23.3	Very low	27.4	Very low	185 Å²	185	130.7 Å²	130.7	86%	0.856	77%	0.774	S	S	*	*			trans	102.7	147.5	161.8	-62.2	-71.8	0	0	0	119.7
176	A	27.2	Very low	27.4	Very low	90 Å²	90	129.4 Å²	129.4	74%	0.744	77%	0.769	S	S	*	*			trans	-103.3	-174.7	-180	0	0	0	0	0	110.9
177	P	37.3	Very low	27.5	Very low	115 Å²	115	133.4 Å²	133.4	75%	0.747	77%	0.773	S	S	*	*				-161.3	175.3	82.9	44.1	-23.7	0	0	0	119.2
178	S	27.9	Very low	27.6	Very low	112 Å²	112	128.9 Å²	128.9	78%	0.783	76%	0.762	S	S	*	*			trans	61.7	129.4	138.9	-67.4	0	0	0	0	126.4
179	A	27.7	Very low	27.8	Very low	101 Å²	101	128.7 Å²	128.7	84%	0.835	77%	0.766	S	S	*	*			trans	66.7	154.3	137.3	0	0	0	0	0	121.1
180	G	24.5	Very low	27.2	Very low	64 Å²	64	132.9 Å²	132.9	66%	0.66	77%	0.773	S	S	*	*			cis	166.5	-176.1	-7.5	0	0	0	0	0	114.5
181	F	22.3	Very low	27.9	Very low	213 Å²	213	135 Å²	135	93%	0.934	78%	0.779	S	S	*	*			trans	75.3	168.6	167.1	-67.3	-77.7	0	0	0	121.1
182	S	24.6	Very low	28.1	Very low	109 Å²	109	131.2 Å²	131.2	76%	0.762	78%	0.777	S	S	*	*			trans	-167.1	167.8	-152.8	55.9	0	0	0	0	115.6
183	R	26.6	Very low	28.4	Very low	229 Å²	229	132.3 Å²	132.3	86%	0.864	78%	0.782	S	S	*	*			trans	69.5	168.9	169.5	-100.2	-175.1	165.7	-178.6	-6.3	117
184	P	39.2	Very low	28.4	Very low	113 Å²	113	134.2 Å²	134.2	73%	0.734	78%	0.784	S	S	*	*			cis	-88.8	-146.3	8.7	28.6	-13.6	0	0	0	113.6
185	A	25	Very low	27.5	Very low	82 Å²	82	134.1 Å²	134.1	68%	0.678	79%	0.791	S	S	*	*			cis	-159.8	-174	10	0	0	0	0	0	114.5
186	E	24.9	Very low	27.8	Very low	165 Å²	165	132.5 Å²	132.5	77%	0.771	79%	0.794	S	S	*	*			trans	-93.1	-164.1	-171.6	-68.2	80	-167.5	0	0	114.4
187	E	26.3	Very low	27.6	Very low	171 Å²	171	132 Å²	132	80%	0.799	80%	0.798	S	S	*	*			cis	-154.8	-132.6	18.6	-156.2	-130.1	46.6	0	0	115.7
188	V	27.7	Very low	27	Very low	112 Å²	112	130.3 Å²	130.3	68%	0.679	80%	0.801	S	S	*	*			trans	-118.7	150.3	-158	164.1	0	0	0	0	116.2
189	S	23.8	Very low	26.8	Very low	121 Å²	121	130.7 Å²	130.7	85%	0.846	80%	0.804	S	S	*	*			trans	-179.2	160	139.9	-87.7	0	0	0	0	118
190	K	26.8	Very low	26.7	Very low	201 Å²	201	131.4 Å²	131.4	87%	0.874	80%	0.801	S	S	*	*			trans	-148.7	160.6	172.3	-108.8	-177	-179.5	-179.7	0	107.7
191	P	37.9	Very low	27.1	Very low	131 Å²	131	134 Å²	134	85%	0.851	81%	0.807	S	S	*	*				-147.3	-137.5	54.7	41	-17.5	0	0	0	114.6
192	A	25.6	Very low	27.2	Very low	89 Å²	89	132.9 Å²	132.9	74%	0.736	80%	0.804	S	S	*	*			trans	-147.8	168.3	-166.3	0	0	0	0	0	114.6
193	L	28.3	Very low	27.8	Very low	172 Å²	172	132.3 Å²	132.3	90%	0.901	80%	0.798	S	S	*	*			trans	-166.4	175.8	142	-131.8	86.8	0	0	0	113.3
194	D	24.9	Very low	27.8	Very low	148 Å²	148	127.7 Å²	127.7	79%	0.791	80%	0.798	S	S	*	*			trans	-94.1	163.6	-163.7	-49.8	-96	0	0	0	117.9
195	A	25.9	Very low	27.1	Very low	94 Å²	94	128.2 Å²	128.2	78%	0.777	80%	0.802	S	S	*	*				-176.6	119.8	129.4	0	0	0	0	0	116.1
196	V	28.6	Very low	27.2	Very low	151 Å²	151	133.9 Å²	133.9	92%	0.915	81%	0.812	S	S	*	*			trans	44.5	119.4	138.8	-172.7	0	0	0	0	122.3
197	G	24.4	Very low	27.2	Very low	79 Å²	79	134.3 Å²	134.3	81%	0.814	81%	0.814	S	S	*	*				126.1	117.7	121.3	0	0	0	0	0	121
198	G	24.6	Very low	27.3	Very low	79 Å²	79	131.8 Å²	131.8	81%	0.814	81%	0.812	S	S	*	*			trans	122.4	88.3	139.2	0	0	0	0	0	121.4
199	S	23.4	Very low	27.2	Very low	121 Å²	121	134 Å²	134	85%	0.846	82%	0.821	S	S	*	*			trans	72.4	152.8	149.4	-150.6	0	0	0	0	121.2
200	C	26.2	Very low	27.4	Very low	116 Å²	116	135.8 Å²	135.8	78%	0.784	81%	0.81	S	S	*	*			trans	-147.2	156.3	176.4	-68.2	0	0	0	0	108.3
201	P	31.5	Very low	27.5	Very low	119 Å²	119	135.9 Å²	135.9	77%	0.773	81%	0.806	S	S	*	*				-151.9	141	86.5	37.3	-18.3	0	0	0	117.7
202	E	25.4	Very low	27	Very low	188 Å²	188	139 Å²	139	88%	0.879	80%	0.802	S	S	*	*			trans	47.8	156.4	140.6	-76.2	-107.7	94.6	0	0	123.7
203	P	36.7	Very low	27.2	Very low	98 Å²	98	141.5 Å²	141.5	64%	0.636	80%	0.796	S	S	*	*			trans	-110	166.7	-153.7	41.6	-37.2	0	0	0	117
204	P	27.1	Very low	27.1	Very low	131 Å²	131	140 Å²	140	85%	0.851	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-89.5	123.6	165.1	33.7	-30.4	0	0	0	112.6
205	C	24.3	Very low	27.2	Very low	124 Å²	124	142.9 Å²	142.9	84%	0.838	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-85.7	167.5	176.7	-163.1	0	0	0	0	113.4
206	K	27.8	Very low	27.3	Very low	201 Å²	201	142.4 Å²	142.4	87%	0.874	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-66.8	137.4	-167.2	-59.3	173.1	-177.1	175.9	0	113.5
207	Q	25.2	Very low	27.3	Very low	175 Å²	175	141 Å²	141	82%	0.818	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-86.3	135.1	178.4	-65.9	-169.3	13.4	0	0	113.9
208	P	27.2	Very low	27.5	Very low	118 Å²	118	146.7 Å²	146.7	77%	0.766	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-79	150	164	-15.6	31.9	0	0	0	113.4
209	N	26.1	Very low	27.8	Very low	159 Å²	159	146.7 Å²	146.7	85%	0.85	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-77.3	149.1	-161.9	-135.6	-41.6	0	0	0	116.1	Y211	N209-Y211 PolarHBondContact O-N 3.05Å
210	Y	28.1	Very low	28.1	Very low	157 Å²	157	149 Å²	149	62%	0.616	74%	0.743	S	S	*	*			trans	-99.2	58.5	-153.5	-135	-93.2	0	0	0	115.3	K213	Y210-K213 HydrophobicContact CE1-CD 3.94Å; Y210-K213 PolarHBondContact OH-NZ 2.79Å
211	Y	27.6	Very low	28.2	Very low	203 Å²	203	151 Å²	151	80%	0.796	74%	0.741	S	S	*	*			trans	-115.6	45.6	-166.2	-111	-82.5	0	0	0	117.9	N209	N209-Y211 PolarHBondContact O-N 3.05Å
212	Y	29	Very low	28.2	Very low	197 Å²	197	155.2 Å²	155.2	77%	0.773	74%	0.743	S	S	*	*			trans	-135.3	-10	176.1	-102.4	-82	0	0	0	118.6
213	K	28.8	Very low	28.5	Very low	141 Å²	141	156.9 Å²	156.9	61%	0.613	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-71.3	-32.7	-173.1	-72.8	-174.6	179.1	174.7	0	114.7	Y210 R215 T216	Y210-K213 HydrophobicContact CE1-CD 3.94Å; Y210-K213 PolarHBondContact OH-NZ 2.79Å; K213-R215 VanDerWaalsContact C-N 3.29Å; K213-R215 PolarHBondContact O-N 2.87Å; K213-T216 PolarHBondContact O-N 3.44Å; K213-T216 PolarHBondContact O-OG1 3.2Å
214	L	26.2	Very low	28.1	Very low	142 Å²	142	161.4 Å²	161.4	74%	0.743	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-62	-27.2	-174.6	-77.7	167.2	0	0	0	114.9	T216	L214-T216 PolarHBondContact O-N 2.83Å
215	R	27.3	Very low	28.1	Very low	207 Å²	207	164 Å²	164	78%	0.781	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-71.7	-11.2	-179	-160.8	169.3	-173.4	158.8	4.1	113.9	K213	K213-R215 VanDerWaalsContact C-N 3.29Å; K213-R215 PolarHBondContact O-N 2.87Å
216	T	28.3	Very low	28.2	Very low	84 Å²	84	165.4 Å²	165.4	52%	0.515	76%	0.758	S	S	.	*	G	3₁₀ helix	trans	-90.2	-17	-171.5	-18.2	0	0	0	0	114.1	K213 L214 S219	K213-T216 PolarHBondContact O-N 3.44Å; K213-T216 PolarHBondContact O-OG1 3.2Å; L214-T216 PolarHBondContact O-N 2.83Å; T216-S219 PolarHBondContact O-OG 2.63Å
217	L	28.5	Very low	28.2	Very low	121 Å²	121	160.4 Å²	160.4	63%	0.634	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-50.1	-176.7	-63.9	175.2	0	0	0	111.6	S219 K220	L217-S219 PolarHBondContact O-N 3.09Å; L217-K220 PolarHBondContact O-N 3.28Å
218	Y	28.5	Very low	28.4	Very low	199 Å²	199	158.1 Å²	158.1	78%	0.78	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	-15	179	-91.6	-79.3	0	0	0	115.1
219	S	30.7	Very low	28.5	Very low	79 Å²	79	158.5 Å²	158.5	55%	0.552	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-7.4	173.8	52.6	0	0	0	0	115	T216 L217	T216-S219 PolarHBondContact O-OG 2.63Å; L217-S219 PolarHBondContact O-N 3.09Å
220	K	30.1	Very low	28.7	Very low	170 Å²	170	156.3 Å²	156.3	74%	0.739	76%	0.756	S	S	*	*	S	Bend	trans	-91.8	-18.5	-177.9	-83.5	-169.3	170.9	-172.7	0	115	L217	L217-K220 PolarHBondContact O-N 3.28Å
221	Q	28.2	Very low	28.7	Very low	157 Å²	157	160.3 Å²	160.3	73%	0.734	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-16.8	-177.5	-76.2	177.4	-33.9	0	0	114.5
222	Y	31.3	Very low	28.7	Very low	209 Å²	209	156.6 Å²	156.6	82%	0.82	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.6	21.3	-175.2	-91.9	-77.9	0	0	0	115.3
223	Y	31.5	Very low	28.7	Very low	223 Å²	223	152.8 Å²	152.8	88%	0.875	77%	0.768	S	S	*	*			trans	-141.6	87.3	167.6	-103.3	-81.7	0	0	0	110.7
224	K	27.3	Very low	28.5	Very low	193 Å²	193	151 Å²	151	84%	0.839	78%	0.779	S	S	*	*			trans	-125	152.3	158.8	-84.9	-170.8	173	-175.7	0	108.5
225	Q	28.5	Very low	28.5	Very low	186 Å²	186	150.1 Å²	150.1	87%	0.869	78%	0.78	S	S	*	*			trans	60	90.1	173.1	-63.6	174.9	-7.4	0	0	116.5
226	T	25.7	Very low	28.4	Very low	153 Å²	153	149.1 Å²	149.1	94%	0.939	78%	0.784	S	S	*	*				-144.5	114	106.2	27.4	0	0	0	0	107.6
227	A	28.8	Very low	28.4	Very low	95 Å²	95	153.8 Å²	153.8	79%	0.785	80%	0.8	S	S	*	*			trans	-128.9	122.6	173.4	0	0	0	0	0	107.1
228	C	28.4	Very low	28.8	Very low	127 Å²	127	153.3 Å²	153.3	86%	0.858	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-74.6	129.4	178.9	-59.7	0	0	0	0	109.4	S230	C228-S230 PolarHBondContact O-N 2.9Å
229	P	30.6	Very low	28.6	Very low	127 Å²	127	151.3 Å²	151.3	83%	0.825	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-70.3	129.3	174.4	28.8	-33.2	0	0	0	110.1
230	S	29.5	Very low	28.3	Very low	113 Å²	113	153.4 Å²	153.4	79%	0.79	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-81	118.6	170.7	-168.9	0	0	0	0	109.1	C228	C228-S230 PolarHBondContact O-N 2.9Å
231	R	28.6	Very low	27.9	Very low	241 Å²	241	152.1 Å²	152.1	91%	0.909	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-74.2	134.7	166.3	-78.7	-173	170.5	-168.1	-3.4	109.4
232	V	25.9	Very low	27.8	Very low	125 Å²	125	147.7 Å²	147.7	76%	0.758	82%	0.818	S	S	*	*			trans	-106	135.1	162.4	-180	0	0	0	0	106.2
233	P	30.2	Very low	27.5	Very low	117 Å²	117	142.5 Å²	142.5	76%	0.76	82%	0.818	S	S	*	*			trans	-77.3	142.4	176.4	32	-33.8	0	0	0	110.9
234	A	23.7	Very low	27.4	Very low	103 Å²	103	137.1 Å²	137.1	85%	0.851	81%	0.813	S	S	*	*			trans	-141.9	134.6	163.6	0	0	0	0	0	107.2
235	T	26.4	Very low	27.5	Very low	124 Å²	124	134.2 Å²	134.2	76%	0.761	81%	0.812	S	S	*	*			trans	-127.9	145.6	-173.3	-30.3	0	0	0	0	109.2
236	E	26.3	Very low	27.3	Very low	186 Å²	186	132.3 Å²	132.3	87%	0.869	81%	0.808	S	S	*	*			trans	73.3	122.5	166.3	-44.9	-155	141.1	0	0	118.4
237	Q	28.6	Very low	27.5	Very low	182 Å²	182	132.3 Å²	132.3	85%	0.85	80%	0.801	S	S	*	*			trans	-94.3	165.7	146.9	-58.7	-177.2	-22.9	0	0	107.6
238	P	35.8	Very low	27.3	Very low	110 Å²	110	132 Å²	132	71%	0.714	80%	0.798	S	S	*	*				-150.1	152.4	91.1	34.9	-16.8	0	0	0	116.8
239	L	24.9	Very low	27.3	Very low	157 Å²	157	131.9 Å²	131.9	82%	0.822	79%	0.793	S	S	*	*			trans	50.3	131.4	143.9	-55.5	167	0	0	0	119.2
240	T	23.1	Very low	27.2	Very low	124 Å²	124	130.2 Å²	130.2	76%	0.761	79%	0.79	S	S	*	*				-171.3	166.8	65	37.3	0	0	0	0	113.5
241	V	23.6	Very low	27.1	Very low	143 Å²	143	132 Å²	132	87%	0.867	79%	0.791	S	S	*	*			trans	15.1	139.7	146.6	-170.9	0	0	0	0	119.8
242	G	24.2	Very low	27	Very low	64 Å²	64	125.7 Å²	125.7	66%	0.66	78%	0.784	S	S	*	*			cis	143.1	162.4	-0.5	0	0	0	0	0	113.7
243	A	26.1	Very low	27.1	Very low	100 Å²	100	127.5 Å²	127.5	83%	0.826	78%	0.784	S	S	*	*			trans	67.2	165	171.9	0	0	0	0	0	118.6
244	S	29.8	Very low	27.5	Very low	110 Å²	110	127.8 Å²	127.8	77%	0.769	79%	0.786	S	S	*	*			cis	-177.1	140.8	-37.1	-85.9	0	0	0	0	110.4
245	T	28.9	Very low	27.7	Very low	132 Å²	132	126.2 Å²	126.2	81%	0.81	77%	0.769	S	S	*	*			trans	-179.4	157.6	147	26.4	0	0	0	0	108.8
246	D	24.7	Very low	27.8	Very low	145 Å²	145	127.2 Å²	127.2	78%	0.775	77%	0.774	S	S	*	*			cis	-143.7	-177.6	7.3	-128.9	-41.2	0	0	0	113.3
247	I	30.4	Very low	27.8	Very low	154 Å²	154	125.2 Å²	125.2	79%	0.79	77%	0.765	S	S	*	*			trans	-116.9	162	-164.7	-63.9	169.5	0	0	0	113.4
248	A	24.4	Very low	27.8	Very low	88 Å²	88	119.5 Å²	119.5	73%	0.727	76%	0.755	S	S	*	*			trans	112.4	157.9	150.1	0	0	0	0	0	118.3
249	T	27.4	Very low	27.5	Very low	124 Å²	124	124.4 Å²	124.4	76%	0.761	76%	0.76	S	S	*	*			cis	-172.5	153.4	-33.6	-77.4	0	0	0	0	107.3
250	A	27.8	Very low	28.5	Very low	93 Å²	93	122.2 Å²	122.2	77%	0.769	75%	0.754	S	S	*	*			trans	69	156.4	163	0	0	0	0	0	118.8
251	D	28	Very low	28.6	Very low	150 Å²	150	119.7 Å²	119.7	80%	0.802	75%	0.753	S	S	*	*			cis	-168.5	-178.7	-27.9	-165.9	9.6	0	0	0	109.2
252	S	26.8	Very low	28.7	Very low	109 Å²	109	118.9 Å²	118.9	76%	0.762	75%	0.748	S	S	*	*			trans	89.8	121.8	161.6	-59.5	0	0	0	0	119.9
253	Q	27.6	Very low	28.9	Very low	162 Å²	162	122.8 Å²	122.8	76%	0.757	75%	0.753	S	S	*	*			trans	-92.6	175.7	169.1	-138.1	-174.8	-0.7	0	0	110.4	S255	Q253-S255 PolarHBondContact NE2-OG 3.3Å; Q253-S255 PolarHBondContact OE1-OG 3.02Å; Q253-S255 VanDerWaalsContact OE1-OG 3.14Å
254	P	39.1	Very low	28.8	Very low	124 Å²	124	125.5 Å²	125.5	81%	0.805	75%	0.749	S	S	*	*				-144.1	-168.1	66.3	24.9	0.6	0	0	0	114.9
255	S	27	Very low	28.5	Very low	70 Å²	70	124.7 Å²	124.7	49%	0.49	74%	0.743	S	S	.	*				175.3	148.9	-51.3	-81.4	0	0	0	0	112	Q253	Q253-S255 PolarHBondContact NE2-OG 3.3Å; Q253-S255 PolarHBondContact OE1-OG 3.02Å; Q253-S255 VanDerWaalsContact OE1-OG 3.14Å
256	V	29.3	Very low	28.5	Very low	144 Å²	144	123.9 Å²	123.9	87%	0.873	74%	0.743	S	S	*	*			trans	67.1	161.9	161.8	170.5	0	0	0	0	116.2
257	E	27.1	Very low	28.6	Very low	144 Å²	144	125.2 Å²	125.2	67%	0.673	74%	0.744	S	S	*	*				-150.5	172.9	-53.3	-101.5	-120.4	83.1	0	0	105.9	R259	E257-R259 WeakPolarHBondContact OE2-CD 3.49Å; E257-R259 IonicContact OE2-NE 2.66Å
258	G	27	Very low	28.4	Very low	63 Å²	63	125.7 Å²	125.7	65%	0.649	74%	0.744	S	S	*	*			cis	132.5	-179.5	-2.2	0	0	0	0	0	114.2
259	R	31.4	Very low	28.5	Very low	213 Å²	213	129 Å²	129	80%	0.804	75%	0.748	S	S	*	*			trans	69	165.2	164.3	-88.8	-173.5	161.3	-131.2	-6	119.8	E257	E257-R259 WeakPolarHBondContact OE2-CD 3.49Å; E257-R259 IonicContact OE2-NE 2.66Å
260	P	44.4	Very low	28.3	Very low	110 Å²	110	130.8 Å²	130.8	71%	0.714	75%	0.748	S	S	*	*				-146.9	176.1	-69.8	39.2	-18	0	0	0	118.2
261	G	26.3	Very low	28.2	Very low	71 Å²	71	131.2 Å²	131.2	73%	0.732	75%	0.745	S	S	*	*			trans	103.6	165.3	150.6	0	0	0	0	0	117.4
262	V	25.7	Very low	28.3	Very low	127 Å²	127	129 Å²	129	77%	0.77	74%	0.737	S	S	*	*			cis	-159.4	143	15	166.8	0	0	0	0	111.7
263	L	27.2	Very low	28.3	Very low	145 Å²	145	133 Å²	133	76%	0.759	74%	0.741	S	S	*	*			trans	64.7	152.5	163.9	-68.3	168	0	0	0	119.5
264	E	24.5	Very low	28.2	Very low	157 Å²	157	133.6 Å²	133.6	73%	0.734	75%	0.748	S	S	*	*			cis	-156.2	168.2	-5	-143.1	166.4	148.5	0	0	114.5
265	S	24.6	Very low	27.4	Very low	94 Å²	94	131.9 Å²	131.9	66%	0.657	75%	0.745	S	S	*	*			trans	75.2	119.2	149.5	-69	0	0	0	0	124.3
266	S	27.7	Very low	28.6	Very low	114 Å²	114	134.2 Å²	134.2	80%	0.797	76%	0.758	S	S	*	*			trans	16.2	150.5	136.6	-42.9	0	0	0	0	122.1
267	E	26.9	Very low	29	Very low	173 Å²	173	132.7 Å²	132.7	81%	0.808	75%	0.751	S	S	*	*			cis	-143.6	148.2	28.7	-71.9	-179.3	124.1	0	0	115.9
268	Q	27.1	Very low	28.8	Very low	165 Å²	165	132.9 Å²	132.9	77%	0.771	76%	0.756	S	S	*	*			trans	24.1	117.1	147.5	-64.7	168.8	7.1	0	0	121.4
269	L	25.5	Very low	28.7	Very low	158 Å²	158	139.8 Å²	139.8	83%	0.827	76%	0.762	S	S	*	*				71.1	148.7	90.5	-64.3	177.5	0	0	0	115.2
270	H	23.9	Very low	28.3	Very low	161 Å²	161	136.5 Å²	136.5	75%	0.745	76%	0.761	S	S	*	*			cis	-149.1	178.9	13.9	-157.8	-95.2	0	0	0	112.4
271	S	25.4	Very low	27.4	Very low	102 Å²	102	137 Å²	137	71%	0.713	77%	0.767	S	S	*	*			trans	-108.6	-176.9	174.3	-168.8	0	0	0	0	113.1
272	T	30.1	Very low	27.3	Very low	103 Å²	103	137.4 Å²	137.4	63%	0.632	77%	0.771	S	S	*	*			trans	112.4	110.9	148.6	-54	0	0	0	0	119.2
273	F	25.5	Very low	27.6	Very low	193 Å²	193	137.1 Å²	137.1	85%	0.846	77%	0.77	S	S	*	*			trans	48.1	135.7	145.7	-76.5	-125.1	0	0	0	122.7
274	L	26.3	Very low	27.4	Very low	175 Å²	175	136.7 Å²	136.7	92%	0.916	77%	0.768	S	S	*	*				-167.7	174.7	107.9	-100.8	169.4	0	0	0	112.1
275	A	23.3	Very low	27.6	Very low	88 Å²	88	134 Å²	134	73%	0.727	77%	0.766	S	S	*	*			trans	-115.6	175.9	-164.5	0	0	0	0	0	113.7
276	P	50.5	Low	27.5	Very low	118 Å²	118	138.5 Å²	138.5	77%	0.766	78%	0.777	S	S	*	*			trans	-91.6	175.7	-157.2	42.1	-41.2	0	0	0	114.2
277	P	39.1	Very low	27.5	Very low	113 Å²	113	137 Å²	137	73%	0.734	77%	0.771	S	S	*	*				-158.6	160.7	91.3	42	-22.5	0	0	0	119.7
278	L	23.1	Very low	27.4	Very low	148 Å²	148	136.5 Å²	136.5	78%	0.775	78%	0.775	S	S	*	*			trans	57.9	141.4	136.3	-70.2	168	0	0	0	125.8
279	R	23.7	Very low	27.3	Very low	207 Å²	207	133 Å²	133	78%	0.781	77%	0.773	S	S	*	*			trans	77.4	126.9	144.2	-82.1	-180	176.2	-159.1	-2.2	118.4
280	N	24.6	Very low	27.4	Very low	145 Å²	145	133.2 Å²	133.2	78%	0.775	78%	0.775	S	S	*	*				67.6	138.7	83	-64	26.4	0	0	0	112.3
281	S	25.3	Very low	27.5	Very low	120 Å²	120	131 Å²	131	84%	0.839	78%	0.776	S	S	*	*			cis	-162.4	162.8	9.2	31.7	0	0	0	0	111.1
282	G	23.3	Very low	28	Very low	79 Å²	79	134.2 Å²	134.2	81%	0.814	78%	0.78	S	S	*	*			trans	-172.3	104.7	168	0	0	0	0	0	110.9
283	T	31.1	Very low	29.3	Very low	121 Å²	121	134.2 Å²	134.2	74%	0.742	78%	0.781	S	S	*	*			trans	-119.6	175.3	177.2	50.3	0	0	0	0	110.2
284	D	23.5	Very low	30.2	Very low	136 Å²	136	128.9 Å²	128.9	73%	0.727	77%	0.766	S	S	*	*			trans	77.4	139.7	164.7	-59.7	-69.5	0	0	0	116.8
285	S	28.7	Very low	30.9	Very low	100 Å²	100	122.9 Å²	122.9	70%	0.699	74%	0.742	S	S	*	*			cis	-159	-171.8	-9.8	-123.5	0	0	0	0	111.4
286	E	23.6	Very low	31.7	Very low	190 Å²	190	124.7 Å²	124.7	89%	0.888	73%	0.734	S	S	*	*			trans	70.4	164.3	175.5	-59.6	-155.2	107.9	0	0	117.9
287	A	27.1	Very low	31.3	Very low	81 Å²	81	125.3 Å²	125.3	67%	0.669	73%	0.726	S	S	*	*			cis	-174	155.2	-47.4	0	0	0	0	0	108.2
288	D	24.3	Very low	31.4	Very low	164 Å²	164	124.6 Å²	124.6	88%	0.877	71%	0.714	S	S	*	*			trans	35.5	119	162.9	-112.8	-48.3	0	0	0	122.4
289	A	25.9	Very low	32.4	Very low	90 Å²	90	120.9 Å²	120.9	74%	0.744	69%	0.69	S	S	*	*			trans	-171.4	122.9	139.3	0	0	0	0	0	115.4
290	L	26.9	Very low	33.5	Very low	163 Å²	163	116.6 Å²	116.6	85%	0.853	68%	0.682	S	S	*	*			trans	44.8	91	142.8	-88.3	61.4	0	0	0	122.3
291	C	25.3	Very low	34.6	Very low	114 Å²	114	115 Å²	115	77%	0.77	67%	0.668	S	S	*	*				24.2	99.3	108	-156.8	0	0	0	0	121.5
292	Q	36.7	Very low	35.7	Very low	170 Å²	170	116.7 Å²	116.7	79%	0.794	66%	0.66	S	S	*	*			trans	63.8	-170.7	136.2	-74.1	-82	-14.3	0	0	118
293	P	56.9	Low	36.9	Very low	103 Å²	103	115.5 Å²	115.5	67%	0.669	64%	0.643	S	S	*	*			cis	-121.8	-107.1	-22.4	17.2	8	0	0	0	116.7
294	P	45.2	Very low	38.1	Very low	82 Å²	82	114.5 Å²	114.5	53%	0.532	63%	0.631	S	S	.	*				-128.4	26.7	-117.3	42.7	-25.3	0	0	0	115.8	K296 Q297 M298	P294-K296 VanDerWaalsContact C-N 3.34Å; P294-K296 PolarHBondContact O-N 3.17Å; P294-Q297 PolarHBondContact O-N 3.07Å; P294-M298 HydrophobicContact CG-CG 4.19Å
295	A	40.6	Very low	39.7	Very low	49 Å²	49	113.7 Å²	113.7	41%	0.405	62%	0.623	S	S	.	*	H	α-helix	trans	-51.4	-41.4	-158.3	0	0	0	0	0	116	Q297 M298 R299	A295-Q297 PolarHBondContact O-N 3Å; A295-M298 PolarHBondContact O-N 2.85Å; A295-M298 VanDerWaalsContact O-N 3.08Å; A295-R299 PolarHBondContact O-N 2.69Å
296	K	41.2	Very low	41.1	Very low	126 Å²	126	113.9 Å²	113.9	55%	0.548	62%	0.615	S	S	.	*	H	α-helix	trans	-64	-41.8	-170.2	-59	-171.1	172.8	-131	0	113.8	P294 L300	P294-K296 VanDerWaalsContact C-N 3.34Å; P294-K296 PolarHBondContact O-N 3.17Å; K296-L300 PolarHBondContact O-N 3Å
297	Q	41.8	Very low	43.1	Very low	130 Å²	130	113 Å²	113	61%	0.607	61%	0.608	S	S	*	*	H	α-helix	trans	-70.9	-31.9	173.5	-80.1	-159.9	18.7	0	0	112.4	P294 A295 K301	P294-Q297 PolarHBondContact O-N 3.07Å; A295-Q297 PolarHBondContact O-N 3Å; Q297-K301 WeakPolarHBondContact O-CB 3.42Å; Q297-K301 WeakPolarHBondContact O-CD 3.37Å; Q297-K301 WeakPolarHBondContact O-CG 3.43Å; Q297-K301 PolarHBondContact O-N 3.3Å
298	M	41.7	Very low	44.5	Very low	98 Å²	98	115 Å²	115	48%	0.483	60%	0.602	S	S	.	*	H	α-helix	trans	-71.5	-39.2	179.9	-69.8	-63.7	-77.9	0	0	111.8	P294 A295 K301 K302	P294-M298 HydrophobicContact CG-CG 4.19Å; A295-M298 PolarHBondContact O-N 2.85Å; A295-M298 VanDerWaalsContact O-N 3.08Å; M298-K301 PolarHBondContact O-N 2.99Å; M298-K302 WeakPolarHBondContact O-CB 3.31Å; M298-K302 WeakPolarHBondContact O-CG 3.39Å; M298-K302 PolarHBondContact O-N 3.37Å
299	R	43.7	Very low	46	Very low	71 Å²	71	111 Å²	111	27%	0.268	58%	0.58	S	S	.	*	H	α-helix	trans	-60	-47.5	173.3	-74.5	-178.6	173.4	148	9.3	111.5	A295 K301 K302 A303 E756	A295-R299 PolarHBondContact O-N 2.69Å; R299-K301 PolarHBondContact O-N 2.75Å; R299-K302 PolarHBondContact O-N 3.34Å; R299-A303 PolarHBondContact O-N 2.86Å; R299-E756 IonicContact CZ-OE1 2.59Å; R299-E756 IonicContact NH1-OE1 3.16Å; R299-E756 PolarHBondContact NH1-OE1 3.14Å; R299-E756 IonicContact NH2-OE1 3.96Å; R299-E756 PolarHBondContact NH2-OE1 3.24Å
300	L	45.4	Very low	47.3	Very low	116 Å²	116	111.2 Å²	111.2	61%	0.607	57%	0.569	S	S	*	*	H	α-helix	trans	-62.7	-44.1	176.2	-176.1	61.5	0	0	0	112.7	K296 K302 A303 M304	K296-L300 PolarHBondContact O-N 3Å; L300-K302 PolarHBondContact O-N 3.12Å; L300-A303 PolarHBondContact O-N 2.97Å; L300-M304 HydrophobicContact CG-SD 4.27Å; L300-M304 WeakPolarHBondContact O-CG 3.26Å; L300-M304 PolarHBondContact O-N 3.34Å
301	K	47.8	Very low	48.8	Very low	111 Å²	111	110 Å²	110	48%	0.483	56%	0.557	S	S	.	*	H	α-helix	trans	-63.1	-39.9	176.6	-71.6	166.9	-167.1	169.7	0	112	Q297 M298 R299 H305	Q297-K301 WeakPolarHBondContact O-CB 3.42Å; Q297-K301 WeakPolarHBondContact O-CD 3.37Å; Q297-K301 WeakPolarHBondContact O-CG 3.43Å; Q297-K301 PolarHBondContact O-N 3.3Å; M298-K301 PolarHBondContact O-N 2.99Å; R299-K301 PolarHBondContact O-N 2.75Å; K301-H305 VanDerWaalsContact O-CB 3.31Å; K301-H305 WeakPolarHBondContact O-CB 3.37Å; K301-H305 PolarHBondContact O-N 3.33Å
302	K	49.8	Very low	50.3	Low	156 Å²	156	108.4 Å²	108.4	68%	0.678	54%	0.54	S	S	*	.	H	α-helix	trans	-63.2	-46.2	173.2	-81.1	-172.2	173.1	-172.2	0	111.8	M298 R299 L300 M304 H305 L306	M298-K302 WeakPolarHBondContact O-CB 3.31Å; M298-K302 WeakPolarHBondContact O-CG 3.39Å; M298-K302 PolarHBondContact O-N 3.37Å; R299-K302 PolarHBondContact O-N 3.34Å; L300-K302 PolarHBondContact O-N 3.12Å; K302-M304 PolarHBondContact O-N 3.13Å; K302-H305 WeakPolarHBondContact O-CB 3.47Å; K302-H305 PolarHBondContact O-N 3.3Å; K302-H305 VanDerWaalsContact O-N 3.16Å; K302-L306 WeakPolarHBondContact O-CB 3.15Å; K302-L306 PolarHBondContact O-N 3.43Å
303	A	48.2	Very low	51.2	Low	55 Å²	55	107 Å²	107	46%	0.455	53%	0.531	S	S	.	.	H	α-helix	trans	-61.8	-42	178.4	0	0	0	0	0	112.6	R299 L300 L306 K307	R299-A303 PolarHBondContact O-N 2.86Å; L300-A303 PolarHBondContact O-N 2.97Å; A303-L306 PolarHBondContact O-N 3.28Å; A303-K307 PolarHBondContact O-N 3.5Å
304	M	56.2	Low	51.2	Low	99 Å²	99	105.6 Å²	105.6	49%	0.488	52%	0.524	S	S	.	.	H	α-helix	trans	-64.9	-40.4	172.7	-69.1	174.4	72.7	0	0	112.2	L300 K302 K308	L300-M304 HydrophobicContact CG-SD 4.27Å; L300-M304 WeakPolarHBondContact O-CG 3.26Å; L300-M304 PolarHBondContact O-N 3.34Å; K302-M304 PolarHBondContact O-N 3.13Å; M304-K308 WeakPolarHBondContact O-CB 3.24Å; M304-K308 PolarHBondContact O-N 2.99Å
305	H	56	Low	51.8	Low	120 Å²	120	105.7 Å²	105.7	56%	0.556	52%	0.518	S	S	*	.	H	α-helix	trans	-64.2	-41	176.4	-166.9	-89.7	0	0	0	111.9	K301 K302 K308 L309	K301-H305 VanDerWaalsContact O-CB 3.31Å; K301-H305 WeakPolarHBondContact O-CB 3.37Å; K301-H305 PolarHBondContact O-N 3.33Å; K302-H305 WeakPolarHBondContact O-CB 3.47Å; K302-H305 PolarHBondContact O-N 3.3Å; K302-H305 VanDerWaalsContact O-N 3.16Å; H305-K308 WeakPolarHBondContact O-CB 3.45Å; H305-K308 PolarHBondContact O-N 3.1Å; H305-L309 WeakPolarHBondContact O-CB 3.21Å; H305-L309 PolarHBondContact O-N 2.8Å
306	L	58.3	Low	52.1	Low	104 Å²	104	109.3 Å²	109.3	55%	0.545	53%	0.526	S	S	.	.	H	α-helix	trans	-67.8	-43.3	177.9	-172.3	60.8	0	0	0	111.9	K302 A303 K308 L309 N310	K302-L306 WeakPolarHBondContact O-CB 3.15Å; K302-L306 PolarHBondContact O-N 3.43Å; A303-L306 PolarHBondContact O-N 3.28Å; L306-K308 VanDerWaalsContact C-N 3.31Å; L306-K308 PolarHBondContact O-N 3.37Å; L306-L309 PolarHBondContact O-N 3.5Å; L306-L309 VanDerWaalsContact O-N 3.17Å; L306-N310 PolarHBondContact O-N 3.15Å
307	K	66.9	Low	52.3	Low	171 Å²	171	106.5 Å²	106.5	74%	0.743	52%	0.522	S	S	*	.	H	α-helix	trans	-60	-39.5	170.6	-80.4	-170.2	173.7	-176.9	0	112.1	A303 F311	A303-K307 PolarHBondContact O-N 3.5Å; K307-F311 WeakPolarHBondContact O-CB 3.4Å; K307-F311 PolarHBondContact O-N 3.46Å
308	K	55.1	Low	52.6	Low	124 Å²	124	102.9 Å²	102.9	54%	0.539	52%	0.515	S	S	.	.	H	α-helix	trans	-64.5	-39.5	173.9	-172.4	-176.7	177.4	-169.9	0	112.1	M304 H305 L306 F311 L312	M304-K308 WeakPolarHBondContact O-CB 3.24Å; M304-K308 PolarHBondContact O-N 2.99Å; H305-K308 WeakPolarHBondContact O-CB 3.45Å; H305-K308 PolarHBondContact O-N 3.1Å; L306-K308 VanDerWaalsContact C-N 3.31Å; L306-K308 PolarHBondContact O-N 3.37Å; K308-F311 PolarHBondContact O-N 3.37Å; K308-L312 HydrophobicContact CG-CD1 4.08Å; K308-L312 WeakPolarHBondContact O-CB 3.42Å; K308-L312 WeakPolarHBondContact O-CG 3.2Å; K308-L312 PolarHBondContact O-N 2.88Å
309	L	55.5	Low	52.7	Low	79 Å²	79	102.9 Å²	102.9	41%	0.414	51%	0.513	S	S	.	.	H	α-helix	trans	-68.4	-40	179.8	-140.8	125.6	0	0	0	111.7	H305 L306 L312 K313	H305-L309 WeakPolarHBondContact O-CB 3.21Å; H305-L309 PolarHBondContact O-N 2.8Å; L306-L309 PolarHBondContact O-N 3.5Å; L306-L309 VanDerWaalsContact O-N 3.17Å; L309-L312 PolarHBondContact O-N 3.06Å; L309-K313 WeakPolarHBondContact O-CB 3.33Å; L309-K313 PolarHBondContact O-N 3.01Å
310	N	54.4	Low	52.7	Low	94 Å²	94	110.2 Å²	110.2	50%	0.503	54%	0.541	S	S	.	.	H	α-helix	trans	-69.4	-38	174.8	-68.8	-4.6	0	0	0	111.9	L306 K313 S314	L306-N310 PolarHBondContact O-N 3.15Å; N310-K313 PolarHBondContact O-N 3.41Å; N310-S314 WeakPolarHBondContact O-CB 3.48Å; N310-S314 PolarHBondContact O-N 2.89Å
311	F	57.9	Low	52.6	Low	139 Å²	139	110.5 Å²	110.5	61%	0.61	55%	0.548	S	S	*	.	H	α-helix	trans	-63	-44.5	172.4	-175.4	-92.6	0	0	0	112	K307 K308 S314 Q315	K307-F311 WeakPolarHBondContact O-CB 3.4Å; K307-F311 PolarHBondContact O-N 3.46Å; K308-F311 PolarHBondContact O-N 3.37Å; F311-S314 PolarHBondContact O-N 3.17Å; F311-Q315 WeakPolarHBondContact O-CB 3.47Å; F311-Q315 PolarHBondContact O-N 2.9Å
312	L	57.6	Low	52.1	Low	79 Å²	79	108.9 Å²	108.9	41%	0.414	55%	0.55	S	S	.	*	H	α-helix	trans	-68.2	-36.5	177.1	-72.7	171.5	0	0	0	112.8	K308 L309 Q315 Q316	K308-L312 HydrophobicContact CG-CD1 4.08Å; K308-L312 WeakPolarHBondContact O-CB 3.42Å; K308-L312 WeakPolarHBondContact O-CG 3.2Å; K308-L312 PolarHBondContact O-N 2.88Å; L309-L312 PolarHBondContact O-N 3.06Å; L312-Q315 PolarHBondContact O-N 3.06Å; L312-Q316 WeakPolarHBondContact O-CB 3.45Å; L312-Q316 WeakPolarHBondContact O-CG 3.48Å; L312-Q316 PolarHBondContact O-N 3.29Å
313	K	55.8	Low	51.1	Low	140 Å²	140	108 Å²	108	61%	0.609	55%	0.553	S	S	*	*	H	α-helix	trans	-61.1	-46.6	169.3	-87.3	-169.3	170.4	-172.4	0	111.5	L309 N310 Q315 Q316 S317	L309-K313 WeakPolarHBondContact O-CB 3.33Å; L309-K313 PolarHBondContact O-N 3.01Å; N310-K313 PolarHBondContact O-N 3.41Å; K313-Q315 VanDerWaalsContact C-N 3.3Å; K313-Q315 PolarHBondContact O-N 3.37Å; K313-Q316 PolarHBondContact O-N 2.89Å; K313-S317 PolarHBondContact O-N 3.48Å; K313-S317 PolarHBondContact O-OG 2.89Å; K313-S317 VanDerWaalsContact O-OG 3.09Å
314	S	55.9	Low	50.6	Low	75 Å²	75	111 Å²	111	52%	0.524	57%	0.568	S	S	.	*	H	α-helix	trans	-60.6	-39.2	177.6	179.6	0	0	0	0	112.1	N310 F311 S317 A318	N310-S314 WeakPolarHBondContact O-CB 3.48Å; N310-S314 PolarHBondContact O-N 2.89Å; F311-S314 PolarHBondContact O-N 3.17Å; S314-S317 VanDerWaalsContact CA-OG 3.31Å; S314-S317 WeakPolarHBondContact CA-OG 3.26Å; S314-S317 PolarHBondContact O-OG 3.27Å; S314-A318 PolarHBondContact O-N 3.45Å; S314-A318 VanDerWaalsContact O-N 3.15Å
315	Q	58.8	Low	49.3	Very low	84 Å²	84	115.8 Å²	115.8	39%	0.393	59%	0.589	S	S	.	*	H	α-helix	trans	-67.4	-46.5	174.5	-172.6	176.2	-14.5	0	0	111.8	F311 L312 K313 S317 A318 E319	F311-Q315 WeakPolarHBondContact O-CB 3.47Å; F311-Q315 PolarHBondContact O-N 2.9Å; L312-Q315 PolarHBondContact O-N 3.06Å; K313-Q315 VanDerWaalsContact C-N 3.3Å; K313-Q315 PolarHBondContact O-N 3.37Å; Q315-S317 VanDerWaalsContact C-N 3.31Å; Q315-S317 PolarHBondContact O-N 2.88Å; Q315-A318 WeakPolarHBondContact O-CB 3.38Å; Q315-A318 PolarHBondContact O-N 3.42Å; Q315-E319 HydrophobicContact CG-CG 4.47Å; Q315-E319 WeakPolarHBondContact CG-OE1 3.33Å; Q315-E319 PolarHBondContact NE2-OE1 3.42Å; Q315-E319 WeakPolarHBondContact O-CG 3.12Å; Q315-E319 PolarHBondContact O-N 2.91Å
316	Q	46.2	Very low	48	Very low	124 Å²	124	115.6 Å²	115.6	58%	0.579	60%	0.602	S	S	*	*	H	α-helix	trans	-63.2	-33.3	176	-77.4	-173.6	-28.3	0	0	113.2	L312 K313 A318 R320	L312-Q316 WeakPolarHBondContact O-CB 3.45Å; L312-Q316 WeakPolarHBondContact O-CG 3.48Å; L312-Q316 PolarHBondContact O-N 3.29Å; K313-Q316 PolarHBondContact O-N 2.89Å; Q316-A318 VanDerWaalsContact C-N 3.34Å; Q316-R320 WeakPolarHBondContact O-CB 3.35Å; Q316-R320 WeakPolarHBondContact O-CG 3.48Å; Q316-R320 PolarHBondContact O-N 2.85Å
317	S	45.4	Very low	46.6	Very low	68 Å²	68	117.9 Å²	117.9	48%	0.476	61%	0.614	S	S	.	*	H	α-helix	trans	-68.2	-32.6	172.2	48.5	0	0	0	0	112.7	K313 S314 Q315 T321	K313-S317 PolarHBondContact O-N 3.48Å; K313-S317 PolarHBondContact O-OG 2.89Å; K313-S317 VanDerWaalsContact O-OG 3.09Å; S314-S317 VanDerWaalsContact CA-OG 3.31Å; S314-S317 WeakPolarHBondContact CA-OG 3.26Å; S314-S317 PolarHBondContact O-OG 3.27Å; Q315-S317 VanDerWaalsContact C-N 3.31Å; Q315-S317 PolarHBondContact O-N 2.88Å; S317-T321 PolarHBondContact O-N 3.44Å; S317-T321 PolarHBondContact O-OG1 3.42Å
318	A	47.2	Very low	44.8	Very low	54 Å²	54	117.5 Å²	117.5	45%	0.446	62%	0.62	S	S	.	*	H	α-helix	trans	-74.4	-38.6	175	0	0	0	0	0	112.3	S314 Q315 Q316 T321 S322	S314-A318 PolarHBondContact O-N 3.45Å; S314-A318 VanDerWaalsContact O-N 3.15Å; Q315-A318 WeakPolarHBondContact O-CB 3.38Å; Q315-A318 PolarHBondContact O-N 3.42Å; Q316-A318 VanDerWaalsContact C-N 3.34Å; A318-T321 WeakPolarHBondContact CA-OG1 3.1Å; A318-T321 PolarHBondContact O-N 2.94Å; A318-T321 PolarHBondContact O-OG1 3.28Å; A318-S322 PolarHBondContact O-OG 2.84Å
319	E	45	Very low	43.6	Very low	97 Å²	97	114.5 Å²	114.5	45%	0.453	63%	0.625	S	S	.	*	H	α-helix	trans	-68.1	-33.5	176.5	-71.5	166.4	178.3	0	0	111.9	Q315 T321 S322	Q315-E319 HydrophobicContact CG-CG 4.47Å; Q315-E319 WeakPolarHBondContact CG-OE1 3.33Å; Q315-E319 PolarHBondContact NE2-OE1 3.42Å; Q315-E319 WeakPolarHBondContact O-CG 3.12Å; Q315-E319 PolarHBondContact O-N 2.91Å; E319-T321 VanDerWaalsContact C-N 3.27Å; E319-T321 PolarHBondContact O-N 3.17Å; E319-S322 PolarHBondContact O-N 3.45Å; E319-S322 PolarHBondContact O-OG 3.16Å; E319-S322 VanDerWaalsContact O-OG 3.1Å
320	R	42.7	Very low	42.2	Very low	226 Å²	226	118.5 Å²	118.5	85%	0.853	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-20.1	171.6	-79.2	-177.5	175.9	-148.5	-3.2	114.3	Q316	Q316-R320 WeakPolarHBondContact O-CB 3.35Å; Q316-R320 WeakPolarHBondContact O-CG 3.48Å; Q316-R320 PolarHBondContact O-N 2.85Å
321	T	43.2	Very low	41	Very low	121 Å²	121	120 Å²	120	74%	0.742	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	6.7	176.5	49.1	0	0	0	0	113.9	S317 A318 E319	S317-T321 PolarHBondContact O-N 3.44Å; S317-T321 PolarHBondContact O-OG1 3.42Å; A318-T321 WeakPolarHBondContact CA-OG1 3.1Å; A318-T321 PolarHBondContact O-N 2.94Å; A318-T321 PolarHBondContact O-OG1 3.28Å; E319-T321 VanDerWaalsContact C-N 3.27Å; E319-T321 PolarHBondContact O-N 3.17Å
322	S	38.3	Very low	39.5	Very low	77 Å²	77	125.3 Å²	125.3	54%	0.538	67%	0.674	S	S	.	*	S	Bend	trans	-126.8	5.7	-171.4	61.2	0	0	0	0	116.4	A318 E319	A318-S322 PolarHBondContact O-OG 2.84Å; E319-S322 PolarHBondContact O-N 3.45Å; E319-S322 PolarHBondContact O-OG 3.16Å; E319-S322 VanDerWaalsContact O-OG 3.1Å
323	N	29.6	Very low	38	Very low	138 Å²	138	130.7 Å²	130.7	74%	0.738	69%	0.688	S	S	*	*			trans	-109.1	112.3	174.9	-78.1	-1	0	0	0	110.7
324	P	35.9	Very low	36.5	Very low	118 Å²	118	130.4 Å²	130.4	77%	0.766	69%	0.69	S	S	*	*			trans	-74.4	139.8	159.1	31.6	-31.5	0	0	0	109.4
325	E	29.7	Very low	35.1	Very low	199 Å²	199	135.4 Å²	135.4	93%	0.93	70%	0.704	S	S	*	*			trans	-77.1	130.7	176.7	-65.9	-178.4	137.8	0	0	110.7
326	S	29.6	Very low	33.6	Very low	117 Å²	117	137.5 Å²	137.5	82%	0.818	73%	0.728	S	S	*	*			trans	-122.5	85.4	168.8	66.6	0	0	0	0	108.5
327	D	28.1	Very low	32.7	Very low	152 Å²	152	136.3 Å²	136.3	81%	0.813	74%	0.74	S	S	*	*			trans	-81.1	138.6	172.7	-167.8	16.6	0	0	0	110.5
328	N	28.8	Very low	31.9	Very low	163 Å²	163	137.7 Å²	137.7	87%	0.872	76%	0.756	S	S	*	*			trans	-155.4	78.2	-179.8	-135.7	-14.5	0	0	0	106.4
329	G	29.6	Very low	31	Very low	61 Å²	61	142.7 Å²	142.7	63%	0.629	77%	0.767	S	S	*	*			trans	-74.6	158.6	-159	0	0	0	0	0	115.6
330	L	26.7	Very low	30.1	Very low	163 Å²	163	145 Å²	145	85%	0.853	78%	0.778	S	S	*	*			trans	-146.5	107	162.6	-166.6	70.9	0	0	0	112.5
331	V	28.8	Very low	29.4	Very low	125 Å²	125	140.9 Å²	140.9	76%	0.758	77%	0.773	S	S	*	*			trans	28.7	116.2	149	-173.3	0	0	0	0	118.6
332	R	26.2	Very low	28.7	Very low	251 Å²	251	144 Å²	144	95%	0.947	78%	0.779	S	S	*	*			trans	-136	168	134.5	-144.8	165.9	179.4	140.3	1.2	110.4
333	R	25.7	Very low	28.2	Very low	191 Å²	191	143.6 Å²	143.6	72%	0.721	79%	0.787	S	S	*	*			trans	-140.3	161.3	-147.5	172.3	-178.7	149.6	138.3	8.3	111.1
334	E	25.1	Very low	28.1	Very low	135 Å²	135	140.5 Å²	140.5	63%	0.631	79%	0.788	S	S	*	*			trans	67.4	142.8	-174.8	-77.8	106.5	-155.9	0	0	113.5
335	E	25.9	Very low	27.9	Very low	179 Å²	179	142 Å²	142	84%	0.836	79%	0.785	S	S	*	*			cis	-158.9	147.9	6.5	-133.2	177.2	153.3	0	0	111.9
336	S	27.3	Very low	27.8	Very low	128 Å²	128	141 Å²	141	90%	0.895	78%	0.777	S	S	*	*			trans	156.3	165.6	152.1	49.1	0	0	0	0	111.6
337	A	26.9	Very low	27.6	Very low	99 Å²	99	139.5 Å²	139.5	82%	0.818	77%	0.772	S	S	*	*			trans	-137.8	152.2	-150.6	0	0	0	0	0	117.8
338	A	28.8	Very low	27.4	Very low	98 Å²	98	143.7 Å²	143.7	81%	0.81	78%	0.777	S	S	*	*			trans	64.5	145.4	160.4	0	0	0	0	0	117.1
339	K	28.5	Very low	27.2	Very low	158 Å²	158	140.7 Å²	140.7	69%	0.687	77%	0.769	S	S	*	*			cis	-153	170.6	31.6	-79.8	169.7	138.2	-80	0	111.8
340	E	27	Very low	27.6	Very low	145 Å²	145	142.2 Å²	142.2	68%	0.678	77%	0.767	S	S	*	*			trans	41.3	141.7	142.2	-76.4	120.2	-119.9	0	0	121.6
341	D	26.8	Very low	27.4	Very low	140 Å²	140	140.5 Å²	140.5	75%	0.749	76%	0.764	S	S	*	*			cis	-165.8	166.2	-8.1	-156.6	-2.5	0	0	0	110.6
342	E	28.7	Very low	28.2	Very low	186 Å²	186	139.8 Å²	139.8	87%	0.869	76%	0.762	S	S	*	*			trans	45.6	153.8	168.4	-57.9	-148.1	109.8	0	0	121
343	G	29	Very low	28.1	Very low	69 Å²	69	136 Å²	136	71%	0.711	76%	0.755	S	S	*	*			cis	170.7	155.9	-5.7	0	0	0	0	0	111.8
344	G	27.9	Very low	28.2	Very low	73 Å²	73	132.9 Å²	132.9	75%	0.753	75%	0.748	S	S	*	*			trans	68	97.5	167.5	0	0	0	0	0	118.1
345	E	29.9	Very low	28.4	Very low	150 Å²	150	134.8 Å²	134.8	70%	0.701	75%	0.754	S	S	*	*				77.7	119	77	-72.2	-117.5	92	0	0	117.2
346	K	28.6	Very low	28.4	Very low	177 Å²	177	129.6 Å²	129.6	77%	0.77	75%	0.749	S	S	*	*			trans	45.3	148.5	135.9	-65.5	175.7	-174	139.2	0	121.8
347	A	25.1	Very low	28.5	Very low	87 Å²	87	133.5 Å²	133.5	72%	0.719	74%	0.744	S	S	*	*			cis	-176.6	174.7	-14.4	0	0	0	0	0	110.5
348	R	24.5	Very low	28.5	Very low	239 Å²	239	135.3 Å²	135.3	90%	0.902	74%	0.736	S	S	*	*			trans	87.2	121.1	145.1	-141.4	-178.6	-171.2	-114.8	3.6	119.4
349	S	24.1	Very low	28.4	Very low	101 Å²	101	137.6 Å²	137.6	71%	0.706	73%	0.729	S	S	*	*			trans	-72.1	-163.4	160.6	-30.9	0	0	0	0	111.6
350	P	38.5	Very low	28.4	Very low	93 Å²	93	137.2 Å²	137.2	60%	0.604	73%	0.734	S	S	*	*			cis	-142.7	165.8	-7.5	38.6	-19.3	0	0	0	117.7
351	T	22.6	Very low	28.3	Very low	127 Å²	127	133.9 Å²	133.9	78%	0.779	74%	0.738	S	S	*	*			trans	61.8	176	142.5	53.4	0	0	0	0	120.7
352	P	44.8	Very low	29	Very low	109 Å²	109	133 Å²	133	71%	0.708	74%	0.74	S	S	*	*				-132.5	-140.3	-53.8	39.6	-20.8	0	0	0	112.1
353	E	24.1	Very low	28.8	Very low	172 Å²	172	133.2 Å²	133.2	80%	0.804	74%	0.741	S	S	*	*			trans	79.9	146.6	171.9	-53	-166.5	150.5	0	0	116.6
354	E	27.3	Very low	28.6	Very low	126 Å²	126	134.5 Å²	134.5	59%	0.589	74%	0.739	S	S	*	*			cis	-158.1	165.3	-9.9	-125.1	-159.6	153.9	0	0	111.7
355	K	29.4	Very low	28.5	Very low	174 Å²	174	135.8 Å²	135.8	76%	0.757	74%	0.737	S	S	*	*			trans	40.4	148.7	154.2	-64.2	166.3	-179.6	136.7	0	121.7
356	G	26.4	Very low	28.6	Very low	70 Å²	70	137.7 Å²	137.7	72%	0.722	75%	0.745	S	S	*	*			cis	150.8	148.7	-6.6	0	0	0	0	0	113.9
357	R	29.9	Very low	28.6	Very low	211 Å²	211	137.6 Å²	137.6	80%	0.796	75%	0.748	S	S	*	*			trans	70	124.6	172.8	-78.2	-175.6	171.7	-100.5	-14.6	117.1
358	E	26	Very low	29	Very low	137 Å²	137	140.2 Å²	140.2	64%	0.64	76%	0.755	S	S	*	*				76.5	149.6	97.2	-68.4	172.8	167.6	0	0	113.7
359	E	26.8	Very low	29.2	Very low	145 Å²	145	137.6 Å²	137.6	68%	0.678	75%	0.753	S	S	*	*			cis	-160.5	166	0.3	-120.5	-82.1	67.7	0	0	109.3
360	L	28	Very low	29.6	Very low	151 Å²	151	140.5 Å²	140.5	79%	0.791	76%	0.758	S	S	*	*			trans	49.8	142.5	160.3	-58.8	177	0	0	0	122.9
361	G	25.6	Very low	29.6	Very low	74 Å²	74	142.1 Å²	142.1	76%	0.763	77%	0.769	S	S	*	*			trans	124.6	117.2	133.9	0	0	0	0	0	117.6
362	P	42.1	Very low	30	Very low	121 Å²	121	139.6 Å²	139.6	79%	0.786	77%	0.769	S	S	*	*			trans	-108.6	145.2	174.3	38	-29.5	0	0	0	113.9
363	E	25.1	Very low	29.4	Very low	191 Å²	191	139.2 Å²	139.2	89%	0.893	77%	0.774	S	S	*	*			trans	-169.2	122.4	146.1	-106.5	159.7	-154.3	0	0	106.7
364	S	24.4	Very low	30	Very low	96 Å²	96	136.9 Å²	136.9	67%	0.671	77%	0.774	S	S	*	*				94.7	109.3	71.9	-172.6	0	0	0	0	112.2
365	S	26.2	Very low	30.2	Very low	100 Å²	100	134.7 Å²	134.7	70%	0.699	78%	0.778	S	S	*	*			trans	58.2	113.5	144.7	-43	0	0	0	0	119.8
366	H	30.7	Very low	30.2	Very low	190 Å²	190	132.8 Å²	132.8	88%	0.88	78%	0.781	S	S	*	*				-157.1	145.1	114.9	-113.4	-71.9	0	0	0	112.2
367	E	28.9	Very low	30.5	Very low	175 Å²	175	141.1 Å²	141.1	82%	0.818	79%	0.791	S	S	*	*			trans	-86	141.6	-176.7	-57.9	160.2	115.2	0	0	112.3
368	V	33.2	Very low	30.7	Very low	143 Å²	143	139.9 Å²	139.9	87%	0.867	79%	0.794	S	S	*	*			trans	-143.3	112	148	-178.1	0	0	0	0	108.1
369	E	28.4	Very low	31.2	Very low	183 Å²	183	137.6 Å²	137.6	86%	0.855	79%	0.786	S	S	*	*			trans	-78.5	140.9	163.8	-68	-167.1	121.5	0	0	110.6
370	I	33.6	Very low	31.9	Very low	162 Å²	162	135.7 Å²	135.7	83%	0.831	79%	0.786	S	S	*	*			trans	-160	142	136.8	-108.4	157.4	0	0	0	109.2
371	P	38.1	Very low	32.7	Very low	127 Å²	127	131.7 Å²	131.7	83%	0.825	77%	0.771	S	S	*	*			trans	-99.7	158.4	-157.4	37.8	-36.8	0	0	0	115
372	G	30.5	Very low	33.6	Very low	75 Å²	75	135.4 Å²	135.4	77%	0.773	77%	0.768	S	S	*	*			trans	174.6	67.2	172.6	0	0	0	0	0	116.1
373	A	32.1	Very low	33.6	Very low	100 Å²	100	133.1 Å²	133.1	83%	0.826	76%	0.76	S	S	*	*			trans	-78.7	150.2	166.4	0	0	0	0	0	111.3
374	P	36.5	Very low	34.7	Very low	123 Å²	123	129.8 Å²	129.8	80%	0.799	75%	0.747	S	S	*	*				-133.5	115.5	126.8	34.4	-24.5	0	0	0	113.5	T376	P374-T376 PolarHBondContact O-N 2.92Å
375	A	32.7	Very low	35.9	Very low	80 Å²	80	132.7 Å²	132.7	66%	0.661	75%	0.75	S	S	*	*			trans	19.2	93.6	152	0	0	0	0	0	118.8
376	T	29.7	Very low	36.9	Very low	134 Å²	134	131.4 Å²	131.4	82%	0.822	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-67.4	132.4	147.4	45.4	0	0	0	0	109.4	P374	P374-T376 PolarHBondContact O-N 2.92Å
377	W	31.2	Very low	38	Very low	246 Å²	246	127.6 Å²	127.6	93%	0.932	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-83	116.9	-176.1	-66.2	55.3	0	0	0	109.9
378	E	34	Very low	39.4	Very low	185 Å²	185	126.7 Å²	126.7	86%	0.864	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-76.5	138.7	177.5	-64.9	-153.7	131.4	0	0	112.5	P380	E378-P380 WeakPolarHBondContact O-CD 3.14Å
379	D	37.6	Very low	40.9	Very low	89 Å²	89	126.6 Å²	126.6	48%	0.476	70%	0.703	S	S	.	*	P	Polyproline II helix	trans	-74	119.3	-176.1	173.8	10.4	0	0	0	111.9	S381 Q382	D379-S381 PolarHBondContact O-N 3.45Å; D379-S381 WeakPolarHBondContact OD1-CB 3.34Å; D379-S381 PolarHBondContact OD1-N 2.99Å; D379-S381 PolarHBondContact OD1-OG 3.32Å; D379-S381 VanDerWaalsContact OD2-CB 3.32Å; D379-S381 WeakPolarHBondContact OD2-CB 3.17Å; D379-S381 PolarHBondContact OD2-OG 2.94Å; D379-Q382 PolarHBondContact O-N 3.48Å
380	P	41.1	Very low	43.2	Very low	105 Å²	105	121.9 Å²	121.9	68%	0.682	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.1	-17.5	176.7	-26.1	35.7	0	0	0	115.2	E378 Q382 A383	E378-P380 WeakPolarHBondContact O-CD 3.14Å; P380-Q382 VanDerWaalsContact C-N 3.32Å; P380-Q382 PolarHBondContact O-N 3.32Å; P380-A383 PolarHBondContact O-N 3.03Å
381	S	45.4	Very low	45.6	Very low	67 Å²	67	116.8 Å²	116.8	47%	0.469	66%	0.66	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.3	-36.8	179.9	-52.3	0	0	0	0	112.8	D379 A383 L384	D379-S381 PolarHBondContact O-N 3.45Å; D379-S381 WeakPolarHBondContact OD1-CB 3.34Å; D379-S381 PolarHBondContact OD1-N 2.99Å; D379-S381 PolarHBondContact OD1-OG 3.32Å; D379-S381 VanDerWaalsContact OD2-CB 3.32Å; D379-S381 WeakPolarHBondContact OD2-CB 3.17Å; D379-S381 PolarHBondContact OD2-OG 2.94Å; S381-A383 VanDerWaalsContact C-N 3.34Å; S381-A383 PolarHBondContact O-N 3.39Å; S381-L384 PolarHBondContact O-N 3.41Å
382	Q	44.6	Very low	47.9	Very low	151 Å²	151	110.8 Å²	110.8	71%	0.706	62%	0.621	S	S	*	*	H	α-helix	trans	-69	-32.8	-176.8	-59.1	-164.9	22.3	0	0	112.4	D379 P380 L384 Q385	D379-Q382 PolarHBondContact O-N 3.48Å; P380-Q382 VanDerWaalsContact C-N 3.32Å; P380-Q382 PolarHBondContact O-N 3.32Å; Q382-L384 PolarHBondContact O-N 2.86Å; Q382-Q385 WeakPolarHBondContact O-CB 3.36Å; Q382-Q385 PolarHBondContact O-N 3.49Å; Q382-Q385 VanDerWaalsContact O-N 3.15Å
383	A	42.5	Very low	50.4	Low	73 Å²	73	114 Å²	114	60%	0.603	62%	0.616	S	S	*	*	H	α-helix	trans	-65.9	-18.6	177.3	0	0	0	0	0	113.8	P380 S381 S386	P380-A383 PolarHBondContact O-N 3.03Å; S381-A383 VanDerWaalsContact C-N 3.34Å; S381-A383 PolarHBondContact O-N 3.39Å; A383-S386 PolarHBondContact O-OG 3.43Å
384	L	47.1	Very low	52.7	Low	121 Å²	121	115.6 Å²	115.6	63%	0.634	61%	0.608	S	S	*	*	H	α-helix	trans	-87.3	-20.4	175.3	-81.5	166.1	0	0	0	113.7	S381 Q382	S381-L384 PolarHBondContact O-N 3.41Å; Q382-L384 PolarHBondContact O-N 2.86Å
385	Q	49.2	Very low	55	Low	157 Å²	157	111.9 Å²	111.9	73%	0.734	58%	0.584	S	S	*	*	H	α-helix	trans	-71	-41.6	179.8	-137.9	83.6	-24.2	0	0	111.2	Q382 Q387	Q382-Q385 WeakPolarHBondContact O-CB 3.36Å; Q382-Q385 PolarHBondContact O-N 3.49Å; Q382-Q385 VanDerWaalsContact O-N 3.15Å; Q385-Q387 PolarHBondContact O-N 2.9Å; Q385-Q387 VanDerWaalsContact O-N 3.16Å
386	S	48.1	Very low	57.3	Low	74 Å²	74	110.8 Å²	110.8	52%	0.517	58%	0.581	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.2	-13.9	-173.4	62.2	0	0	0	0	115.1	A383 Q389	A383-S386 PolarHBondContact O-OG 3.43Å; S386-Q389 VanDerWaalsContact O-CG 3.31Å; S386-Q389 WeakPolarHBondContact O-CG 3.45Å; S386-Q389 PolarHBondContact O-NE2 3.44Å
387	Q	54	Low	59.9	Low	110 Å²	110	109.5 Å²	109.5	51%	0.514	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.7	17.3	-177.2	-148.6	-170.8	65.4	0	0	114.3	Q385	Q385-Q387 PolarHBondContact O-N 2.9Å; Q385-Q387 VanDerWaalsContact O-N 3.16Å
388	R	58.1	Low	62.4	Low	155 Å²	155	101.1 Å²	101.1	59%	0.585	54%	0.542	S	S	*	.			trans	-127.3	39.7	-176.7	-64	-170.2	-173.4	-175.9	4.2	113.8	Y390 P398	R388-Y390 VanDerWaalsContact C-N 3.26Å; R388-Y390 PolarHBondContact O-N 3.08Å; R388-Y390 VanDerWaalsContact O-N 3.1Å; R388-P398 HydrophobicContact CB-CB 4.24Å
389	Q	65.4	Low	64.8	Low	142 Å²	142	94.5 Å²	94.5	66%	0.664	51%	0.51	S	S	*	.			trans	-66.1	-13.5	-164.3	-62.4	168.9	0.2	0	0	116.2	S386	S386-Q389 VanDerWaalsContact O-CG 3.31Å; S386-Q389 WeakPolarHBondContact O-CG 3.45Å; S386-Q389 PolarHBondContact O-NE2 3.44Å
390	Y	76.7	Confident	67	Low	84 Å²	84	96 Å²	96	33%	0.329	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	90	-169.8	-60.1	-82.5	0	0	0	111.5	R388 F399 P402	R388-Y390 VanDerWaalsContact C-N 3.26Å; R388-Y390 PolarHBondContact O-N 3.08Å; R388-Y390 VanDerWaalsContact O-N 3.1Å; Y390-F399 PolarHBondContact N-O 2.58Å; Y390-F399 WeakPolarHBondContact O-CB 3.14Å; Y390-F399 WeakPolarHBondContact O-CD2 3.07Å; Y390-F399 PolarHBondContact O-N 3.05Å; Y390-P402 HydrophobicContact CD1-CB 3.79Å; Y390-P402 HydrophobicContact CD1-CG 4.46Å; Y390-P402 HydrophobicContact CE1-CB 3.78Å; Y390-P402 HydrophobicContact CE1-CG 4.09Å; Y390-P402 HydrophobicContact CG-CB 4.34Å
391	A	84.1	Confident	69	Low	55 Å²	55	96.1 Å²	96.1	46%	0.455	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	151.6	175.4	0	0	0	0	0	112.4	K397 L405	A391-K397 CarbonylContact C-O 3.52Å; A391-K397 WeakPolarHBondContact CA-O 3.19Å; A391-L405 WeakPolarHBondContact O-CD2 3.42Å
392	C	86.6	Confident	70.8	Confident	1 Å²	1	96.1 Å²	96.1	1%	0.007	50%	0.502	C	S	.	.			trans	-93.7	115.4	175.2	-173.6	0	0	0	0	111.7	M394 C395 G396 K397 F399 L405	C392-M394 PolarHBondContact O-N 3.09Å; C392-M394 VanDerWaalsContact O-N 3.13Å; C392-C395 PolarHBondContact O-N 3.16Å; C392-C395 VanDerWaalsContact O-N 3.09Å; C392-G396 WeakPolarHBondContact O-CA 3.45Å; C392-G396 PolarHBondContact O-N 2.87Å; C392-K397 PolarHBondContact N-O 2.8Å; C392-F399 HydrophobicContact CB-CE2 4.19Å; C392-L405 VanDerWaalsContact CA-CD1 3.46Å; C392-L405 HydrophobicContact CB-CD1 3.43Å; C392-L405 VanDerWaalsContact CB-CD1 3.43Å
393	E	82.1	Confident	72.6	Confident	143 Å²	143	92.7 Å²	92.7	67%	0.668	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-38.6	-179.8	-52	94.7	-87.2	0	0	112.7	C395 K409	E393-C395 VanDerWaalsContact C-N 3.29Å; E393-C395 PolarHBondContact O-N 2.69Å; E393-K409 WeakPolarHBondContact OE1-CE 3.35Å; E393-K409 IonicContact OE1-NZ 3.76Å; E393-K409 PolarHBondContact OE1-NZ 2.98Å; E393-K409 IonicContact OE2-NZ 3.89Å; E393-K409 PolarHBondContact OE2-NZ 2.87Å
394	M	80.6	Confident	74.5	Confident	133 Å²	133	92.8 Å²	92.8	66%	0.655	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-11.5	-176.2	-63.2	-59.5	-65.2	0	0	115.1	C392	C392-M394 PolarHBondContact O-N 3.09Å; C392-M394 VanDerWaalsContact O-N 3.13Å
395	C	84.6	Confident	76.4	Confident	44 Å²	44	88 Å²	88	30%	0.297	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-158.3	8.3	-176.9	70.2	0	0	0	0	116.9	C392 E393 K397 H408 H412	C392-C395 PolarHBondContact O-N 3.16Å; C392-C395 VanDerWaalsContact O-N 3.09Å; E393-C395 VanDerWaalsContact C-N 3.29Å; E393-C395 PolarHBondContact O-N 2.69Å; C395-K397 PolarHBondContact O-N 3.31Å; C395-K397 VanDerWaalsContact O-N 3.07Å; C395-H408 PolarHBondContact SG-NE2 3.02Å; C395-H412 WeakPolarHBondContact CB-NE2 3.43Å
396	G	81.8	Confident	77.9	Confident	58 Å²	58	84 Å²	84	60%	0.598	44%	0.442	S	S	*	.			trans	67.7	0.3	178.6	0	0	0	0	0	116.2	C392 P398	C392-G396 WeakPolarHBondContact O-CA 3.45Å; C392-G396 PolarHBondContact O-N 2.87Å; G396-P398 WeakPolarHBondContact O-CD 3.29Å
397	K	82.9	Confident	79.6	Confident	107 Å²	107	83.1 Å²	83.1	47%	0.465	43%	0.43	S	S	.	.			trans	-71.7	127.8	-173.1	-71.9	175.4	-168.9	157.6	0	111.8	A391 C392 C395 F399	A391-K397 CarbonylContact C-O 3.52Å; A391-K397 WeakPolarHBondContact CA-O 3.19Å; C392-K397 PolarHBondContact N-O 2.8Å; C395-K397 PolarHBondContact O-N 3.31Å; C395-K397 VanDerWaalsContact O-N 3.07Å; K397-F399 HydrophobicContact CB-CE2 3.78Å; K397-F399 HydrophobicContact CB-CZ 4.09Å; K397-F399 VanDerWaalsContact O-CD2 3.27Å; K397-F399 WeakPolarHBondContact O-CD2 3.31Å; K397-F399 WeakPolarHBondContact O-CE2 3.32Å
398	P	83.3	Confident	81.1	Confident	70 Å²	70	79.2 Å²	79.2	46%	0.455	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	141.6	178	33	-33.9	0	0	0	112.6	R388 G396	R388-P398 HydrophobicContact CB-CB 4.24Å; G396-P398 WeakPolarHBondContact O-CD 3.29Å
399	F	85.4	Confident	82.3	Confident	46 Å²	46	74.9 Å²	74.9	20%	0.202	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	150.6	177.4	-62.2	-89.5	0	0	0	110.8	Y390 C392 K397 N404 L405 H408	Y390-F399 PolarHBondContact N-O 2.58Å; Y390-F399 WeakPolarHBondContact O-CB 3.14Å; Y390-F399 WeakPolarHBondContact O-CD2 3.07Å; Y390-F399 PolarHBondContact O-N 3.05Å; C392-F399 HydrophobicContact CB-CE2 4.19Å; K397-F399 HydrophobicContact CB-CE2 3.78Å; K397-F399 HydrophobicContact CB-CZ 4.09Å; K397-F399 VanDerWaalsContact O-CD2 3.27Å; K397-F399 WeakPolarHBondContact O-CD2 3.31Å; K397-F399 WeakPolarHBondContact O-CE2 3.32Å; F399-N404 HydrophobicContact CB-CB 4.44Å; F399-N404 HydrophobicContact CD1-CB 4.01Å; F399-L405 HydrophobicContact CB-CB 4.21Å; F399-L405 HydrophobicContact CD2-CB 4Å; F399-L405 HydrophobicContact CD2-CD1 3.99Å; F399-L405 HydrophobicContact CE2-CD1 4.24Å; F399-L405 HydrophobicContact CG-CB 4.19Å; F399-H408 HydrophobicContact CE1-CB 4.03Å; F399-H408 HydrophobicContact CE2-CB 4.03Å; F399-H408 AromaticContact CE2-CD2 3.48Å; F399-H408 VanDerWaalsContact CE2-CD2 3.48Å; F399-H408 WeakPolarHBondContact CE2-CD2 3.48Å; F399-H408 AromaticContact CE2-CG 4Å; F399-H408 HydrophobicContact CZ-CB 3.54Å; F399-H408 AromaticContact CZ-CD2 3.28Å; F399-H408 WeakPolarHBondContact CZ-CD2 3.45Å; F399-H408 AromaticContact CZ-CG 3.45Å; F399-H408 VanDerWaalsContact CZ-CG 3.45Å
400	K	83.9	Confident	83.2	Confident	119 Å²	119	71.1 Å²	71.1	52%	0.517	38%	0.377	S	S	.	.	S	Bend	trans	-79	-19.9	177.5	-65.1	-158.5	175.2	-161.4	0	114.2
401	H	82.8	Confident	83.5	Confident	108 Å²	108	70.8 Å²	70.8	50%	0.5	39%	0.387	S	S	.	.	S	Bend	trans	-142.7	145	-175.2	-56.9	-60.6	0	0	0	110.8	S403 N404 L405	H401-S403 VanDerWaalsContact C-N 3.3Å; H401-S403 PolarHBondContact O-N 3.09Å; H401-N404 PolarHBondContact O-N 2.79Å; H401-N404 VanDerWaalsContact O-N 3.16Å; H401-L405 PolarHBondContact O-N 2.87Å
402	P	83.2	Confident	83.4	Confident	68 Å²	68	72.6 Å²	72.6	44%	0.442	39%	0.386	S	S	.	.	H	α-helix	trans	-64.5	-33.1	-178.4	24.8	-32.9	0	0	0	112.4	Y390 N404 L405 E406	Y390-P402 HydrophobicContact CD1-CB 3.79Å; Y390-P402 HydrophobicContact CD1-CG 4.46Å; Y390-P402 HydrophobicContact CE1-CB 3.78Å; Y390-P402 HydrophobicContact CE1-CG 4.09Å; Y390-P402 HydrophobicContact CG-CB 4.34Å; P402-N404 VanDerWaalsContact C-N 3.28Å; P402-N404 PolarHBondContact O-N 3.13Å; P402-L405 WeakPolarHBondContact O-CB 3.24Å; P402-L405 PolarHBondContact O-N 2.79Å; P402-E406 WeakPolarHBondContact O-CB 3.48Å; P402-E406 PolarHBondContact O-N 2.94Å
403	S	81.9	Confident	83.1	Confident	79 Å²	79	76.6 Å²	76.6	55%	0.552	41%	0.411	S	S	*	.	H	α-helix	trans	-61	-33	175.5	52.7	0	0	0	0	113.7	H401 L407	H401-S403 VanDerWaalsContact C-N 3.3Å; H401-S403 PolarHBondContact O-N 3.09Å; S403-L407 VanDerWaalsContact O-CB 3.26Å; S403-L407 WeakPolarHBondContact O-CB 3.42Å; S403-L407 PolarHBondContact O-N 3.05Å
404	N	83.1	Confident	83.1	Confident	75 Å²	75	71.4 Å²	71.4	40%	0.401	40%	0.396	S	S	.	.	H	α-helix	trans	-78.5	-34.6	175.6	-72.4	-36.5	0	0	0	112.1	F399 H401 P402 H408	F399-N404 HydrophobicContact CB-CB 4.44Å; F399-N404 HydrophobicContact CD1-CB 4.01Å; H401-N404 PolarHBondContact O-N 2.79Å; H401-N404 VanDerWaalsContact O-N 3.16Å; P402-N404 VanDerWaalsContact C-N 3.28Å; P402-N404 PolarHBondContact O-N 3.13Å; N404-H408 WeakPolarHBondContact O-CB 3.35Å; N404-H408 PolarHBondContact O-N 3.09Å
405	L	85.8	Confident	83	Confident	19 Å²	19	69.5 Å²	69.5	10%	0.099	39%	0.385	C	S	.	.	H	α-helix	trans	-64	-48.2	170.7	166.7	59.4	0	0	0	110.9	A391 C392 F399 H401 P402 L407 H408 K409	A391-L405 WeakPolarHBondContact O-CD2 3.42Å; C392-L405 VanDerWaalsContact CA-CD1 3.46Å; C392-L405 HydrophobicContact CB-CD1 3.43Å; C392-L405 VanDerWaalsContact CB-CD1 3.43Å; F399-L405 HydrophobicContact CB-CB 4.21Å; F399-L405 HydrophobicContact CD2-CB 4Å; F399-L405 HydrophobicContact CD2-CD1 3.99Å; F399-L405 HydrophobicContact CE2-CD1 4.24Å; F399-L405 HydrophobicContact CG-CB 4.19Å; H401-L405 PolarHBondContact O-N 2.87Å; P402-L405 WeakPolarHBondContact O-CB 3.24Å; P402-L405 PolarHBondContact O-N 2.79Å; L405-L407 PolarHBondContact O-N 3.2Å; L405-H408 CarbonylContact O-C 3.56Å; L405-H408 WeakPolarHBondContact O-CA 3.43Å; L405-H408 VanDerWaalsContact O-CB 3.31Å; L405-H408 WeakPolarHBondContact O-CB 3.41Å; L405-H408 PolarHBondContact O-N 3.05Å; L405-K409 HydrophobicContact CD1-CG 4.21Å; L405-K409 PolarHBondContact O-N 3.17Å
406	E	81.6	Confident	83.1	Confident	75 Å²	75	72.5 Å²	72.5	35%	0.35	39%	0.393	S	S	.	.	H	α-helix	trans	-59.5	-46.8	178.1	169	50.1	-155.6	0	0	111.6	P402 H408 K409 R410	P402-E406 WeakPolarHBondContact O-CB 3.48Å; P402-E406 PolarHBondContact O-N 2.94Å; E406-H408 PolarHBondContact O-N 3.32Å; E406-K409 PolarHBondContact O-N 3.12Å; E406-K409 VanDerWaalsContact O-N 3.09Å; E406-R410 PolarHBondContact O-N 3.38Å; E406-R410 VanDerWaalsContact O-N 3.16Å; E406-R410 IonicContact OE1-CZ 3.22Å; E406-R410 IonicContact OE1-NE 2.69Å; E406-R410 PolarHBondContact OE1-NE 3.07Å; E406-R410 IonicContact OE1-NH2 2.85Å; E406-R410 PolarHBondContact OE1-NH2 2.83Å
407	L	83.7	Confident	83.2	Confident	54 Å²	54	73.5 Å²	73.5	28%	0.283	39%	0.389	S	S	.	.	H	α-helix	trans	-60.2	-27.8	171.9	178	56.2	0	0	0	113	S403 L405 Q429	S403-L407 VanDerWaalsContact O-CB 3.26Å; S403-L407 WeakPolarHBondContact O-CB 3.42Å; S403-L407 PolarHBondContact O-N 3.05Å; L405-L407 PolarHBondContact O-N 3.2Å; L407-Q429 HydrophobicContact CD1-CG 3.45Å; L407-Q429 VanDerWaalsContact CD1-CG 3.45Å; L407-Q429 HydrophobicContact CD2-CG 4.17Å; L407-Q429 HydrophobicContact CG-CG 4.43Å
408	H	84.8	Confident	83.4	Confident	29 Å²	29	71.7 Å²	71.7	13%	0.134	38%	0.381	C	S	.	.	H	α-helix	trans	-78.9	-37.4	171.8	-173.6	41.9	0	0	0	113.2	C395 F399 N404 L405 E406 R410 S411	C395-H408 PolarHBondContact SG-NE2 3.02Å; F399-H408 HydrophobicContact CE1-CB 4.03Å; F399-H408 HydrophobicContact CE2-CB 4.03Å; F399-H408 AromaticContact CE2-CD2 3.48Å; F399-H408 VanDerWaalsContact CE2-CD2 3.48Å; F399-H408 WeakPolarHBondContact CE2-CD2 3.48Å; F399-H408 AromaticContact CE2-CG 4Å; F399-H408 HydrophobicContact CZ-CB 3.54Å; F399-H408 AromaticContact CZ-CD2 3.28Å; F399-H408 WeakPolarHBondContact CZ-CD2 3.45Å; F399-H408 AromaticContact CZ-CG 3.45Å; F399-H408 VanDerWaalsContact CZ-CG 3.45Å; N404-H408 WeakPolarHBondContact O-CB 3.35Å; N404-H408 PolarHBondContact O-N 3.09Å; L405-H408 CarbonylContact O-C 3.56Å; L405-H408 WeakPolarHBondContact O-CA 3.43Å; L405-H408 VanDerWaalsContact O-CB 3.31Å; L405-H408 WeakPolarHBondContact O-CB 3.41Å; L405-H408 PolarHBondContact O-N 3.05Å; E406-H408 PolarHBondContact O-N 3.32Å; H408-R410 PolarHBondContact O-N 3.28Å; H408-S411 PolarHBondContact CE1-OG 2.97Å; H408-S411 VanDerWaalsContact CE1-OG 3.3Å; H408-S411 PolarHBondContact ND1-OG 3.37Å; H408-S411 WeakPolarHBondContact O-CA 3.46Å; H408-S411 WeakPolarHBondContact O-CB 3.48Å; H408-S411 PolarHBondContact O-N 2.79Å; H408-S411 PolarHBondContact O-OG 3.2Å
409	K	83.6	Confident	83.6	Confident	63 Å²	63	72.5 Å²	72.5	27%	0.274	38%	0.379	S	S	.	.	H	α-helix	trans	-55.9	-40.9	173.9	-71.9	-165.1	177	-165.1	0	111.2	E393 L405 E406 S411 H412 T413	E393-K409 WeakPolarHBondContact OE1-CE 3.35Å; E393-K409 IonicContact OE1-NZ 3.76Å; E393-K409 PolarHBondContact OE1-NZ 2.98Å; E393-K409 IonicContact OE2-NZ 3.89Å; E393-K409 PolarHBondContact OE2-NZ 2.87Å; L405-K409 HydrophobicContact CD1-CG 4.21Å; L405-K409 PolarHBondContact O-N 3.17Å; E406-K409 PolarHBondContact O-N 3.12Å; E406-K409 VanDerWaalsContact O-N 3.09Å; K409-S411 PolarHBondContact O-N 3.26Å; K409-S411 VanDerWaalsContact O-N 3.09Å; K409-H412 WeakPolarHBondContact O-CA 3.32Å; K409-H412 WeakPolarHBondContact O-CB 3.34Å; K409-H412 PolarHBondContact O-N 3.05Å; K409-T413 PolarHBondContact O-N 2.97Å
410	R	84.6	Confident	83.9	Confident	64 Å²	64	70.3 Å²	70.3	24%	0.242	37%	0.369	C	S	.	.	H	α-helix	trans	-59.7	-19.4	172.4	-63.3	175.9	-162.7	-179.9	0	115	E406 H408 T413 G414 E415	E406-R410 PolarHBondContact O-N 3.38Å; E406-R410 VanDerWaalsContact O-N 3.16Å; E406-R410 IonicContact OE1-CZ 3.22Å; E406-R410 IonicContact OE1-NE 2.69Å; E406-R410 PolarHBondContact OE1-NE 3.07Å; E406-R410 IonicContact OE1-NH2 2.85Å; E406-R410 PolarHBondContact OE1-NH2 2.83Å; H408-R410 PolarHBondContact O-N 3.28Å; R410-T413 WeakPolarHBondContact CA-OG1 3.5Å; R410-G414 WeakPolarHBondContact O-CA 3.39Å; R410-G414 PolarHBondContact O-N 3.08Å; R410-E415 HydrophobicContact CB-CB 4.34Å; R410-E415 HydrophobicContact CG-CB 4.24Å; R410-E415 PolarHBondContact O-N 2.86Å
411	S	82.5	Confident	84	Confident	77 Å²	77	72 Å²	72	54%	0.538	38%	0.384	S	S	.	.	H	α-helix	trans	-82.3	-14.7	172.7	75.7	0	0	0	0	113.9	H408 K409	H408-S411 PolarHBondContact CE1-OG 2.97Å; H408-S411 VanDerWaalsContact CE1-OG 3.3Å; H408-S411 PolarHBondContact ND1-OG 3.37Å; H408-S411 WeakPolarHBondContact O-CA 3.46Å; H408-S411 WeakPolarHBondContact O-CB 3.48Å; H408-S411 PolarHBondContact O-N 2.79Å; H408-S411 PolarHBondContact O-OG 3.2Å; K409-S411 PolarHBondContact O-N 3.26Å; K409-S411 VanDerWaalsContact O-N 3.09Å
412	H	82.1	Confident	84.2	Confident	92 Å²	92	71.8 Å²	71.8	43%	0.426	39%	0.386	S	S	.	.	H	α-helix	trans	-91.5	-49.2	169.6	-65.4	-75.3	0	0	0	111.7	C395 K409 G414	C395-H412 WeakPolarHBondContact CB-NE2 3.43Å; K409-H412 WeakPolarHBondContact O-CA 3.32Å; K409-H412 WeakPolarHBondContact O-CB 3.34Å; K409-H412 PolarHBondContact O-N 3.05Å; H412-G414 PolarHBondContact O-N 3.46Å
413	T	80.5	Confident	84.4	Confident	86 Å²	86	70.7 Å²	70.7	53%	0.528	38%	0.379	S	S	.	.	H	α-helix	trans	-70	-20.1	177.9	62.8	0	0	0	0	112.7	K409 R410 E415	K409-T413 PolarHBondContact O-N 2.97Å; R410-T413 WeakPolarHBondContact CA-OG1 3.5Å; T413-E415 WeakPolarHBondContact CB-OE1 3.38Å; T413-E415 WeakPolarHBondContact CG2-OE1 3.46Å; T413-E415 PolarHBondContact O-N 3.3Å; T413-E415 VanDerWaalsContact OG1-CD 3.24Å; T413-E415 WeakPolarHBondContact OG1-CG 3.47Å; T413-E415 PolarHBondContact OG1-OE1 3.43Å
414	G	81.8	Confident	84.5	Confident	34 Å²	34	69 Å²	69	35%	0.351	37%	0.374	S	S	.	.			trans	78.8	5.4	178.5	0	0	0	0	0	114.2	R410 H412 K416	R410-G414 WeakPolarHBondContact O-CA 3.39Å; R410-G414 PolarHBondContact O-N 3.08Å; H412-G414 PolarHBondContact O-N 3.46Å; G414-K416 WeakPolarHBondContact O-CG 3.31Å; G414-K416 PolarHBondContact O-NZ 3.17Å
415	E	80.1	Confident	84.6	Confident	92 Å²	92	71.1 Å²	71.1	43%	0.43	38%	0.38	S	S	.	.			trans	-55.6	137.6	179.1	-76.4	163.4	-117.5	0	0	113.3	R410 T413	R410-E415 HydrophobicContact CB-CB 4.34Å; R410-E415 HydrophobicContact CG-CB 4.24Å; R410-E415 PolarHBondContact O-N 2.86Å; T413-E415 WeakPolarHBondContact CB-OE1 3.38Å; T413-E415 WeakPolarHBondContact CG2-OE1 3.46Å; T413-E415 PolarHBondContact O-N 3.3Å; T413-E415 VanDerWaalsContact OG1-CD 3.24Å; T413-E415 WeakPolarHBondContact OG1-CG 3.47Å; T413-E415 PolarHBondContact OG1-OE1 3.43Å
416	K	85.4	Confident	84.7	Confident	107 Å²	107	74.7 Å²	74.7	47%	0.465	40%	0.396	S	S	.	.			trans	-140.9	73.8	-178.1	-66.2	177.1	-160.2	78.3	0	110.8	G414 F418 H426 F427	G414-K416 WeakPolarHBondContact O-CG 3.31Å; G414-K416 PolarHBondContact O-NZ 3.17Å; K416-F418 PolarHBondContact O-N 3.49Å; K416-H426 HydrophobicContact CB-CB 3.64Å; K416-H426 HydrophobicContact CD-CB 4.26Å; K416-H426 WeakPolarHBondContact CD-O 3.46Å; K416-F427 CarbonylContact C-O 3.57Å; K416-F427 WeakPolarHBondContact CA-O 3.49Å
417	P	85.4	Confident	85	Confident	80 Å²	80	73.2 Å²	73.2	52%	0.519	39%	0.388	S	S	.	.			trans	-65.2	-11.2	-171.3	-23.1	35.3	0	0	0	115.7
418	F	85.9	Confident	85	Confident	68 Å²	68	72.4 Å²	72.4	30%	0.298	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	94.5	-172.1	-57.4	-79.4	0	0	0	111.2	K416 H426 F427 Q429 A430 L433	K416-F418 PolarHBondContact O-N 3.49Å; F418-H426 CarbonylContact O-C 3.52Å; F418-H426 WeakPolarHBondContact O-CA 3.46Å; F418-F427 HydrophobicContact CB-CB 4.29Å; F418-F427 WeakPolarHBondContact CB-O 3.22Å; F418-F427 WeakPolarHBondContact CD2-O 3.44Å; F418-F427 PolarHBondContact N-O 3.05Å; F418-F427 PolarHBondContact O-N 3.04Å; F418-Q429 VanDerWaalsContact CD2-C 3.44Å; F418-A430 HydrophobicContact CD1-CB 4.02Å; F418-A430 HydrophobicContact CE1-CB 3.79Å; F418-A430 HydrophobicContact CZ-CB 4.09Å; F418-L433 HydrophobicContact CB-CB 4.14Å; F418-L433 HydrophobicContact CB-CD2 3.92Å
419	E	88.8	Confident	85.1	Confident	87 Å²	87	74.4 Å²	74.4	41%	0.407	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	148.3	175.7	-176.9	166.3	-146.5	0	0	113.2	G424 K425 H426 L433	E419-G424 VanDerWaalsContact OE1-CA 3.26Å; E419-G424 WeakPolarHBondContact OE1-CA 3.48Å; E419-K425 CarbonylContact C-O 3.6Å; E419-H426 IonicContact OE1-CE1 2.6Å; E419-H426 PolarHBondContact OE1-CE1 2.85Å; E419-H426 IonicContact OE1-ND1 2.67Å; E419-H426 IonicContact OE2-CE1 3.67Å; E419-L433 WeakPolarHBondContact O-CD1 3.08Å; E419-L433 VanDerWaalsContact O-CD2 3.25Å; E419-L433 WeakPolarHBondContact O-CD2 3.47Å
420	C	90.3	Very high	85.1	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	101	167	-177.7	0	0	0	0	111.2	I422 C423 G424 K425 F427 L433 H436	C420-I422 PolarHBondContact O-N 3.34Å; C420-C423 PolarHBondContact O-N 2.81Å; C420-G424 PolarHBondContact O-N 3.14Å; C420-K425 WeakPolarHBondContact CB-O 3.14Å; C420-K425 PolarHBondContact N-O 2.98Å; C420-F427 HydrophobicContact CB-CE2 4.26Å; C420-L433 HydrophobicContact CB-CD1 3.56Å; C420-H436 VanDerWaalsContact SG-CD2 3.57Å
421	N	86.5	Confident	85	Confident	155 Å²	155	72.8 Å²	72.8	83%	0.829	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-15	-179.3	-51.9	12.3	0	0	0	114.8
422	I	86.4	Confident	85.2	Confident	103 Å²	103	72.2 Å²	72.2	53%	0.528	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-19.7	-180	-52.7	174	0	0	0	112	C420 L437 H440	C420-I422 PolarHBondContact O-N 3.34Å; I422-L437 HydrophobicContact CD1-CD2 4.07Å; I422-H440 HydrophobicContact CD1-CB 3.71Å; I422-H440 HydrophobicContact CG2-CB 4.29Å; I422-H440 WeakPolarHBondContact CG2-CE1 3.39Å; I422-H440 VanDerWaalsContact CG2-ND1 3.34Å; I422-H440 WeakPolarHBondContact CG2-ND1 3.47Å
423	C	86.9	Confident	85.5	Confident	45 Å²	45	69 Å²	69	30%	0.304	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-153.5	18.8	-179.5	69.7	0	0	0	0	117.1	C420 K425 H436 H440	C420-C423 PolarHBondContact O-N 2.81Å; C423-K425 WeakPolarHBondContact O-CG 3.41Å; C423-K425 PolarHBondContact O-N 3.01Å; C423-H436 PolarHBondContact SG-NE2 2.74Å; C423-H436 VanDerWaalsContact SG-NE2 3.44Å; C423-H440 WeakPolarHBondContact CB-NE2 3.27Å; C423-H440 PolarHBondContact SG-NE2 3.48Å
424	G	84.5	Confident	85.7	Confident	43 Å²	43	70 Å²	70	44%	0.443	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.9	12.5	174.9	0	0	0	0	0	115.2	E419 C420 H426	E419-G424 VanDerWaalsContact OE1-CA 3.26Å; E419-G424 WeakPolarHBondContact OE1-CA 3.48Å; C420-G424 PolarHBondContact O-N 3.14Å; G424-H426 PolarHBondContact O-ND1 3.44Å
425	K	86.6	Confident	85.8	Confident	120 Å²	120	70.9 Å²	70.9	52%	0.522	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	121.5	-172	-67.2	-160.9	179.4	-155	0	111.4	E419 C420 C423 F427	E419-K425 CarbonylContact C-O 3.6Å; C420-K425 WeakPolarHBondContact CB-O 3.14Å; C420-K425 PolarHBondContact N-O 2.98Å; C423-K425 WeakPolarHBondContact O-CG 3.41Å; C423-K425 PolarHBondContact O-N 3.01Å; K425-F427 HydrophobicContact CB-CE2 3.91Å; K425-F427 HydrophobicContact CB-CZ 4.03Å; K425-F427 WeakPolarHBondContact O-CD2 3.39Å; K425-F427 WeakPolarHBondContact O-CE2 3.42Å
426	H	87.1	Confident	86.2	Confident	95 Å²	95	67.7 Å²	67.7	44%	0.44	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	142.5	-175.8	-69.1	59	0	0	0	111.8	K416 F418 E419 G424	K416-H426 HydrophobicContact CB-CB 3.64Å; K416-H426 HydrophobicContact CD-CB 4.26Å; K416-H426 WeakPolarHBondContact CD-O 3.46Å; F418-H426 CarbonylContact O-C 3.52Å; F418-H426 WeakPolarHBondContact O-CA 3.46Å; E419-H426 IonicContact OE1-CE1 2.6Å; E419-H426 PolarHBondContact OE1-CE1 2.85Å; E419-H426 IonicContact OE1-ND1 2.67Å; E419-H426 IonicContact OE2-CE1 3.67Å; G424-H426 PolarHBondContact O-ND1 3.44Å
427	F	86.8	Confident	86.2	Confident	43 Å²	43	64.9 Å²	64.9	19%	0.189	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	149.7	-179.9	-61.9	-81.7	0	0	0	111.7	K416 F418 C420 K425 Q429 N432 L433 H436	K416-F427 CarbonylContact C-O 3.57Å; K416-F427 WeakPolarHBondContact CA-O 3.49Å; F418-F427 HydrophobicContact CB-CB 4.29Å; F418-F427 WeakPolarHBondContact CB-O 3.22Å; F418-F427 WeakPolarHBondContact CD2-O 3.44Å; F418-F427 PolarHBondContact N-O 3.05Å; F418-F427 PolarHBondContact O-N 3.04Å; C420-F427 HydrophobicContact CB-CE2 4.26Å; K425-F427 HydrophobicContact CB-CE2 3.91Å; K425-F427 HydrophobicContact CB-CZ 4.03Å; K425-F427 WeakPolarHBondContact O-CD2 3.39Å; K425-F427 WeakPolarHBondContact O-CE2 3.42Å; F427-Q429 VanDerWaalsContact C-N 3.34Å; F427-N432 HydrophobicContact CB-CB 4.34Å; F427-N432 HydrophobicContact CD1-CB 4.11Å; F427-N432 HydrophobicContact CG-CB 4.46Å; F427-L433 HydrophobicContact CB-CB 4.38Å; F427-L433 HydrophobicContact CD2-CB 4.08Å; F427-L433 HydrophobicContact CD2-CD1 3.97Å; F427-L433 HydrophobicContact CE2-CD1 4.31Å; F427-L433 HydrophobicContact CG-CB 4.42Å; F427-H436 HydrophobicContact CE1-CB 4.46Å; F427-H436 AromaticContact CE1-ND1 3.96Å; F427-H436 HydrophobicContact CE2-CB 4.09Å; F427-H436 AromaticContact CE2-CE1 3.99Å; F427-H436 AromaticContact CE2-CG 3.76Å; F427-H436 AromaticContact CE2-ND1 3.78Å; F427-H436 HydrophobicContact CZ-CB 3.98Å; F427-H436 AromaticContact CZ-CE1 3.52Å; F427-H436 AromaticContact CZ-CG 3.57Å; F427-H436 AromaticContact CZ-ND1 3.14Å; F427-H436 WeakPolarHBondContact CZ-ND1 3.29Å
428	S	85.4	Confident	86.2	Confident	37 Å²	37	63.8 Å²	63.8	26%	0.259	35%	0.347	S	S	.	.	S	Bend	trans	-83.8	-5.2	176.3	53.7	0	0	0	0	114.3
429	Q	85.9	Confident	86.1	Confident	71 Å²	71	67.4 Å²	67.4	33%	0.332	36%	0.359	S	S	.	.	S	Bend	trans	-143.1	138	-179.1	-61	172	16.5	0	0	111.2	L407 F418 F427 G431 N432 L433	L407-Q429 HydrophobicContact CD1-CG 3.45Å; L407-Q429 VanDerWaalsContact CD1-CG 3.45Å; L407-Q429 HydrophobicContact CD2-CG 4.17Å; L407-Q429 HydrophobicContact CG-CG 4.43Å; F418-Q429 VanDerWaalsContact CD2-C 3.44Å; F427-Q429 VanDerWaalsContact C-N 3.34Å; Q429-G431 VanDerWaalsContact C-N 3.3Å; Q429-G431 PolarHBondContact O-N 2.8Å; Q429-N432 HydrophobicContact CB-CB 4.21Å; Q429-N432 VanDerWaalsContact CD-ND2 3.29Å; Q429-N432 PolarHBondContact O-N 2.77Å; Q429-N432 VanDerWaalsContact O-N 3.11Å; Q429-N432 PolarHBondContact OE1-ND2 3.49Å; Q429-N432 VanDerWaalsContact OE1-ND2 3.08Å; Q429-L433 PolarHBondContact O-N 3.15Å; Q429-L433 VanDerWaalsContact O-N 3.12Å
430	A	83.8	Confident	85.8	Confident	48 Å²	48	67 Å²	67	40%	0.397	36%	0.357	S	S	.	.	H	α-helix	trans	-57	-39.7	173.3	0	0	0	0	0	112.9	F418 N432 L433 Q434	F418-A430 HydrophobicContact CD1-CB 4.02Å; F418-A430 HydrophobicContact CE1-CB 3.79Å; F418-A430 HydrophobicContact CZ-CB 4.09Å; A430-N432 VanDerWaalsContact C-N 3.29Å; A430-N432 PolarHBondContact O-N 3.29Å; A430-L433 WeakPolarHBondContact O-CB 3.25Å; A430-L433 PolarHBondContact O-N 2.78Å; A430-Q434 WeakPolarHBondContact O-CG 3.44Å; A430-Q434 PolarHBondContact O-N 3.19Å
431	G	83.4	Confident	85.5	Confident	45 Å²	45	70.4 Å²	70.4	46%	0.464	38%	0.381	S	S	.	.	H	α-helix	trans	-63.5	-31.8	176.8	0	0	0	0	0	114	Q429 T435	Q429-G431 VanDerWaalsContact C-N 3.3Å; Q429-G431 PolarHBondContact O-N 2.8Å; G431-T435 PolarHBondContact O-N 2.92Å; G431-T435 PolarHBondContact O-OG1 2.95Å
432	N	85.7	Confident	85.4	Confident	66 Å²	66	65.1 Å²	65.1	35%	0.353	36%	0.363	S	S	.	.	H	α-helix	trans	-75	-35.2	174.4	-69.7	-28.2	0	0	0	111.5	F427 Q429 A430 T435 H436	F427-N432 HydrophobicContact CB-CB 4.34Å; F427-N432 HydrophobicContact CD1-CB 4.11Å; F427-N432 HydrophobicContact CG-CB 4.46Å; Q429-N432 HydrophobicContact CB-CB 4.21Å; Q429-N432 VanDerWaalsContact CD-ND2 3.29Å; Q429-N432 PolarHBondContact O-N 2.77Å; Q429-N432 VanDerWaalsContact O-N 3.11Å; Q429-N432 PolarHBondContact OE1-ND2 3.49Å; Q429-N432 VanDerWaalsContact OE1-ND2 3.08Å; A430-N432 VanDerWaalsContact C-N 3.29Å; A430-N432 PolarHBondContact O-N 3.29Å; N432-T435 WeakPolarHBondContact CA-OG1 3.45Å; N432-T435 PolarHBondContact O-OG1 3.2Å; N432-H436 WeakPolarHBondContact O-CB 3.32Å; N432-H436 PolarHBondContact O-N 2.95Å
433	L	88.4	Confident	85.1	Confident	23 Å²	23	65.3 Å²	65.3	12%	0.12	36%	0.362	C	S	.	.	H	α-helix	trans	-64	-45.3	168.6	173.7	60.9	0	0	0	111.3	F418 E419 C420 F427 Q429 A430 H436 L437	F418-L433 HydrophobicContact CB-CB 4.14Å; F418-L433 HydrophobicContact CB-CD2 3.92Å; E419-L433 WeakPolarHBondContact O-CD1 3.08Å; E419-L433 VanDerWaalsContact O-CD2 3.25Å; E419-L433 WeakPolarHBondContact O-CD2 3.47Å; C420-L433 HydrophobicContact CB-CD1 3.56Å; F427-L433 HydrophobicContact CB-CB 4.38Å; F427-L433 HydrophobicContact CD2-CB 4.08Å; F427-L433 HydrophobicContact CD2-CD1 3.97Å; F427-L433 HydrophobicContact CE2-CD1 4.31Å; F427-L433 HydrophobicContact CG-CB 4.42Å; Q429-L433 PolarHBondContact O-N 3.15Å; Q429-L433 VanDerWaalsContact O-N 3.12Å; A430-L433 WeakPolarHBondContact O-CB 3.25Å; A430-L433 PolarHBondContact O-N 2.78Å; L433-H436 CarbonylContact O-C 3.6Å; L433-H436 WeakPolarHBondContact O-CA 3.46Å; L433-H436 VanDerWaalsContact O-CB 3.29Å; L433-H436 WeakPolarHBondContact O-CB 3.5Å; L433-H436 PolarHBondContact O-N 3.01Å; L433-H436 VanDerWaalsContact O-N 3.09Å; L433-L437 HydrophobicContact CD1-CD1 4.2Å; L433-L437 HydrophobicContact CD1-CD2 4.41Å; L433-L437 HydrophobicContact CD1-CG 4.01Å; L433-L437 HydrophobicContact CG-CD1 4.04Å; L433-L437 HydrophobicContact CG-CG 4.32Å; L433-L437 WeakPolarHBondContact O-CG 3.47Å; L433-L437 PolarHBondContact O-N 3.09Å
434	Q	84.6	Confident	85.1	Confident	108 Å²	108	67.9 Å²	67.9	51%	0.505	37%	0.368	S	S	.	.	H	α-helix	trans	-64.9	-45	-179.3	-73	-64.9	-10.2	0	0	112.8	A430 H436 L437 R438	A430-Q434 WeakPolarHBondContact O-CG 3.44Å; A430-Q434 PolarHBondContact O-N 3.19Å; Q434-H436 PolarHBondContact O-N 2.68Å; Q434-L437 PolarHBondContact O-N 2.77Å; Q434-R438 PolarHBondContact O-N 3.06Å
435	T	84.8	Confident	85.1	Confident	53 Å²	53	68.8 Å²	68.8	33%	0.325	37%	0.366	S	S	.	.	H	α-helix	trans	-65.4	-25.5	172.6	50.4	0	0	0	0	112.8	G431 N432	G431-T435 PolarHBondContact O-N 2.92Å; G431-T435 PolarHBondContact O-OG1 2.95Å; N432-T435 WeakPolarHBondContact CA-OG1 3.45Å; N432-T435 PolarHBondContact O-OG1 3.2Å
436	H	86.9	Confident	85.1	Confident	25 Å²	25	66.9 Å²	66.9	12%	0.116	36%	0.356	C	S	.	.	H	α-helix	trans	-73.9	-40.3	169.9	-177	105	0	0	0	113.3	C420 C423 F427 N432 L433 Q434 R438 R439 H440	C420-H436 VanDerWaalsContact SG-CD2 3.57Å; C423-H436 PolarHBondContact SG-NE2 2.74Å; C423-H436 VanDerWaalsContact SG-NE2 3.44Å; F427-H436 HydrophobicContact CE1-CB 4.46Å; F427-H436 AromaticContact CE1-ND1 3.96Å; F427-H436 HydrophobicContact CE2-CB 4.09Å; F427-H436 AromaticContact CE2-CE1 3.99Å; F427-H436 AromaticContact CE2-CG 3.76Å; F427-H436 AromaticContact CE2-ND1 3.78Å; F427-H436 HydrophobicContact CZ-CB 3.98Å; F427-H436 AromaticContact CZ-CE1 3.52Å; F427-H436 AromaticContact CZ-CG 3.57Å; F427-H436 AromaticContact CZ-ND1 3.14Å; F427-H436 WeakPolarHBondContact CZ-ND1 3.29Å; N432-H436 WeakPolarHBondContact O-CB 3.32Å; N432-H436 PolarHBondContact O-N 2.95Å; L433-H436 CarbonylContact O-C 3.6Å; L433-H436 WeakPolarHBondContact O-CA 3.46Å; L433-H436 VanDerWaalsContact O-CB 3.29Å; L433-H436 WeakPolarHBondContact O-CB 3.5Å; L433-H436 PolarHBondContact O-N 3.01Å; L433-H436 VanDerWaalsContact O-N 3.09Å; Q434-H436 PolarHBondContact O-N 2.68Å; H436-R438 VanDerWaalsContact C-N 3.29Å; H436-R438 PolarHBondContact O-N 3.35Å; H436-R439 PolarHBondContact CE1-NH2 2.69Å; H436-R439 PolarHBondContact NE2-NH2 2.71Å; H436-R439 WeakPolarHBondContact O-CB 3.43Å; H436-R439 PolarHBondContact O-N 2.83Å; H436-H440 AromaticContact CD2-CD2 3.85Å; H436-H440 AromaticContact NE2-CD2 3.95Å
437	L	85.4	Confident	85.1	Confident	47 Å²	47	66.3 Å²	66.3	25%	0.246	36%	0.355	C	S	.	.	H	α-helix	trans	-62.2	-35.8	179.7	-74.1	169.5	0	0	0	111.9	I422 L433 Q434 R439 H440 S441	I422-L437 HydrophobicContact CD1-CD2 4.07Å; L433-L437 HydrophobicContact CD1-CD1 4.2Å; L433-L437 HydrophobicContact CD1-CD2 4.41Å; L433-L437 HydrophobicContact CD1-CG 4.01Å; L433-L437 HydrophobicContact CG-CD1 4.04Å; L433-L437 HydrophobicContact CG-CG 4.32Å; L433-L437 WeakPolarHBondContact O-CG 3.47Å; L433-L437 PolarHBondContact O-N 3.09Å; Q434-L437 PolarHBondContact O-N 2.77Å; L437-R439 PolarHBondContact O-N 2.59Å; L437-H440 WeakPolarHBondContact O-CA 3.19Å; L437-H440 WeakPolarHBondContact O-CB 3.41Å; L437-H440 PolarHBondContact O-N 2.81Å; L437-S441 PolarHBondContact O-N 3.48Å; L437-S441 VanDerWaalsContact O-N 3.07Å
438	R	86.8	Confident	85.2	Confident	57 Å²	57	64.2 Å²	64.2	22%	0.215	35%	0.346	C	S	.	.	H	α-helix	trans	-55.7	-22.6	170.6	-67.2	176.4	-174.5	168	1.6	114.2	Q434 H436 H440 G442 E443 Y446 A456	Q434-R438 PolarHBondContact O-N 3.06Å; H436-R438 VanDerWaalsContact C-N 3.29Å; H436-R438 PolarHBondContact O-N 3.35Å; R438-H440 VanDerWaalsContact C-N 3.32Å; R438-G442 CarbonylContact O-C 3.56Å; R438-G442 VanDerWaalsContact O-CA 3.32Å; R438-G442 WeakPolarHBondContact O-CA 3.28Å; R438-G442 PolarHBondContact O-N 3.16Å; R438-E443 HydrophobicContact CB-CB 4.27Å; R438-E443 HydrophobicContact CG-CB 4.13Å; R438-E443 PolarHBondContact O-N 3.27Å; R438-Y446 PolarHBondContact NH1-OH 3.11Å; R438-A456 HydrophobicContact CB-CB 4.03Å; R438-A456 WeakPolarHBondContact CD-O 3.4Å; R438-A456 PolarHBondContact NH1-O 3.34Å; R438-A456 VanDerWaalsContact NH1-O 3.09Å
439	R	82.8	Confident	85.2	Confident	144 Å²	144	71.3 Å²	71.3	54%	0.543	38%	0.375	S	S	.	.	H	α-helix	trans	-75.3	-21.3	174	-167.4	-178.6	58.4	83.4	13	112.8	H436 L437	H436-R439 PolarHBondContact CE1-NH2 2.69Å; H436-R439 PolarHBondContact NE2-NH2 2.71Å; H436-R439 WeakPolarHBondContact O-CB 3.43Å; H436-R439 PolarHBondContact O-N 2.83Å; L437-R439 PolarHBondContact O-N 2.59Å
440	H	83.4	Confident	85.2	Confident	79 Å²	79	72.9 Å²	72.9	37%	0.366	39%	0.385	S	S	.	.	H	α-helix	trans	-92.2	-47.7	175.5	-67.2	-77.2	0	0	0	111.8	I422 C423 H436 L437 R438 G442	I422-H440 HydrophobicContact CD1-CB 3.71Å; I422-H440 HydrophobicContact CG2-CB 4.29Å; I422-H440 WeakPolarHBondContact CG2-CE1 3.39Å; I422-H440 VanDerWaalsContact CG2-ND1 3.34Å; I422-H440 WeakPolarHBondContact CG2-ND1 3.47Å; C423-H440 WeakPolarHBondContact CB-NE2 3.27Å; C423-H440 PolarHBondContact SG-NE2 3.48Å; H436-H440 AromaticContact CD2-CD2 3.85Å; H436-H440 AromaticContact NE2-CD2 3.95Å; L437-H440 WeakPolarHBondContact O-CA 3.19Å; L437-H440 WeakPolarHBondContact O-CB 3.41Å; L437-H440 PolarHBondContact O-N 2.81Å; R438-H440 VanDerWaalsContact C-N 3.32Å; H440-G442 PolarHBondContact O-N 3Å
441	S	84	Confident	85.2	Confident	71 Å²	71	72.9 Å²	72.9	50%	0.497	38%	0.381	S	S	.	.	H	α-helix	trans	-69.1	-21.1	174.2	64.7	0	0	0	0	113	L437 E443	L437-S441 PolarHBondContact O-N 3.48Å; L437-S441 VanDerWaalsContact O-N 3.07Å; S441-E443 WeakPolarHBondContact CB-OE1 3.47Å; S441-E443 PolarHBondContact O-N 2.78Å; S441-E443 VanDerWaalsContact OG-CD 3.25Å; S441-E443 WeakPolarHBondContact OG-CG 3.21Å; S441-E443 PolarHBondContact OG-N 3.27Å; S441-E443 PolarHBondContact OG-OE1 2.87Å
442	G	83.2	Confident	85.2	Confident	45 Å²	45	73 Å²	73	46%	0.464	38%	0.383	S	S	.	.			trans	82.1	-0.1	-178	0	0	0	0	0	113.8	R438 H440 K444	R438-G442 CarbonylContact O-C 3.56Å; R438-G442 VanDerWaalsContact O-CA 3.32Å; R438-G442 WeakPolarHBondContact O-CA 3.28Å; R438-G442 PolarHBondContact O-N 3.16Å; H440-G442 PolarHBondContact O-N 3Å; G442-K444 WeakPolarHBondContact O-CD 3.48Å; G442-K444 PolarHBondContact O-N 3.09Å
443	E	81	Confident	85.2	Confident	106 Å²	106	75.1 Å²	75.1	50%	0.495	39%	0.389	S	S	.	.			trans	-53.7	131.4	177.2	-78.7	162.9	-112.2	0	0	112.6	R438 S441	R438-E443 HydrophobicContact CB-CB 4.27Å; R438-E443 HydrophobicContact CG-CB 4.13Å; R438-E443 PolarHBondContact O-N 3.27Å; S441-E443 WeakPolarHBondContact CB-OE1 3.47Å; S441-E443 PolarHBondContact O-N 2.78Å; S441-E443 VanDerWaalsContact OG-CD 3.25Å; S441-E443 WeakPolarHBondContact OG-CG 3.21Å; S441-E443 PolarHBondContact OG-N 3.27Å; S441-E443 PolarHBondContact OG-OE1 2.87Å
444	K	87	Confident	85.1	Confident	99 Å²	99	80.4 Å²	80.4	43%	0.43	41%	0.407	S	S	.	.			trans	-135.2	82.6	177.4	-72.7	145.6	162.3	-95.8	0	109.4	G442 R454 F455	G442-K444 WeakPolarHBondContact O-CD 3.48Å; G442-K444 PolarHBondContact O-N 3.09Å; K444-R454 HydrophobicContact CB-CB 3.5Å; K444-R454 HydrophobicContact CD-CB 4.21Å; K444-R454 HydrophobicContact CG-CB 4.29Å; K444-R454 PolarHBondContact NZ-O 3.4Å; K444-R454 PolarHBondContact O-NE 3.02Å; K444-R454 PolarHBondContact O-NH2 3.19Å; K444-F455 CarbonylContact C-O 3.57Å; K444-F455 WeakPolarHBondContact CA-O 3.38Å; K444-F455 WeakPolarHBondContact CB-O 3.48Å
445	P	84.8	Confident	85.1	Confident	63 Å²	63	77.6 Å²	77.6	41%	0.409	39%	0.394	S	S	.	.			trans	-65.2	-39.8	-177.7	-21.8	34.3	0	0	0	112.1
446	Y	86.1	Confident	85.2	Confident	79 Å²	79	76.3 Å²	76.3	31%	0.31	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	128.4	-173.1	-45.5	-79.2	0	0	0	110.8	R438 R454 F455 A456 A457 S458	R438-Y446 PolarHBondContact NH1-OH 3.11Å; Y446-R454 CarbonylContact O-C 3.57Å; Y446-R454 VanDerWaalsContact O-CA 3.32Å; Y446-R454 WeakPolarHBondContact O-CA 3.32Å; Y446-F455 PolarHBondContact N-O 3.22Å; Y446-F455 PolarHBondContact O-N 3.49Å; Y446-A456 WeakPolarHBondContact CE2-O 3.33Å; Y446-A457 VanDerWaalsContact CE2-CA 3.49Å; Y446-S458 VanDerWaalsContact CD2-N 3.35Å; Y446-S458 VanDerWaalsContact CE2-N 3.34Å
447	I	86.2	Confident	85.1	Confident	83 Å²	83	76.3 Å²	76.3	43%	0.426	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	137.8	-179	-46.7	-170.4	0	0	0	108.6	R454	I447-R454 HydrophobicContact CD1-CG 4.38Å; I447-R454 HydrophobicContact CG1-CG 4.08Å; I447-R454 HydrophobicContact CG2-CG 4.32Å
448	C	89.7	Confident	85	Confident	0 Å²	0	77 Å²	77	0%	0	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	102.8	168.7	176.1	0	0	0	0	109.1	I450 C451 G452 K453 F455 H464 H468	C448-I450 PolarHBondContact O-N 3.14Å; C448-C451 CarbonylContact O-C 3.46Å; C448-C451 PolarHBondContact O-N 2.93Å; C448-G452 WeakPolarHBondContact O-CA 3.48Å; C448-G452 PolarHBondContact O-N 3.47Å; C448-K453 PolarHBondContact N-O 3.35Å; C448-F455 HydrophobicContact CB-CE2 4.17Å; C448-H464 VanDerWaalsContact SG-CD2 3.57Å; C448-H468 PolarHBondContact SG-NE2 3.26Å; C448-H468 VanDerWaalsContact SG-NE2 3.43Å
449	E	85.8	Confident	84.8	Confident	186 Å²	186	75.5 Å²	75.5	87%	0.869	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	-43.1	-177.8	-68.4	158.7	-164.1	0	0	112.8	C451	E449-C451 PolarHBondContact O-N 3.37Å
450	I	85.3	Confident	84.9	Confident	103 Å²	103	71.3 Å²	71.3	53%	0.528	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-20.5	-177.9	-52.8	169.3	0	0	0	113.2	C448 I465 H468	C448-I450 PolarHBondContact O-N 3.14Å; I450-I465 HydrophobicContact CD1-CG2 4.18Å; I450-H468 HydrophobicContact CB-CB 4.49Å; I450-H468 HydrophobicContact CD1-CB 3.72Å; I450-H468 HydrophobicContact CG2-CB 3.91Å
451	C	84.8	Confident	85.1	Confident	48 Å²	48	68.3 Å²	68.3	32%	0.324	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-153.5	17.9	-179.4	70.5	0	0	0	0	116.7	C448 E449 K453 H464 H468	C448-C451 CarbonylContact O-C 3.46Å; C448-C451 PolarHBondContact O-N 2.93Å; E449-C451 PolarHBondContact O-N 3.37Å; C451-K453 PolarHBondContact O-N 2.94Å; C451-H464 PolarHBondContact SG-NE2 3.42Å; C451-H468 PolarHBondContact SG-CE1 3.48Å; C451-H468 PolarHBondContact SG-NE2 2.67Å
452	G	83.1	Confident	85.1	Confident	49 Å²	49	71.1 Å²	71.1	51%	0.505	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.4	0.5	178.4	0	0	0	0	0	116.7	C448 R454	C448-G452 WeakPolarHBondContact O-CA 3.48Å; C448-G452 PolarHBondContact O-N 3.47Å; G452-R454 PolarHBondContact O-N 2.95Å
453	K	84.9	Confident	85.1	Confident	109 Å²	109	73.7 Å²	73.7	47%	0.474	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	129.8	-174.6	-70.7	176.4	-162.9	132.8	0	111.1	C448 C451 F455	C448-K453 PolarHBondContact N-O 3.35Å; C451-K453 PolarHBondContact O-N 2.94Å; K453-F455 HydrophobicContact CB-CE2 3.7Å; K453-F455 HydrophobicContact CB-CZ 4.1Å; K453-F455 WeakPolarHBondContact O-CD2 3.18Å; K453-F455 VanDerWaalsContact O-CE2 3.24Å; K453-F455 WeakPolarHBondContact O-CE2 3.47Å
454	R	86.6	Confident	85.3	Confident	135 Å²	135	69.7 Å²	69.7	51%	0.509	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	136.7	-175.7	-49.6	-177.4	57.1	173.7	0.6	112.9	K444 Y446 I447 G452	K444-R454 HydrophobicContact CB-CB 3.5Å; K444-R454 HydrophobicContact CD-CB 4.21Å; K444-R454 HydrophobicContact CG-CB 4.29Å; K444-R454 PolarHBondContact NZ-O 3.4Å; K444-R454 PolarHBondContact O-NE 3.02Å; K444-R454 PolarHBondContact O-NH2 3.19Å; Y446-R454 CarbonylContact O-C 3.57Å; Y446-R454 VanDerWaalsContact O-CA 3.32Å; Y446-R454 WeakPolarHBondContact O-CA 3.32Å; I447-R454 HydrophobicContact CD1-CG 4.38Å; I447-R454 HydrophobicContact CG1-CG 4.08Å; I447-R454 HydrophobicContact CG2-CG 4.32Å; G452-R454 PolarHBondContact O-N 2.95Å
455	F	85.8	Confident	85.2	Confident	49 Å²	49	67.8 Å²	67.8	22%	0.215	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	158	-175.6	-57	-102.5	0	0	0	112.1	K444 Y446 C448 K453 D460 V461 H464	K444-F455 CarbonylContact C-O 3.57Å; K444-F455 WeakPolarHBondContact CA-O 3.38Å; K444-F455 WeakPolarHBondContact CB-O 3.48Å; Y446-F455 PolarHBondContact N-O 3.22Å; Y446-F455 PolarHBondContact O-N 3.49Å; C448-F455 HydrophobicContact CB-CE2 4.17Å; K453-F455 HydrophobicContact CB-CE2 3.7Å; K453-F455 HydrophobicContact CB-CZ 4.1Å; K453-F455 WeakPolarHBondContact O-CD2 3.18Å; K453-F455 VanDerWaalsContact O-CE2 3.24Å; K453-F455 WeakPolarHBondContact O-CE2 3.47Å; F455-D460 HydrophobicContact CB-CB 4.06Å; F455-D460 HydrophobicContact CD1-CB 3.83Å; F455-D460 HydrophobicContact CG-CB 4.23Å; F455-V461 HydrophobicContact CB-CG2 4.06Å; F455-V461 HydrophobicContact CD2-CG2 3.41Å; F455-V461 VanDerWaalsContact CD2-CG2 3.41Å; F455-V461 HydrophobicContact CE2-CG2 4.17Å; F455-V461 HydrophobicContact CG-CG2 3.99Å; F455-H464 HydrophobicContact CE1-CB 4.2Å; F455-H464 HydrophobicContact CE2-CB 4.17Å; F455-H464 AromaticContact CE2-CD2 3.53Å; F455-H464 HydrophobicContact CZ-CB 3.69Å; F455-H464 AromaticContact CZ-CD2 3.32Å; F455-H464 WeakPolarHBondContact CZ-CD2 3.5Å; F455-H464 AromaticContact CZ-CG 3.54Å
456	A	85.2	Confident	85.2	Confident	25 Å²	25	66.6 Å²	66.6	21%	0.207	35%	0.345	C	S	.	.	S	Bend	trans	-87.3	-17.9	-175.7	0	0	0	0	0	114.3	R438 Y446	R438-A456 HydrophobicContact CB-CB 4.03Å; R438-A456 WeakPolarHBondContact CD-O 3.4Å; R438-A456 PolarHBondContact NH1-O 3.34Å; R438-A456 VanDerWaalsContact NH1-O 3.09Å; Y446-A456 WeakPolarHBondContact CE2-O 3.33Å
457	A	85.7	Confident	85	Confident	26 Å²	26	67.7 Å²	67.7	22%	0.215	36%	0.355	C	S	.	.	S	Bend	trans	-131.9	145.9	179	0	0	0	0	0	111.5	Y446 D460 V461	Y446-A457 VanDerWaalsContact CE2-CA 3.49Å; A457-D460 WeakPolarHBondContact O-CB 3.48Å; A457-D460 PolarHBondContact O-N 3.2Å; A457-V461 PolarHBondContact O-N 3.21Å
458	S	83	Confident	84.6	Confident	61 Å²	61	67.1 Å²	67.1	43%	0.427	35%	0.351	S	S	.	.	H	α-helix	trans	-62.4	-45.1	-178.1	48.5	0	0	0	0	112.5	Y446 D460 V461 Q462	Y446-S458 VanDerWaalsContact CD2-N 3.35Å; Y446-S458 VanDerWaalsContact CE2-N 3.34Å; S458-D460 PolarHBondContact O-N 3.18Å; S458-D460 VanDerWaalsContact O-N 3.14Å; S458-V461 WeakPolarHBondContact O-CA 3.32Å; S458-V461 WeakPolarHBondContact O-CB 3.4Å; S458-V461 PolarHBondContact O-N 3.09Å; S458-Q462 PolarHBondContact O-N 2.99Å
459	G	82.9	Confident	84.1	Confident	25 Å²	25	70.4 Å²	70.4	26%	0.258	37%	0.374	S	S	.	.	H	α-helix	trans	-62.6	-17	176.3	0	0	0	0	0	114.3	R463	G459-R463 WeakPolarHBondContact O-CB 3.34Å; G459-R463 PolarHBondContact O-N 3.25Å; G459-R463 PolarHBondContact O-NH2 3.1Å; G459-R463 VanDerWaalsContact O-NH2 3.14Å
460	D	84.8	Confident	83.7	Confident	56 Å²	56	63.9 Å²	63.9	30%	0.299	36%	0.356	S	S	.	.	H	α-helix	trans	-81	-34.7	170.7	-69.9	-15.4	0	0	0	112.1	F455 A457 S458 R463 H464	F455-D460 HydrophobicContact CB-CB 4.06Å; F455-D460 HydrophobicContact CD1-CB 3.83Å; F455-D460 HydrophobicContact CG-CB 4.23Å; A457-D460 WeakPolarHBondContact O-CB 3.48Å; A457-D460 PolarHBondContact O-N 3.2Å; S458-D460 PolarHBondContact O-N 3.18Å; S458-D460 VanDerWaalsContact O-N 3.14Å; D460-R463 IonicContact OD1-CZ 3.39Å; D460-R463 VanDerWaalsContact OD1-CZ 3.22Å; D460-R463 IonicContact OD1-NH1 3.9Å; D460-R463 PolarHBondContact OD1-NH1 3.24Å; D460-R463 IonicContact OD1-NH2 2.73Å; D460-R463 PolarHBondContact OD1-NH2 3.35Å; D460-H464 VanDerWaalsContact O-CB 3.31Å; D460-H464 WeakPolarHBondContact O-CB 3.45Å; D460-H464 PolarHBondContact O-N 2.97Å
461	V	86.6	Confident	83.1	Confident	16 Å²	16	63.7 Å²	63.7	10%	0.097	35%	0.353	C	S	.	.	H	α-helix	trans	-64.6	-50.6	169.8	152.1	0	0	0	0	110.6	F455 A457 S458 R463 H464 I465	F455-V461 HydrophobicContact CB-CG2 4.06Å; F455-V461 HydrophobicContact CD2-CG2 3.41Å; F455-V461 VanDerWaalsContact CD2-CG2 3.41Å; F455-V461 HydrophobicContact CE2-CG2 4.17Å; F455-V461 HydrophobicContact CG-CG2 3.99Å; A457-V461 PolarHBondContact O-N 3.21Å; S458-V461 WeakPolarHBondContact O-CA 3.32Å; S458-V461 WeakPolarHBondContact O-CB 3.4Å; S458-V461 PolarHBondContact O-N 3.09Å; V461-R463 VanDerWaalsContact C-N 3.33Å; V461-R463 PolarHBondContact O-N 3.32Å; V461-H464 CarbonylContact O-C 3.58Å; V461-H464 WeakPolarHBondContact O-CA 3.35Å; V461-H464 WeakPolarHBondContact O-CB 3.32Å; V461-H464 PolarHBondContact O-N 3.01Å; V461-I465 HydrophobicContact CG1-CD1 3.64Å; V461-I465 HydrophobicContact CG1-CG1 4.34Å; V461-I465 WeakPolarHBondContact O-CG1 3.31Å; V461-I465 PolarHBondContact O-N 3.42Å
462	Q	84.3	Confident	82.9	Confident	131 Å²	131	67.3 Å²	67.3	61%	0.612	36%	0.363	S	S	*	.	H	α-helix	trans	-57.4	-47.6	-179.9	-70.9	175.5	-30.8	0	0	111.2	S458 H464 I465 I466	S458-Q462 PolarHBondContact O-N 2.99Å; Q462-H464 PolarHBondContact O-N 3.22Å; Q462-I465 PolarHBondContact O-N 3.18Å; Q462-I465 VanDerWaalsContact O-N 3.12Å; Q462-I466 PolarHBondContact O-N 3.32Å
463	R	83.1	Confident	82.7	Confident	99 Å²	99	68.5 Å²	68.5	37%	0.374	36%	0.362	S	S	.	.	H	α-helix	trans	-65.4	-25.4	176.5	-159.5	-172.9	-38.3	110.6	8.4	113.3	G459 D460 V461 N485	G459-R463 WeakPolarHBondContact O-CB 3.34Å; G459-R463 PolarHBondContact O-N 3.25Å; G459-R463 PolarHBondContact O-NH2 3.1Å; G459-R463 VanDerWaalsContact O-NH2 3.14Å; D460-R463 IonicContact OD1-CZ 3.39Å; D460-R463 VanDerWaalsContact OD1-CZ 3.22Å; D460-R463 IonicContact OD1-NH1 3.9Å; D460-R463 PolarHBondContact OD1-NH1 3.24Å; D460-R463 IonicContact OD1-NH2 2.73Å; D460-R463 PolarHBondContact OD1-NH2 3.35Å; V461-R463 VanDerWaalsContact C-N 3.33Å; V461-R463 PolarHBondContact O-N 3.32Å; R463-N485 VanDerWaalsContact CD-CG 3.46Å; R463-N485 WeakPolarHBondContact CD-OD1 3.37Å; R463-N485 VanDerWaalsContact CG-OD1 3.29Å; R463-N485 WeakPolarHBondContact CG-OD1 3.31Å
464	H	85.8	Confident	82.5	Confident	21 Å²	21	66.1 Å²	66.1	10%	0.097	35%	0.353	C	S	.	.	H	α-helix	trans	-76.6	-37.8	171	-177.5	33.1	0	0	0	112.6	C448 C451 F455 D460 V461 Q462 I466 I467 H468	C448-H464 VanDerWaalsContact SG-CD2 3.57Å; C451-H464 PolarHBondContact SG-NE2 3.42Å; F455-H464 HydrophobicContact CE1-CB 4.2Å; F455-H464 HydrophobicContact CE2-CB 4.17Å; F455-H464 AromaticContact CE2-CD2 3.53Å; F455-H464 HydrophobicContact CZ-CB 3.69Å; F455-H464 AromaticContact CZ-CD2 3.32Å; F455-H464 WeakPolarHBondContact CZ-CD2 3.5Å; F455-H464 AromaticContact CZ-CG 3.54Å; D460-H464 VanDerWaalsContact O-CB 3.31Å; D460-H464 WeakPolarHBondContact O-CB 3.45Å; D460-H464 PolarHBondContact O-N 2.97Å; V461-H464 CarbonylContact O-C 3.58Å; V461-H464 WeakPolarHBondContact O-CA 3.35Å; V461-H464 WeakPolarHBondContact O-CB 3.32Å; V461-H464 PolarHBondContact O-N 3.01Å; Q462-H464 PolarHBondContact O-N 3.22Å; H464-I466 VanDerWaalsContact C-N 3.27Å; H464-I466 PolarHBondContact O-N 3.15Å; H464-I467 VanDerWaalsContact O-CB 3.24Å; H464-I467 WeakPolarHBondContact O-CB 3.48Å; H464-I467 WeakPolarHBondContact O-CG1 3.26Å; H464-I467 PolarHBondContact O-N 3.16Å; H464-H468 AromaticContact CD2-NE2 3.85Å; H464-H468 AromaticContact CE1-CE1 3.86Å; H464-H468 AromaticContact CE1-NE2 3.33Å; H464-H468 PolarHBondContact CE1-NE2 2.89Å; H464-H468 VanDerWaalsContact CE1-NE2 3.33Å; H464-H468 AromaticContact NE2-CE1 3.87Å; H464-H468 AromaticContact NE2-NE2 3.13Å; H464-H468 PolarHBondContact NE2-NE2 3.38Å; H464-H468 VanDerWaalsContact NE2-NE2 3.13Å
465	I	84.2	Confident	82.3	Confident	60 Å²	60	64.2 Å²	64.2	31%	0.308	35%	0.352	S	S	.	.	H	α-helix	trans	-59	-38.8	179.2	-71.3	165.5	0	0	0	111.3	I450 V461 Q462 I467 H468 S469	I450-I465 HydrophobicContact CD1-CG2 4.18Å; V461-I465 HydrophobicContact CG1-CD1 3.64Å; V461-I465 HydrophobicContact CG1-CG1 4.34Å; V461-I465 WeakPolarHBondContact O-CG1 3.31Å; V461-I465 PolarHBondContact O-N 3.42Å; Q462-I465 PolarHBondContact O-N 3.18Å; Q462-I465 VanDerWaalsContact O-N 3.12Å; I465-I467 PolarHBondContact O-N 2.96Å; I465-H468 WeakPolarHBondContact O-CB 3.42Å; I465-H468 PolarHBondContact O-N 3.26Å; I465-S469 PolarHBondContact O-N 3.26Å; I465-S469 VanDerWaalsContact O-N 3.17Å; I465-S469 PolarHBondContact O-OG 3.07Å
466	I	85.4	Confident	82.3	Confident	37 Å²	37	61.9 Å²	61.9	19%	0.19	34%	0.342	C	S	.	.	H	α-helix	trans	-51.8	-32.4	173.2	-61.8	171.3	0	0	0	112.4	Q462 H464 H468 G470 E471 P473	Q462-I466 PolarHBondContact O-N 3.32Å; H464-I466 VanDerWaalsContact C-N 3.27Å; H464-I466 PolarHBondContact O-N 3.15Å; I466-H468 VanDerWaalsContact C-N 3.32Å; I466-H468 PolarHBondContact O-N 3.29Å; I466-G470 PolarHBondContact O-N 3.41Å; I466-G470 VanDerWaalsContact O-N 3.15Å; I466-E471 HydrophobicContact CG2-CB 4.35Å; I466-E471 WeakPolarHBondContact CG2-O 3.18Å; I466-P473 HydrophobicContact CD1-CG 4.39Å; I466-P473 HydrophobicContact CG2-CG 4.37Å
467	I	82	Confident	82.2	Confident	103 Å²	103	66.7 Å²	66.7	53%	0.528	36%	0.364	S	S	.	.	H	α-helix	trans	-68.8	-31	178.7	-51.9	-177.9	0	0	0	111.6	H464 I465	H464-I467 VanDerWaalsContact O-CB 3.24Å; H464-I467 WeakPolarHBondContact O-CB 3.48Å; H464-I467 WeakPolarHBondContact O-CG1 3.26Å; H464-I467 PolarHBondContact O-N 3.16Å; I465-I467 PolarHBondContact O-N 2.96Å
468	H	78.9	Confident	82	Confident	71 Å²	71	70.1 Å²	70.1	33%	0.329	38%	0.382	S	S	.	.	H	α-helix	trans	-80.4	-39.7	177	-61.2	-66.7	0	0	0	112.1	C448 I450 C451 H464 I465 I466 G470	C448-H468 PolarHBondContact SG-NE2 3.26Å; C448-H468 VanDerWaalsContact SG-NE2 3.43Å; I450-H468 HydrophobicContact CB-CB 4.49Å; I450-H468 HydrophobicContact CD1-CB 3.72Å; I450-H468 HydrophobicContact CG2-CB 3.91Å; C451-H468 PolarHBondContact SG-CE1 3.48Å; C451-H468 PolarHBondContact SG-NE2 2.67Å; H464-H468 AromaticContact CD2-NE2 3.85Å; H464-H468 AromaticContact CE1-CE1 3.86Å; H464-H468 AromaticContact CE1-NE2 3.33Å; H464-H468 PolarHBondContact CE1-NE2 2.89Å; H464-H468 VanDerWaalsContact CE1-NE2 3.33Å; H464-H468 AromaticContact NE2-CE1 3.87Å; H464-H468 AromaticContact NE2-NE2 3.13Å; H464-H468 PolarHBondContact NE2-NE2 3.38Å; H464-H468 VanDerWaalsContact NE2-NE2 3.13Å; I465-H468 WeakPolarHBondContact O-CB 3.42Å; I465-H468 PolarHBondContact O-N 3.26Å; I466-H468 VanDerWaalsContact C-N 3.32Å; I466-H468 PolarHBondContact O-N 3.29Å; H468-G470 PolarHBondContact O-N 3.36Å
469	S	78.6	Confident	81.8	Confident	69 Å²	69	70.1 Å²	70.1	48%	0.483	38%	0.382	S	S	.	.	H	α-helix	trans	-63.6	-19	172.7	-48.1	0	0	0	0	112.7	I465 E471	I465-S469 PolarHBondContact O-N 3.26Å; I465-S469 VanDerWaalsContact O-N 3.17Å; I465-S469 PolarHBondContact O-OG 3.07Å; S469-E471 PolarHBondContact O-N 3.41Å; S469-E471 VanDerWaalsContact O-N 3.11Å
470	G	76.1	Confident	81.7	Confident	49 Å²	49	71.6 Å²	71.6	51%	0.505	40%	0.397	S	S	.	.			trans	70.5	-1.1	-174.3	0	0	0	0	0	114	I466 H468	I466-G470 PolarHBondContact O-N 3.41Å; I466-G470 VanDerWaalsContact O-N 3.15Å; H468-G470 PolarHBondContact O-N 3.36Å
471	E	74.3	Confident	81.4	Confident	98 Å²	98	76.7 Å²	76.7	46%	0.458	41%	0.412	S	S	.	.			trans	-63	151	179.4	-71	-176.6	173.3	0	0	111.8	I466 S469	I466-E471 HydrophobicContact CG2-CB 4.35Å; I466-E471 WeakPolarHBondContact CG2-O 3.18Å; S469-E471 PolarHBondContact O-N 3.41Å; S469-E471 VanDerWaalsContact O-N 3.11Å
472	K	80.3	Confident	81	Confident	125 Å²	125	76.5 Å²	76.5	54%	0.543	41%	0.414	S	S	.	.			trans	-136.4	74.8	-177.9	-73.1	160.7	178.3	168.9	0	109.3	H474 G482 F483	K472-H474 PolarHBondContact O-N 3.2Å; K472-H474 VanDerWaalsContact O-N 3.08Å; K472-G482 WeakPolarHBondContact CD-O 3.34Å; K472-F483 CarbonylContact C-O 3.19Å; K472-F483 WeakPolarHBondContact CA-O 3.34Å
473	P	78	Confident	80.8	Confident	74 Å²	74	72 Å²	72	48%	0.481	39%	0.392	S	S	.	.	S	Bend	trans	-60.4	-22.2	-174.7	-24.1	35.5	0	0	0	113.5	I466	I466-P473 HydrophobicContact CD1-CG 4.39Å; I466-P473 HydrophobicContact CG2-CG 4.37Å
474	H	80.3	Confident	80.6	Confident	59 Å²	59	68.6 Å²	68.6	27%	0.273	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	90.3	-177.4	-54.7	-61.6	0	0	0	110.1	K472 F483 F486 L489	K472-H474 PolarHBondContact O-N 3.2Å; K472-H474 VanDerWaalsContact O-N 3.08Å; H474-F483 HydrophobicContact CB-CB 4.46Å; H474-F483 PolarHBondContact N-O 3.01Å; H474-F483 PolarHBondContact O-N 3.48Å; H474-F486 PolarHBondContact CD2-N 2.93Å; H474-F486 AromaticContact ND1-CD2 3.98Å; H474-F486 PolarHBondContact NE2-N 3.14Å; H474-L489 HydrophobicContact CB-CB 4.06Å; H474-L489 HydrophobicContact CB-CD2 3.79Å
475	L	83.9	Confident	80.3	Confident	94 Å²	94	69.1 Å²	69.1	49%	0.492	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	152.9	173.7	-58.2	-175.8	0	0	0	111.4	L489	L475-L489 WeakPolarHBondContact O-CD1 3.41Å; L475-L489 WeakPolarHBondContact O-CD2 3.41Å
476	C	85.3	Confident	80	Confident	0 Å²	0	72 Å²	72	0%	0	40%	0.397	C	S	.	.			trans	-102.5	105.9	173.9	-169	0	0	0	0	110.5	T478 C479 G480 R481 F483 L489 H492 H496	C476-T478 PolarHBondContact O-N 3.28Å; C476-T478 VanDerWaalsContact O-N 3.1Å; C476-C479 CarbonylContact O-C 3.34Å; C476-C479 PolarHBondContact O-N 3.25Å; C476-G480 WeakPolarHBondContact O-CA 3.49Å; C476-G480 PolarHBondContact O-N 3.27Å; C476-R481 HydrophobicContact CB-CB 4.5Å; C476-R481 VanDerWaalsContact CB-O 3.27Å; C476-R481 WeakPolarHBondContact CB-O 3.4Å; C476-R481 PolarHBondContact N-O 3.06Å; C476-F483 HydrophobicContact CB-CE2 4.37Å; C476-L489 HydrophobicContact CB-CD1 3.47Å; C476-L489 VanDerWaalsContact CB-CD1 3.47Å; C476-H492 VanDerWaalsContact SG-CD2 3.59Å; C476-H496 PolarHBondContact SG-CD2 3.19Å; C476-H496 PolarHBondContact SG-NE2 3.29Å; C476-H496 VanDerWaalsContact SG-NE2 3.41Å
477	D	82.8	Confident	79.7	Confident	126 Å²	126	74.5 Å²	74.5	67%	0.674	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	-39	-175.1	-30	-43	0	0	0	112.7	C479 K493	D477-C479 VanDerWaalsContact C-N 3.32Å; D477-C479 PolarHBondContact O-N 3.49Å; D477-K493 VanDerWaalsContact OD2-CE 3.31Å; D477-K493 WeakPolarHBondContact OD2-CE 3.43Å; D477-K493 IonicContact OD2-NZ 3.13Å; D477-K493 PolarHBondContact OD2-NZ 2.98Å
478	T	81.1	Confident	79.7	Confident	98 Å²	98	72.5 Å²	72.5	60%	0.601	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-16.5	-179.2	-29.3	0	0	0	0	115	C476 H496	C476-T478 PolarHBondContact O-N 3.28Å; C476-T478 VanDerWaalsContact O-N 3.1Å; T478-H496 HydrophobicContact CG2-CB 3.95Å
479	C	80.4	Confident	80	Confident	61 Å²	61	69.5 Å²	69.5	41%	0.412	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-153.7	13.1	-174	78.8	0	0	0	0	115.5	C476 D477 R481 H492 H496	C476-C479 CarbonylContact O-C 3.34Å; C476-C479 PolarHBondContact O-N 3.25Å; D477-C479 VanDerWaalsContact C-N 3.32Å; D477-C479 PolarHBondContact O-N 3.49Å; C479-R481 PolarHBondContact O-N 3.12Å; C479-R481 WeakPolarHBondContact SG-CB 3.4Å; C479-H492 PolarHBondContact SG-NE2 3.24Å; C479-H496 VanDerWaalsContact SG-CE1 3.52Å; C479-H496 PolarHBondContact SG-NE2 3.21Å
480	G	78.8	Confident	80.1	Confident	56 Å²	56	72.5 Å²	72.5	58%	0.577	40%	0.399	S	S	*	.			trans	62.6	-3.8	-176.3	0	0	0	0	0	116.5	C476 G482	C476-G480 WeakPolarHBondContact O-CA 3.49Å; C476-G480 PolarHBondContact O-N 3.27Å; G480-G482 PolarHBondContact O-N 2.68Å
481	R	78.6	Confident	80.3	Confident	163 Å²	163	73.9 Å²	73.9	62%	0.615	39%	0.392	S	S	*	.			trans	-72.4	119.2	-169.4	-170.8	174	-174.2	145.7	4.4	111	C476 C479 F483	C476-R481 HydrophobicContact CB-CB 4.5Å; C476-R481 VanDerWaalsContact CB-O 3.27Å; C476-R481 WeakPolarHBondContact CB-O 3.4Å; C476-R481 PolarHBondContact N-O 3.06Å; C479-R481 PolarHBondContact O-N 3.12Å; C479-R481 WeakPolarHBondContact SG-CB 3.4Å; R481-F483 HydrophobicContact CB-CE2 4.03Å; R481-F483 HydrophobicContact CG-CE2 3.77Å; R481-F483 HydrophobicContact CG-CZ 3.9Å; R481-F483 VanDerWaalsContact O-CD2 3.26Å; R481-F483 WeakPolarHBondContact O-CD2 3.47Å; R481-F483 WeakPolarHBondContact O-CE2 3.39Å
482	G	79.9	Confident	80.6	Confident	13 Å²	13	70.4 Å²	70.4	13%	0.134	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	145.3	-179.7	0	0	0	0	0	115.4	K472 G480	K472-G482 WeakPolarHBondContact CD-O 3.34Å; G480-G482 PolarHBondContact O-N 2.68Å
483	F	79.4	Confident	80.7	Confident	37 Å²	37	67.9 Å²	67.9	16%	0.162	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	150.7	-178.9	-63.4	-96.3	0	0	0	111.8	K472 H474 C476 R481 N485 N488 L489 H492	K472-F483 CarbonylContact C-O 3.19Å; K472-F483 WeakPolarHBondContact CA-O 3.34Å; H474-F483 HydrophobicContact CB-CB 4.46Å; H474-F483 PolarHBondContact N-O 3.01Å; H474-F483 PolarHBondContact O-N 3.48Å; C476-F483 HydrophobicContact CB-CE2 4.37Å; R481-F483 HydrophobicContact CB-CE2 4.03Å; R481-F483 HydrophobicContact CG-CE2 3.77Å; R481-F483 HydrophobicContact CG-CZ 3.9Å; R481-F483 VanDerWaalsContact O-CD2 3.26Å; R481-F483 WeakPolarHBondContact O-CD2 3.47Å; R481-F483 WeakPolarHBondContact O-CE2 3.39Å; F483-N485 VanDerWaalsContact C-N 3.33Å; F483-N488 HydrophobicContact CB-CB 4.49Å; F483-N488 HydrophobicContact CD1-CB 3.93Å; F483-L489 HydrophobicContact CB-CB 4.38Å; F483-L489 HydrophobicContact CD2-CB 4.26Å; F483-L489 HydrophobicContact CD2-CD1 4.1Å; F483-L489 HydrophobicContact CE2-CD1 4.43Å; F483-L489 HydrophobicContact CG-CB 4.41Å; F483-H492 HydrophobicContact CE1-CB 4.05Å; F483-H492 HydrophobicContact CE2-CB 4.02Å; F483-H492 AromaticContact CE2-CD2 3.18Å; F483-H492 WeakPolarHBondContact CE2-CD2 3.47Å; F483-H492 AromaticContact CE2-CG 3.79Å; F483-H492 AromaticContact CE2-NE2 3.97Å; F483-H492 HydrophobicContact CZ-CB 3.57Å; F483-H492 AromaticContact CZ-CD2 3.2Å; F483-H492 WeakPolarHBondContact CZ-CD2 3.21Å; F483-H492 AromaticContact CZ-CG 3.38Å; F483-H492 AromaticContact CZ-NE2 3.9Å
484	S	77.9	Confident	80.8	Confident	26 Å²	26	69 Å²	69	18%	0.182	36%	0.362	C	S	.	.	S	Bend	trans	-77.6	-15.3	174.1	60.6	0	0	0	0	113.9
485	N	79.4	Confident	80.6	Confident	33 Å²	33	68.9 Å²	68.9	18%	0.176	37%	0.366	C	S	.	.			trans	-134.1	132.6	-173.4	-46.7	-1.9	0	0	0	110.3	R463 F483 S487 N488 L489	R463-N485 VanDerWaalsContact CD-CG 3.46Å; R463-N485 WeakPolarHBondContact CD-OD1 3.37Å; R463-N485 VanDerWaalsContact CG-OD1 3.29Å; R463-N485 WeakPolarHBondContact CG-OD1 3.31Å; F483-N485 VanDerWaalsContact C-N 3.33Å; N485-S487 VanDerWaalsContact C-N 3.29Å; N485-S487 PolarHBondContact O-N 3.09Å; N485-N488 HydrophobicContact CB-CB 4.04Å; N485-N488 WeakPolarHBondContact CB-OD1 3.32Å; N485-N488 PolarHBondContact ND2-ND2 3.24Å; N485-N488 PolarHBondContact ND2-OD1 3.2Å; N485-N488 PolarHBondContact O-N 3.42Å; N485-N488 VanDerWaalsContact O-N 3.13Å; N485-L489 PolarHBondContact O-N 3.27Å; N485-L489 VanDerWaalsContact O-N 3.08Å
486	F	78.1	Confident	80.2	Confident	121 Å²	121	67.7 Å²	67.7	53%	0.531	36%	0.358	S	S	.	.	H	α-helix	trans	-59.3	-38.2	173.4	-175.3	-102.6	0	0	0	112.7	H474 N488 L489 K490	H474-F486 PolarHBondContact CD2-N 2.93Å; H474-F486 AromaticContact ND1-CD2 3.98Å; H474-F486 PolarHBondContact NE2-N 3.14Å; F486-N488 VanDerWaalsContact C-N 3.29Å; F486-N488 PolarHBondContact O-N 3.37Å; F486-L489 HydrophobicContact CD2-CD2 4.32Å; F486-L489 HydrophobicContact CE2-CD2 4.47Å; F486-L489 WeakPolarHBondContact O-CB 3.31Å; F486-L489 PolarHBondContact O-N 3.29Å; F486-L489 VanDerWaalsContact O-N 3.15Å; F486-K490 PolarHBondContact O-N 3Å
487	S	80	Confident	79.4	Confident	89 Å²	89	71 Å²	71	62%	0.622	38%	0.378	S	S	*	.	H	α-helix	trans	-61.3	-36.8	176.6	-45.7	0	0	0	0	112.7	N485 K490 E491	N485-S487 VanDerWaalsContact C-N 3.29Å; N485-S487 PolarHBondContact O-N 3.09Å; S487-K490 PolarHBondContact O-N 2.97Å; S487-E491 WeakPolarHBondContact O-CB 3.45Å; S487-E491 PolarHBondContact O-N 2.77Å
488	N	82.3	Confident	78.4	Confident	60 Å²	60	69.4 Å²	69.4	32%	0.321	38%	0.382	S	S	.	.	H	α-helix	trans	-72.8	-35.4	176.8	-60.4	23.1	0	0	0	110.8	F483 N485 F486 E491 H492	F483-N488 HydrophobicContact CB-CB 4.49Å; F483-N488 HydrophobicContact CD1-CB 3.93Å; N485-N488 HydrophobicContact CB-CB 4.04Å; N485-N488 WeakPolarHBondContact CB-OD1 3.32Å; N485-N488 PolarHBondContact ND2-ND2 3.24Å; N485-N488 PolarHBondContact ND2-OD1 3.2Å; N485-N488 PolarHBondContact O-N 3.42Å; N485-N488 VanDerWaalsContact O-N 3.13Å; F486-N488 VanDerWaalsContact C-N 3.29Å; F486-N488 PolarHBondContact O-N 3.37Å; N488-E491 PolarHBondContact O-N 3.26Å; N488-H492 WeakPolarHBondContact O-CB 3.42Å; N488-H492 PolarHBondContact O-N 3.3Å
489	L	84.3	Confident	77.5	Confident	8 Å²	8	68.4 Å²	68.4	4%	0.042	37%	0.373	C	S	.	.	H	α-helix	trans	-62.9	-45.4	170.4	170.9	63.3	0	0	0	111	H474 L475 C476 F483 N485 F486 E491 H492 K493	H474-L489 HydrophobicContact CB-CB 4.06Å; H474-L489 HydrophobicContact CB-CD2 3.79Å; L475-L489 WeakPolarHBondContact O-CD1 3.41Å; L475-L489 WeakPolarHBondContact O-CD2 3.41Å; C476-L489 HydrophobicContact CB-CD1 3.47Å; C476-L489 VanDerWaalsContact CB-CD1 3.47Å; F483-L489 HydrophobicContact CB-CB 4.38Å; F483-L489 HydrophobicContact CD2-CB 4.26Å; F483-L489 HydrophobicContact CD2-CD1 4.1Å; F483-L489 HydrophobicContact CE2-CD1 4.43Å; F483-L489 HydrophobicContact CG-CB 4.41Å; N485-L489 PolarHBondContact O-N 3.27Å; N485-L489 VanDerWaalsContact O-N 3.08Å; F486-L489 HydrophobicContact CD2-CD2 4.32Å; F486-L489 HydrophobicContact CE2-CD2 4.47Å; F486-L489 WeakPolarHBondContact O-CB 3.31Å; F486-L489 PolarHBondContact O-N 3.29Å; F486-L489 VanDerWaalsContact O-N 3.15Å; L489-E491 VanDerWaalsContact C-N 3.33Å; L489-E491 PolarHBondContact O-N 3.22Å; L489-H492 CarbonylContact O-C 3.47Å; L489-H492 WeakPolarHBondContact O-CA 3.47Å; L489-H492 WeakPolarHBondContact O-CB 3.2Å; L489-H492 PolarHBondContact O-N 3.39Å; L489-K493 HydrophobicContact CD1-CG 4.15Å; L489-K493 PolarHBondContact O-N 3.31Å
490	K	81.4	Confident	76.5	Confident	133 Å²	133	72.2 Å²	72.2	58%	0.578	38%	0.383	S	S	*	.	H	α-helix	trans	-64.5	-37.3	177.6	-170.4	169.6	-177.1	171.9	0	112	F486 S487 H492	F486-K490 PolarHBondContact O-N 3Å; S487-K490 PolarHBondContact O-N 2.97Å; K490-H492 VanDerWaalsContact C-N 3.31Å
491	E	79.3	Confident	76	Confident	77 Å²	77	73.9 Å²	73.9	36%	0.36	38%	0.382	S	S	.	.	H	α-helix	trans	-66.9	-29.7	170.8	-177.7	172.9	-139.2	0	0	112.3	S487 N488 L489 M513	S487-E491 WeakPolarHBondContact O-CB 3.45Å; S487-E491 PolarHBondContact O-N 2.77Å; N488-E491 PolarHBondContact O-N 3.26Å; L489-E491 VanDerWaalsContact C-N 3.33Å; L489-E491 PolarHBondContact O-N 3.22Å; E491-M513 HydrophobicContact CG-CE 3.42Å; E491-M513 VanDerWaalsContact CG-CE 3.42Å; E491-M513 HydrophobicContact CG-SD 4.25Å; E491-M513 VanDerWaalsContact OE1-SD 3.4Å
492	H	82.3	Confident	75.7	Confident	25 Å²	25	69 Å²	69	12%	0.116	37%	0.365	C	S	.	.	H	α-helix	trans	-80.8	-35.2	174.5	178.7	43.6	0	0	0	114.3	C476 C479 F483 N488 L489 K490 K494 T495 H496	C476-H492 VanDerWaalsContact SG-CD2 3.59Å; C479-H492 PolarHBondContact SG-NE2 3.24Å; F483-H492 HydrophobicContact CE1-CB 4.05Å; F483-H492 HydrophobicContact CE2-CB 4.02Å; F483-H492 AromaticContact CE2-CD2 3.18Å; F483-H492 WeakPolarHBondContact CE2-CD2 3.47Å; F483-H492 AromaticContact CE2-CG 3.79Å; F483-H492 AromaticContact CE2-NE2 3.97Å; F483-H492 HydrophobicContact CZ-CB 3.57Å; F483-H492 AromaticContact CZ-CD2 3.2Å; F483-H492 WeakPolarHBondContact CZ-CD2 3.21Å; F483-H492 AromaticContact CZ-CG 3.38Å; F483-H492 AromaticContact CZ-NE2 3.9Å; N488-H492 WeakPolarHBondContact O-CB 3.42Å; N488-H492 PolarHBondContact O-N 3.3Å; L489-H492 CarbonylContact O-C 3.47Å; L489-H492 WeakPolarHBondContact O-CA 3.47Å; L489-H492 WeakPolarHBondContact O-CB 3.2Å; L489-H492 PolarHBondContact O-N 3.39Å; K490-H492 VanDerWaalsContact C-N 3.31Å; H492-K494 PolarHBondContact O-N 3.01Å; H492-T495 PolarHBondContact CE1-OG1 3.46Å; H492-T495 PolarHBondContact ND1-OG1 3.46Å; H492-T495 WeakPolarHBondContact O-CA 3.47Å; H492-T495 WeakPolarHBondContact O-CB 3.46Å; H492-T495 PolarHBondContact O-N 2.78Å; H492-T495 PolarHBondContact O-OG1 2.95Å; H492-H496 AromaticContact CD2-NE2 3.73Å; H492-H496 AromaticContact CE1-CE1 3.51Å; H492-H496 AromaticContact CE1-NE2 3.21Å; H492-H496 PolarHBondContact CE1-NE2 3.18Å; H492-H496 AromaticContact ND1-NE2 3.99Å; H492-H496 AromaticContact NE2-CE1 3.69Å; H492-H496 AromaticContact NE2-NE2 3.04Å; H492-H496 PolarHBondContact NE2-NE2 2.7Å
493	K	81.4	Confident	75.8	Confident	73 Å²	73	71.8 Å²	71.8	32%	0.317	38%	0.379	S	S	.	.	H	α-helix	trans	-58.6	-32.8	175.8	-76.3	-172	171.5	-169.6	0	111.5	D477 L489 T495 H496 T497	D477-K493 VanDerWaalsContact OD2-CE 3.31Å; D477-K493 WeakPolarHBondContact OD2-CE 3.43Å; D477-K493 IonicContact OD2-NZ 3.13Å; D477-K493 PolarHBondContact OD2-NZ 2.98Å; L489-K493 HydrophobicContact CD1-CG 4.15Å; L489-K493 PolarHBondContact O-N 3.31Å; K493-T495 PolarHBondContact O-N 3.2Å; K493-H496 PolarHBondContact O-N 3.02Å; K493-T497 PolarHBondContact O-N 2.99Å; K493-T497 VanDerWaalsContact O-N 3.12Å; K493-T497 PolarHBondContact O-OG1 3.43Å
494	K	79.4	Confident	76	Confident	96 Å²	96	70 Å²	70	42%	0.417	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	8.8	167.2	-64.2	-167.4	172.4	-147.1	0	115.7	H492 N512	H492-K494 PolarHBondContact O-N 3.01Å; K494-N512 WeakPolarHBondContact O-CB 3.32Å
495	T	76.3	Confident	76.2	Confident	58 Å²	58	74.8 Å²	74.8	36%	0.356	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-2.5	168	81.5	0	0	0	0	112.7	H492 K493 N512	H492-T495 PolarHBondContact CE1-OG1 3.46Å; H492-T495 PolarHBondContact ND1-OG1 3.46Å; H492-T495 WeakPolarHBondContact O-CA 3.47Å; H492-T495 WeakPolarHBondContact O-CB 3.46Å; H492-T495 PolarHBondContact O-N 2.78Å; H492-T495 PolarHBondContact O-OG1 2.95Å; K493-T495 PolarHBondContact O-N 3.2Å; T495-N512 WeakPolarHBondContact CG2-ND2 3.25Å
496	H	75.1	Confident	76.3	Confident	68 Å²	68	77 Å²	77	32%	0.315	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-43.4	173.3	-58.8	-52.9	0	0	0	111	C476 T478 C479 H492 K493 A498	C476-H496 PolarHBondContact SG-CD2 3.19Å; C476-H496 PolarHBondContact SG-NE2 3.29Å; C476-H496 VanDerWaalsContact SG-NE2 3.41Å; T478-H496 HydrophobicContact CG2-CB 3.95Å; C479-H496 VanDerWaalsContact SG-CE1 3.52Å; C479-H496 PolarHBondContact SG-NE2 3.21Å; H492-H496 AromaticContact CD2-NE2 3.73Å; H492-H496 AromaticContact CE1-CE1 3.51Å; H492-H496 AromaticContact CE1-NE2 3.21Å; H492-H496 PolarHBondContact CE1-NE2 3.18Å; H492-H496 AromaticContact ND1-NE2 3.99Å; H492-H496 AromaticContact NE2-CE1 3.69Å; H492-H496 AromaticContact NE2-NE2 3.04Å; H492-H496 PolarHBondContact NE2-NE2 2.7Å; K493-H496 PolarHBondContact O-N 3.02Å; H496-A498 PolarHBondContact O-N 3.43Å
497	T	69.1	Low	76.6	Confident	71 Å²	71	73.6 Å²	73.6	44%	0.436	40%	0.395	S	S	.	.	S	Bend	trans	-63.8	132.2	159	55.8	0	0	0	0	107.8	K493 D499	K493-T497 PolarHBondContact O-N 2.99Å; K493-T497 VanDerWaalsContact O-N 3.12Å; K493-T497 PolarHBondContact O-OG1 3.43Å; T497-D499 VanDerWaalsContact CB-OD2 3.23Å; T497-D499 WeakPolarHBondContact CB-OD2 3.38Å; T497-D499 PolarHBondContact O-N 3.09Å; T497-D499 PolarHBondContact OG1-OD2 3.47Å
498	A	62.4	Low	76.6	Confident	91 Å²	91	72.1 Å²	72.1	75%	0.752	39%	0.394	S	S	*	.			trans	-75.4	31.8	-176.3	0	0	0	0	0	113	H496 K500	H496-A498 PolarHBondContact O-N 3.43Å; A498-K500 PolarHBondContact O-N 3.41Å
499	D	61.8	Low	76.5	Confident	77 Å²	77	75 Å²	75	41%	0.412	40%	0.404	S	S	.	.			trans	-68.4	72.8	-176.8	-63.5	-30.3	0	0	0	110.8	T497 V501	T497-D499 VanDerWaalsContact CB-OD2 3.23Å; T497-D499 WeakPolarHBondContact CB-OD2 3.38Å; T497-D499 PolarHBondContact O-N 3.09Å; T497-D499 PolarHBondContact OG1-OD2 3.47Å; D499-V501 HydrophobicContact CB-CG2 3.9Å; D499-V501 PolarHBondContact O-N 2.96Å
500	K	59.3	Low	76.2	Confident	141 Å²	141	76.8 Å²	76.8	61%	0.613	42%	0.417	S	S	*	.			trans	-73.9	38.4	176.3	-81.3	177.3	171.3	178	0	112.4	A498 F502 S510	A498-K500 PolarHBondContact O-N 3.41Å; K500-F502 PolarHBondContact O-N 3.21Å; K500-S510 WeakPolarHBondContact CD-OG 3.44Å; K500-S510 WeakPolarHBondContact CE-OG 3.4Å
501	V	67.6	Low	76.1	Confident	92 Å²	92	72.5 Å²	72.5	56%	0.558	40%	0.398	S	S	*	.			trans	-56.3	-24.2	-167.4	-168.6	0	0	0	0	114.3	D499	D499-V501 HydrophobicContact CB-CG2 3.9Å; D499-V501 PolarHBondContact O-N 2.96Å
502	F	73.9	Confident	75.9	Confident	60 Å²	60	71.2 Å²	71.2	26%	0.263	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	81.1	-174.2	-51.3	-71.7	0	0	0	111.3	K500 F511 Q514 L517	K500-F502 PolarHBondContact O-N 3.21Å; F502-F511 HydrophobicContact CB-CB 4.49Å; F502-F511 WeakPolarHBondContact CB-O 3.42Å; F502-F511 PolarHBondContact N-O 2.86Å; F502-F511 PolarHBondContact O-N 3.13Å; F502-Q514 HydrophobicContact CD1-CB 3.93Å; F502-Q514 HydrophobicContact CD1-CG 4.4Å; F502-Q514 HydrophobicContact CD2-CB 4.39Å; F502-Q514 HydrophobicContact CE1-CB 3.9Å; F502-Q514 HydrophobicContact CE1-CG 4.45Å; F502-Q514 HydrophobicContact CE2-CB 4.36Å; F502-Q514 HydrophobicContact CG-CB 4.17Å; F502-Q514 HydrophobicContact CZ-CB 4.12Å; F502-L517 HydrophobicContact CB-CB 4.19Å; F502-L517 HydrophobicContact CB-CD2 3.91Å
503	T	80.4	Confident	75.7	Confident	71 Å²	71	71.5 Å²	71.5	44%	0.436	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	147.8	170.2	41.5	0	0	0	0	112.3	L517	T503-L517 WeakPolarHBondContact O-CD2 3.37Å
504	C	84.9	Confident	75.5	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	40%	0.402	C	S	.	.			trans	-95	108.5	168	-173.2	0	0	0	0	109.5	E506 C507 G508 K509 F511 L517 H520	C504-E506 PolarHBondContact O-N 3.16Å; C504-C507 CarbonylContact O-C 3.58Å; C504-C507 PolarHBondContact O-N 2.92Å; C504-C507 VanDerWaalsContact O-N 3.07Å; C504-G508 WeakPolarHBondContact O-CA 3.46Å; C504-G508 PolarHBondContact O-N 3.39Å; C504-K509 WeakPolarHBondContact CB-O 3.49Å; C504-K509 PolarHBondContact N-O 2.94Å; C504-F511 HydrophobicContact CB-CE2 4.38Å; C504-L517 HydrophobicContact CB-CD1 3.43Å; C504-L517 VanDerWaalsContact CB-CD1 3.43Å; C504-H520 PolarHBondContact SG-CD2 2.98Å
505	D	81.8	Confident	75.5	Confident	126 Å²	126	76.3 Å²	76.3	67%	0.674	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-38.9	-177	-37.3	-59.2	0	0	0	111	C507	D505-C507 VanDerWaalsContact C-N 3.26Å; D505-C507 PolarHBondContact O-N 3.31Å
506	E	81.6	Confident	75.7	Confident	80 Å²	80	77.5 Å²	77.5	37%	0.374	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-9.6	-178.9	-61.2	159.7	-130.4	0	0	114.5	C504 R521 H524	C504-E506 PolarHBondContact O-N 3.16Å; E506-R521 IonicContact OE1-CZ 2.71Å; E506-R521 IonicContact OE1-NE 3.53Å; E506-R521 PolarHBondContact OE1-NE 2.89Å; E506-R521 IonicContact OE1-NH2 2.77Å; E506-R521 PolarHBondContact OE1-NH2 3.28Å; E506-H524 WeakPolarHBondContact OE2-CB 3.49Å; E506-H524 IonicContact OE2-CD2 3.15Å; E506-H524 IonicContact OE2-CG 2.74Å
507	C	84.1	Confident	76.1	Confident	49 Å²	49	74.9 Å²	74.9	33%	0.331	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-159.6	17.7	173.2	75.3	0	0	0	0	117	C504 D505 K509 H520 H524	C504-C507 CarbonylContact O-C 3.58Å; C504-C507 PolarHBondContact O-N 2.92Å; C504-C507 VanDerWaalsContact O-N 3.07Å; D505-C507 VanDerWaalsContact C-N 3.26Å; D505-C507 PolarHBondContact O-N 3.31Å; C507-K509 PolarHBondContact O-N 3.25Å; C507-H520 PolarHBondContact SG-NE2 3.06Å; C507-H524 VanDerWaalsContact SG-CE1 3.59Å; C507-H524 PolarHBondContact SG-NE2 3.06Å
508	G	79.7	Confident	76.7	Confident	59 Å²	59	75.4 Å²	75.4	61%	0.608	41%	0.405	S	S	*	.			trans	66.8	-1.1	-178.5	0	0	0	0	0	116.5	C504 S510	C504-G508 WeakPolarHBondContact O-CA 3.46Å; C504-G508 PolarHBondContact O-N 3.39Å; G508-S510 PolarHBondContact O-N 3.22Å
509	K	79.9	Confident	77.5	Confident	121 Å²	121	78.9 Å²	78.9	53%	0.526	40%	0.403	S	S	.	.			trans	-78	115.8	-169.8	-73.6	178.3	-179.8	177.5	0	112.4	C504 C507 F511	C504-K509 WeakPolarHBondContact CB-O 3.49Å; C504-K509 PolarHBondContact N-O 2.94Å; C507-K509 PolarHBondContact O-N 3.25Å; K509-F511 HydrophobicContact CB-CE2 4.13Å; K509-F511 HydrophobicContact CB-CZ 4.28Å; K509-F511 VanDerWaalsContact O-CD2 3.29Å; K509-F511 WeakPolarHBondContact O-CD2 3.29Å; K509-F511 WeakPolarHBondContact O-CE2 3.39Å
510	S	78.9	Confident	78.5	Confident	44 Å²	44	76.4 Å²	76.4	31%	0.308	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	137.8	180	60.9	0	0	0	0	113.9	K500 G508	K500-S510 WeakPolarHBondContact CD-OG 3.44Å; K500-S510 WeakPolarHBondContact CE-OG 3.4Å; G508-S510 PolarHBondContact O-N 3.22Å
511	F	78.9	Confident	79.5	Confident	43 Å²	43	74.7 Å²	74.7	19%	0.189	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	143.1	173.7	-60.7	-82.9	0	0	0	111.8	F502 C504 K509 M513 K516 L517 H520	F502-F511 HydrophobicContact CB-CB 4.49Å; F502-F511 WeakPolarHBondContact CB-O 3.42Å; F502-F511 PolarHBondContact N-O 2.86Å; F502-F511 PolarHBondContact O-N 3.13Å; C504-F511 HydrophobicContact CB-CE2 4.38Å; K509-F511 HydrophobicContact CB-CE2 4.13Å; K509-F511 HydrophobicContact CB-CZ 4.28Å; K509-F511 VanDerWaalsContact O-CD2 3.29Å; K509-F511 WeakPolarHBondContact O-CD2 3.29Å; K509-F511 WeakPolarHBondContact O-CE2 3.39Å; F511-M513 PolarHBondContact O-N 3.31Å; F511-K516 HydrophobicContact CB-CB 4.14Å; F511-K516 HydrophobicContact CD1-CB 3.78Å; F511-K516 HydrophobicContact CD1-CD 4.46Å; F511-K516 HydrophobicContact CG-CB 4.1Å; F511-L517 HydrophobicContact CB-CB 4.47Å; F511-L517 HydrophobicContact CD2-CB 3.98Å; F511-L517 HydrophobicContact CD2-CD1 3.98Å; F511-L517 HydrophobicContact CE2-CD1 4.2Å; F511-L517 HydrophobicContact CG-CB 4.45Å; F511-H520 HydrophobicContact CE2-CB 3.93Å; F511-H520 AromaticContact CE2-CD2 3.58Å; F511-H520 AromaticContact CE2-CG 3.6Å; F511-H520 AromaticContact CE2-ND1 3.97Å; F511-H520 AromaticContact CE2-NE2 3.93Å; F511-H520 HydrophobicContact CZ-CB 3.78Å; F511-H520 AromaticContact CZ-CD2 3.86Å; F511-H520 AromaticContact CZ-CE1 3.77Å; F511-H520 AromaticContact CZ-CG 3.44Å; F511-H520 VanDerWaalsContact CZ-CG 3.44Å; F511-H520 AromaticContact CZ-ND1 3.42Å; F511-H520 WeakPolarHBondContact CZ-ND1 3.49Å
512	N	75.4	Confident	80.1	Confident	50 Å²	50	71.9 Å²	71.9	27%	0.267	36%	0.361	S	S	.	.	S	Bend	trans	-77.9	2.4	172.7	48.7	28	0	0	0	114.2	K494 T495 K516	K494-N512 WeakPolarHBondContact O-CB 3.32Å; T495-N512 WeakPolarHBondContact CG2-ND2 3.25Å; N512-K516 PolarHBondContact OD1-NZ 3.14Å
513	M	76.9	Confident	80.2	Confident	31 Å²	31	76.3 Å²	76.3	15%	0.153	38%	0.376	C	S	.	.			trans	-150.8	125.4	-176.8	-56.4	169.9	-172.4	0	0	111.3	E491 F511 R515 K516 L517	E491-M513 HydrophobicContact CG-CE 3.42Å; E491-M513 VanDerWaalsContact CG-CE 3.42Å; E491-M513 HydrophobicContact CG-SD 4.25Å; E491-M513 VanDerWaalsContact OE1-SD 3.4Å; F511-M513 PolarHBondContact O-N 3.31Å; M513-R515 HydrophobicContact CB-CG 4.19Å; M513-R515 PolarHBondContact O-N 3.46Å; M513-R515 VanDerWaalsContact O-N 3.13Å; M513-K516 HydrophobicContact CB-CB 4.45Å; M513-K516 HydrophobicContact CB-CD 4.08Å; M513-K516 HydrophobicContact CB-CG 4.09Å; M513-K516 HydrophobicContact CG-CD 4.29Å; M513-K516 WeakPolarHBondContact O-CB 3.46Å; M513-K516 PolarHBondContact O-N 2.94Å; M513-K516 HydrophobicContact SD-CD 3.97Å; M513-K516 WeakPolarHBondContact SD-CE 3.48Å; M513-K516 HydrophobicContact SD-CG 4.37Å; M513-K516 PolarHBondContact SD-NZ 2.75Å; M513-K516 VanDerWaalsContact SD-NZ 3.42Å; M513-L517 PolarHBondContact O-N 3.25Å
514	Q	78.9	Confident	80.1	Confident	97 Å²	97	76.1 Å²	76.1	45%	0.453	37%	0.37	S	S	.	.	H	α-helix	trans	-53.9	-36.7	177.3	-175.5	64.4	-24	0	0	113	F502 K516 L517 V518	F502-Q514 HydrophobicContact CD1-CB 3.93Å; F502-Q514 HydrophobicContact CD1-CG 4.4Å; F502-Q514 HydrophobicContact CD2-CB 4.39Å; F502-Q514 HydrophobicContact CE1-CB 3.9Å; F502-Q514 HydrophobicContact CE1-CG 4.45Å; F502-Q514 HydrophobicContact CE2-CB 4.36Å; F502-Q514 HydrophobicContact CG-CB 4.17Å; F502-Q514 HydrophobicContact CZ-CB 4.12Å; Q514-K516 PolarHBondContact O-N 3.33Å; Q514-L517 PolarHBondContact O-N 3.37Å; Q514-L517 VanDerWaalsContact O-N 3.16Å; Q514-V518 HydrophobicContact CG-CG2 4.45Å; Q514-V518 WeakPolarHBondContact O-CG2 3.43Å; Q514-V518 PolarHBondContact O-N 3.09Å
515	R	79.1	Confident	79.5	Confident	173 Å²	173	79.5 Å²	79.5	65%	0.653	39%	0.391	S	S	*	.	H	α-helix	trans	-65.9	-17	176.7	78.8	-171.8	-55.1	-169.5	6.7	114.9	M513 K519	M513-R515 HydrophobicContact CB-CG 4.19Å; M513-R515 PolarHBondContact O-N 3.46Å; M513-R515 VanDerWaalsContact O-N 3.13Å; R515-K519 WeakPolarHBondContact O-CG 3.4Å
516	K	80.3	Confident	79	Confident	84 Å²	84	75.9 Å²	75.9	37%	0.365	38%	0.383	S	S	.	.	H	α-helix	trans	-85.7	-44.6	171.1	-68.8	174.7	178.9	164.9	0	109.8	F511 N512 M513 Q514 V518 K519 H520	F511-K516 HydrophobicContact CB-CB 4.14Å; F511-K516 HydrophobicContact CD1-CB 3.78Å; F511-K516 HydrophobicContact CD1-CD 4.46Å; F511-K516 HydrophobicContact CG-CB 4.1Å; N512-K516 PolarHBondContact OD1-NZ 3.14Å; M513-K516 HydrophobicContact CB-CB 4.45Å; M513-K516 HydrophobicContact CB-CD 4.08Å; M513-K516 HydrophobicContact CB-CG 4.09Å; M513-K516 HydrophobicContact CG-CD 4.29Å; M513-K516 WeakPolarHBondContact O-CB 3.46Å; M513-K516 PolarHBondContact O-N 2.94Å; M513-K516 HydrophobicContact SD-CD 3.97Å; M513-K516 WeakPolarHBondContact SD-CE 3.48Å; M513-K516 HydrophobicContact SD-CG 4.37Å; M513-K516 PolarHBondContact SD-NZ 2.75Å; M513-K516 VanDerWaalsContact SD-NZ 3.42Å; Q514-K516 PolarHBondContact O-N 3.33Å; K516-V518 PolarHBondContact O-N 3.24Å; K516-K519 PolarHBondContact O-N 2.89Å; K516-H520 WeakPolarHBondContact O-CB 3.32Å; K516-H520 PolarHBondContact O-N 3.13Å
517	L	83.4	Confident	78.5	Confident	13 Å²	13	77.6 Å²	77.6	7%	0.068	39%	0.392	C	S	.	.	H	α-helix	trans	-56.6	-50.2	175.2	175	58.2	0	0	0	111.7	F502 T503 C504 F511 M513 Q514 K519 H520 R521	F502-L517 HydrophobicContact CB-CB 4.19Å; F502-L517 HydrophobicContact CB-CD2 3.91Å; T503-L517 WeakPolarHBondContact O-CD2 3.37Å; C504-L517 HydrophobicContact CB-CD1 3.43Å; C504-L517 VanDerWaalsContact CB-CD1 3.43Å; F511-L517 HydrophobicContact CB-CB 4.47Å; F511-L517 HydrophobicContact CD2-CB 3.98Å; F511-L517 HydrophobicContact CD2-CD1 3.98Å; F511-L517 HydrophobicContact CE2-CD1 4.2Å; F511-L517 HydrophobicContact CG-CB 4.45Å; M513-L517 PolarHBondContact O-N 3.25Å; Q514-L517 PolarHBondContact O-N 3.37Å; Q514-L517 VanDerWaalsContact O-N 3.16Å; L517-K519 VanDerWaalsContact C-N 3.34Å; L517-K519 PolarHBondContact O-N 2.98Å; L517-H520 CarbonylContact O-C 3.59Å; L517-H520 WeakPolarHBondContact O-CA 3.44Å; L517-H520 WeakPolarHBondContact O-CB 3.45Å; L517-H520 PolarHBondContact O-N 3.23Å; L517-R521 HydrophobicContact CD1-CG 3.94Å; L517-R521 HydrophobicContact CG-CG 4.39Å; L517-R521 PolarHBondContact O-N 3.47Å
518	V	81.6	Confident	78.1	Confident	82 Å²	82	82 Å²	82	50%	0.497	40%	0.401	S	S	.	.	H	α-helix	trans	-57	-45.9	178.7	173.6	0	0	0	0	111.7	Q514 K516 H520 R521 V522	Q514-V518 HydrophobicContact CG-CG2 4.45Å; Q514-V518 WeakPolarHBondContact O-CG2 3.43Å; Q514-V518 PolarHBondContact O-N 3.09Å; K516-V518 PolarHBondContact O-N 3.24Å; V518-H520 PolarHBondContact O-N 2.96Å; V518-R521 PolarHBondContact O-N 3.22Å; V518-V522 WeakPolarHBondContact O-CG2 3.34Å; V518-V522 PolarHBondContact O-N 3.17Å
519	K	79.4	Confident	78.1	Confident	164 Å²	164	83 Å²	83	71%	0.713	40%	0.397	S	S	*	.	H	α-helix	trans	-64.4	-24.6	175.1	-75.4	-176.2	173.3	-169.3	0	114	R515 K516 L517	R515-K519 WeakPolarHBondContact O-CG 3.4Å; K516-K519 PolarHBondContact O-N 2.89Å; L517-K519 VanDerWaalsContact C-N 3.34Å; L517-K519 PolarHBondContact O-N 2.98Å
520	H	83	Confident	78.1	Confident	24 Å²	24	82 Å²	82	11%	0.111	39%	0.391	C	S	.	.	H	α-helix	trans	-82.9	-36.7	178	171.5	92.9	0	0	0	111.6	C504 C507 F511 K516 L517 V518 R523 H524	C504-H520 PolarHBondContact SG-CD2 2.98Å; C507-H520 PolarHBondContact SG-NE2 3.06Å; F511-H520 HydrophobicContact CE2-CB 3.93Å; F511-H520 AromaticContact CE2-CD2 3.58Å; F511-H520 AromaticContact CE2-CG 3.6Å; F511-H520 AromaticContact CE2-ND1 3.97Å; F511-H520 AromaticContact CE2-NE2 3.93Å; F511-H520 HydrophobicContact CZ-CB 3.78Å; F511-H520 AromaticContact CZ-CD2 3.86Å; F511-H520 AromaticContact CZ-CE1 3.77Å; F511-H520 AromaticContact CZ-CG 3.44Å; F511-H520 VanDerWaalsContact CZ-CG 3.44Å; F511-H520 AromaticContact CZ-ND1 3.42Å; F511-H520 WeakPolarHBondContact CZ-ND1 3.49Å; K516-H520 WeakPolarHBondContact O-CB 3.32Å; K516-H520 PolarHBondContact O-N 3.13Å; L517-H520 CarbonylContact O-C 3.59Å; L517-H520 WeakPolarHBondContact O-CA 3.44Å; L517-H520 WeakPolarHBondContact O-CB 3.45Å; L517-H520 PolarHBondContact O-N 3.23Å; V518-H520 PolarHBondContact O-N 2.96Å; H520-R523 PolarHBondContact CE1-NH2 3.35Å; H520-R523 VanDerWaalsContact O-CB 3.25Å; H520-R523 WeakPolarHBondContact O-CB 3.29Å; H520-R523 PolarHBondContact O-N 3.28Å; H520-R523 VanDerWaalsContact O-N 3.1Å; H520-H524 AromaticContact CD2-NE2 3.88Å; H520-H524 AromaticContact NE2-CD2 3.96Å; H520-H524 AromaticContact NE2-NE2 3.3Å; H520-H524 PolarHBondContact NE2-NE2 3.39Å
521	R	80.8	Confident	78.4	Confident	106 Å²	106	83.3 Å²	83.3	40%	0.4	40%	0.4	S	S	.	.	H	α-helix	trans	-63.3	-37.1	173.3	-67.6	-171.3	69	-168.8	-1.9	112.7	E506 L517 V518 R523 H524 T525	E506-R521 IonicContact OE1-CZ 2.71Å; E506-R521 IonicContact OE1-NE 3.53Å; E506-R521 PolarHBondContact OE1-NE 2.89Å; E506-R521 IonicContact OE1-NH2 2.77Å; E506-R521 PolarHBondContact OE1-NH2 3.28Å; L517-R521 HydrophobicContact CD1-CG 3.94Å; L517-R521 HydrophobicContact CG-CG 4.39Å; L517-R521 PolarHBondContact O-N 3.47Å; V518-R521 PolarHBondContact O-N 3.22Å; R521-R523 PolarHBondContact O-N 3.33Å; R521-H524 PolarHBondContact O-N 3.37Å; R521-T525 PolarHBondContact O-N 2.84Å; R521-T525 PolarHBondContact O-OG1 2.98Å
522	V	79.6	Confident	78.8	Confident	33 Å²	33	81.3 Å²	81.3	20%	0.2	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-20.8	171.3	172.8	0	0	0	0	113.6	V518 E527	V518-V522 WeakPolarHBondContact O-CG2 3.34Å; V518-V522 PolarHBondContact O-N 3.17Å; V522-E527 WeakPolarHBondContact CG1-O 3.14Å
523	R	76.2	Confident	79.1	Confident	153 Å²	153	85.1 Å²	85.1	58%	0.577	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-26.4	174.6	-174.5	-174.7	60.4	124.7	17.6	112.9	H520 R521	H520-R523 PolarHBondContact CE1-NH2 3.35Å; H520-R523 VanDerWaalsContact O-CB 3.25Å; H520-R523 WeakPolarHBondContact O-CB 3.29Å; H520-R523 PolarHBondContact O-N 3.28Å; H520-R523 VanDerWaalsContact O-N 3.1Å; R521-R523 PolarHBondContact O-N 3.33Å
524	H	77.3	Confident	79.4	Confident	66 Å²	66	87 Å²	87	31%	0.306	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-42.5	-178.2	-65.2	-56.7	0	0	0	111.7	E506 C507 H520 R521 G526	E506-H524 WeakPolarHBondContact OE2-CB 3.49Å; E506-H524 IonicContact OE2-CD2 3.15Å; E506-H524 IonicContact OE2-CG 2.74Å; C507-H524 VanDerWaalsContact SG-CE1 3.59Å; C507-H524 PolarHBondContact SG-NE2 3.06Å; H520-H524 AromaticContact CD2-NE2 3.88Å; H520-H524 AromaticContact NE2-CD2 3.96Å; H520-H524 AromaticContact NE2-NE2 3.3Å; H520-H524 PolarHBondContact NE2-NE2 3.39Å; R521-H524 PolarHBondContact O-N 3.37Å; H524-G526 PolarHBondContact O-N 3.05Å
525	T	73.8	Confident	79.7	Confident	71 Å²	71	84.7 Å²	84.7	44%	0.436	43%	0.434	S	S	.	.	S	Bend	trans	-64.3	-7.3	174.8	59.7	0	0	0	0	113.7	R521 E527	R521-T525 PolarHBondContact O-N 2.84Å; R521-T525 PolarHBondContact O-OG1 2.98Å; T525-E527 PolarHBondContact O-N 3.31Å
526	G	69.5	Low	79.8	Confident	50 Å²	50	79.1 Å²	79.1	52%	0.515	43%	0.429	S	S	.	.			trans	69.6	-5.2	-177.8	0	0	0	0	0	114.4	H524 R528	H524-G526 PolarHBondContact O-N 3.05Å; G526-R528 WeakPolarHBondContact O-CG 3.48Å; G526-R528 PolarHBondContact O-N 3.16Å
527	E	72.4	Confident	80	Confident	117 Å²	117	81.5 Å²	81.5	55%	0.547	44%	0.44	S	S	.	.			trans	-60.2	126.5	179.1	-72	-176.5	-174.2	0	0	111.1	V522 T525	V522-E527 WeakPolarHBondContact CG1-O 3.14Å; T525-E527 PolarHBondContact O-N 3.31Å
528	R	76	Confident	80	Confident	140 Å²	140	82.9 Å²	82.9	53%	0.528	45%	0.451	S	S	.	.			trans	-129.6	73.1	-179.4	-67.9	168.1	86	102.8	-0.1	109.6	G526 Y530 S538 F539	G526-R528 WeakPolarHBondContact O-CG 3.48Å; G526-R528 PolarHBondContact O-N 3.16Å; R528-Y530 PolarHBondContact O-N 3.37Å; R528-S538 VanDerWaalsContact CB-CB 3.47Å; R528-S538 PolarHBondContact NE-O 3.06Å; R528-S538 PolarHBondContact NH2-O 3.48Å; R528-S538 WeakPolarHBondContact O-CB 3.44Å; R528-F539 CarbonylContact C-O 3.28Å; R528-F539 VanDerWaalsContact C-O 3.28Å; R528-F539 WeakPolarHBondContact CA-O 3.34Å
529	P	78.5	Confident	80	Confident	82 Å²	82	80.8 Å²	80.8	53%	0.532	44%	0.435	S	S	.	.			trans	-65.6	-1.8	-169.4	-22	34.9	0	0	0	115.5
530	Y	79.7	Confident	79.9	Confident	98 Å²	98	75 Å²	75	38%	0.384	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	82.8	-174.8	-55.5	-66.7	0	0	0	110.4	R528 S538 F539 G541	R528-Y530 PolarHBondContact O-N 3.37Å; Y530-S538 CarbonylContact O-C 3.49Å; Y530-S538 WeakPolarHBondContact O-CA 3.45Å; Y530-F539 WeakPolarHBondContact CB-O 3.49Å; Y530-F539 PolarHBondContact N-O 3.2Å; Y530-F539 PolarHBondContact O-N 2.8Å; Y530-G541 VanDerWaalsContact CD2-C 3.44Å
531	S	85.9	Confident	79.8	Confident	72 Å²	72	74.6 Å²	74.6	50%	0.503	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	147.2	173.9	54	0	0	0	0	112.7	L545	S531-L545 WeakPolarHBondContact O-CD1 3.29Å; S531-L545 WeakPolarHBondContact O-CD2 3.34Å
532	C	87.8	Confident	79.9	Confident	2 Å²	2	72.4 Å²	72.4	1%	0.014	43%	0.425	C	S	.	.			trans	-93.2	115.2	173.8	-173.6	0	0	0	0	110.5	A534 C535 G536 K537 F539 L545	C532-A534 PolarHBondContact O-N 3Å; C532-C535 PolarHBondContact O-N 2.93Å; C532-C535 VanDerWaalsContact SG-SG 3.68Å; C532-G536 WeakPolarHBondContact O-CA 3.27Å; C532-G536 PolarHBondContact O-N 3.08Å; C532-K537 WeakPolarHBondContact CB-O 3.36Å; C532-K537 PolarHBondContact N-O 3.41Å; C532-F539 HydrophobicContact CB-CE2 4.47Å; C532-L545 HydrophobicContact CB-CD1 3.64Å
533	P	81.5	Confident	80	Confident	129 Å²	129	72.9 Å²	72.9	84%	0.838	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-23	-175.7	26.7	-35.1	0	0	0	113.2
534	A	82.9	Confident	80.4	Confident	70 Å²	70	68.6 Å²	68.6	58%	0.579	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-10.1	-178.7	0	0	0	0	0	114.9	C532	C532-A534 PolarHBondContact O-N 3Å
535	C	85.3	Confident	80.8	Confident	50 Å²	50	66.9 Å²	66.9	34%	0.338	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-161	12.2	-174.9	68.4	0	0	0	0	115.5	C532 K537 H548 H552	C532-C535 PolarHBondContact O-N 2.93Å; C532-C535 VanDerWaalsContact SG-SG 3.68Å; C535-K537 PolarHBondContact O-N 3.29Å; C535-H548 PolarHBondContact SG-NE2 3.44Å; C535-H552 PolarHBondContact SG-NE2 3.01Å
536	G	81.8	Confident	81.3	Confident	55 Å²	55	71.5 Å²	71.5	57%	0.567	43%	0.428	S	S	*	.			trans	69.9	-20.5	-178.3	0	0	0	0	0	116.2	C532 S538	C532-G536 WeakPolarHBondContact O-CA 3.27Å; C532-G536 PolarHBondContact O-N 3.08Å; G536-S538 PolarHBondContact O-N 2.9Å; G536-S538 VanDerWaalsContact O-N 3.12Å; G536-S538 PolarHBondContact O-OG 3.14Å
537	K	83.8	Confident	82.1	Confident	134 Å²	134	73.8 Å²	73.8	58%	0.583	42%	0.421	S	S	*	.			trans	-59.5	116.8	-172.7	-66.2	-177.4	-179.7	-178.6	0	112	C532 C535 F539	C532-K537 WeakPolarHBondContact CB-O 3.36Å; C532-K537 PolarHBondContact N-O 3.41Å; C535-K537 PolarHBondContact O-N 3.29Å; K537-F539 HydrophobicContact CB-CE2 4.11Å; K537-F539 HydrophobicContact CB-CZ 4.35Å; K537-F539 WeakPolarHBondContact O-CD2 3.48Å; K537-F539 WeakPolarHBondContact O-CE2 3.33Å
538	S	83.4	Confident	82.8	Confident	43 Å²	43	69.6 Å²	69.6	30%	0.301	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	155.6	179.2	-53.5	0	0	0	0	113.2	R528 Y530 G536	R528-S538 VanDerWaalsContact CB-CB 3.47Å; R528-S538 PolarHBondContact NE-O 3.06Å; R528-S538 PolarHBondContact NH2-O 3.48Å; R528-S538 WeakPolarHBondContact O-CB 3.44Å; Y530-S538 CarbonylContact O-C 3.49Å; Y530-S538 WeakPolarHBondContact O-CA 3.45Å; G536-S538 PolarHBondContact O-N 2.9Å; G536-S538 VanDerWaalsContact O-N 3.12Å; G536-S538 PolarHBondContact O-OG 3.14Å
539	F	81.3	Confident	83.2	Confident	38 Å²	38	65.4 Å²	65.4	17%	0.167	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	145.1	179	-61.5	-92.5	0	0	0	111.7	R528 Y530 C532 K537 G541 D544 L545 H548	R528-F539 CarbonylContact C-O 3.28Å; R528-F539 VanDerWaalsContact C-O 3.28Å; R528-F539 WeakPolarHBondContact CA-O 3.34Å; Y530-F539 WeakPolarHBondContact CB-O 3.49Å; Y530-F539 PolarHBondContact N-O 3.2Å; Y530-F539 PolarHBondContact O-N 2.8Å; C532-F539 HydrophobicContact CB-CE2 4.47Å; K537-F539 HydrophobicContact CB-CE2 4.11Å; K537-F539 HydrophobicContact CB-CZ 4.35Å; K537-F539 WeakPolarHBondContact O-CD2 3.48Å; K537-F539 WeakPolarHBondContact O-CE2 3.33Å; F539-G541 PolarHBondContact O-N 3.01Å; F539-D544 HydrophobicContact CB-CB 4.38Å; F539-D544 HydrophobicContact CD1-CB 4.02Å; F539-D544 HydrophobicContact CG-CB 4.45Å; F539-L545 HydrophobicContact CB-CB 4.34Å; F539-L545 HydrophobicContact CD2-CB 4.03Å; F539-L545 HydrophobicContact CD2-CD1 4.07Å; F539-L545 HydrophobicContact CE2-CD1 4.35Å; F539-L545 HydrophobicContact CG-CB 4.37Å; F539-H548 HydrophobicContact CE1-CB 4.17Å; F539-H548 HydrophobicContact CE2-CB 3.85Å; F539-H548 AromaticContact CE2-CD2 3.36Å; F539-H548 WeakPolarHBondContact CE2-CD2 3.37Å; F539-H548 AromaticContact CE2-CG 3.8Å; F539-H548 HydrophobicContact CZ-CB 3.51Å; F539-H548 AromaticContact CZ-CD2 3.43Å; F539-H548 VanDerWaalsContact CZ-CD2 3.43Å; F539-H548 WeakPolarHBondContact CZ-CD2 3.3Å; F539-H548 AromaticContact CZ-CG 3.47Å; F539-H548 VanDerWaalsContact CZ-CG 3.47Å
540	G	77.2	Confident	83.6	Confident	41 Å²	41	64.1 Å²	64.1	42%	0.423	38%	0.375	S	S	.	.	S	Bend	trans	-75.3	-0.2	171.9	0	0	0	0	0	114.3
541	G	81.4	Confident	83.8	Confident	16 Å²	16	63.7 Å²	63.7	17%	0.165	38%	0.383	C	S	.	.			trans	-145.5	129	-177.9	0	0	0	0	0	113.2	Y530 F539 G543 D544 L545	Y530-G541 VanDerWaalsContact CD2-C 3.44Å; F539-G541 PolarHBondContact O-N 3.01Å; G541-G543 PolarHBondContact O-N 3.21Å; G541-D544 WeakPolarHBondContact O-CB 3.4Å; G541-D544 PolarHBondContact O-N 3.23Å; G541-L545 PolarHBondContact O-N 3.35Å
542	S	82	Confident	83.7	Confident	61 Å²	61	64.4 Å²	64.4	43%	0.427	38%	0.378	S	S	.	.	H	α-helix	trans	-63.7	-25.7	178.7	56.7	0	0	0	0	113.6	R546	S542-R546 WeakPolarHBondContact O-CB 3.47Å; S542-R546 PolarHBondContact O-N 3.19Å
543	G	83.4	Confident	83.5	Confident	43 Å²	43	67.9 Å²	67.9	44%	0.443	40%	0.399	S	S	.	.	H	α-helix	trans	-71.5	-29.3	171.7	0	0	0	0	0	113.4	G541 R547	G541-G543 PolarHBondContact O-N 3.21Å; G543-R547 WeakPolarHBondContact O-CB 3.29Å; G543-R547 PolarHBondContact O-N 3.18Å; G543-R547 VanDerWaalsContact O-N 3.1Å
544	D	83.1	Confident	83.5	Confident	62 Å²	62	63.9 Å²	63.9	33%	0.332	38%	0.382	S	S	.	.	H	α-helix	trans	-81.4	-42	177.5	-56.3	-79.7	0	0	0	110.6	F539 G541 R546 R547 H548	F539-D544 HydrophobicContact CB-CB 4.38Å; F539-D544 HydrophobicContact CD1-CB 4.02Å; F539-D544 HydrophobicContact CG-CB 4.45Å; G541-D544 WeakPolarHBondContact O-CB 3.4Å; G541-D544 PolarHBondContact O-N 3.23Å; D544-R546 PolarHBondContact O-N 3.33Å; D544-R547 WeakPolarHBondContact O-CB 3.49Å; D544-R547 PolarHBondContact O-N 3.06Å; D544-R547 VanDerWaalsContact O-N 3.11Å; D544-R547 IonicContact OD1-CZ 3.08Å; D544-R547 IonicContact OD1-NH1 3.56Å; D544-R547 PolarHBondContact OD1-NH1 2.96Å; D544-R547 IonicContact OD1-NH2 2.73Å; D544-R547 PolarHBondContact OD1-NH2 3.39Å; D544-H548 PolarHBondContact O-N 2.93Å
545	L	86.8	Confident	83.5	Confident	30 Å²	30	64.9 Å²	64.9	16%	0.157	38%	0.375	C	S	.	.	H	α-helix	trans	-54	-50.6	166.4	171.4	61.2	0	0	0	110.9	S531 C532 F539 G541 R547 H548 V549	S531-L545 WeakPolarHBondContact O-CD1 3.29Å; S531-L545 WeakPolarHBondContact O-CD2 3.34Å; C532-L545 HydrophobicContact CB-CD1 3.64Å; F539-L545 HydrophobicContact CB-CB 4.34Å; F539-L545 HydrophobicContact CD2-CB 4.03Å; F539-L545 HydrophobicContact CD2-CD1 4.07Å; F539-L545 HydrophobicContact CE2-CD1 4.35Å; F539-L545 HydrophobicContact CG-CB 4.37Å; G541-L545 PolarHBondContact O-N 3.35Å; L545-R547 PolarHBondContact O-N 3Å; L545-H548 CarbonylContact O-C 3.56Å; L545-H548 WeakPolarHBondContact O-CA 3.44Å; L545-H548 WeakPolarHBondContact O-CB 3.18Å; L545-H548 PolarHBondContact O-N 3.41Å; L545-V549 HydrophobicContact CD1-CG2 3.99Å; L545-V549 HydrophobicContact CG-CG2 4.42Å; L545-V549 WeakPolarHBondContact O-CG2 3.29Å; L545-V549 PolarHBondContact O-N 3.31Å
546	R	84.5	Confident	83.5	Confident	169 Å²	169	68.4 Å²	68.4	64%	0.638	38%	0.384	S	S	*	.	H	α-helix	trans	-63	-29.2	178.7	-166.3	-175.3	-58.1	-174.5	1	112.9	S542 D544	S542-R546 WeakPolarHBondContact O-CB 3.47Å; S542-R546 PolarHBondContact O-N 3.19Å; D544-R546 PolarHBondContact O-N 3.33Å
547	R	85.6	Confident	83.6	Confident	98 Å²	98	69.2 Å²	69.2	37%	0.37	38%	0.38	S	S	.	.	H	α-helix	trans	-71	-39.3	172.5	-166.3	-168.8	-51.3	117.8	13.4	111.3	G543 D544 L545 R569	G543-R547 WeakPolarHBondContact O-CB 3.29Å; G543-R547 PolarHBondContact O-N 3.18Å; G543-R547 VanDerWaalsContact O-N 3.1Å; D544-R547 WeakPolarHBondContact O-CB 3.49Å; D544-R547 PolarHBondContact O-N 3.06Å; D544-R547 VanDerWaalsContact O-N 3.11Å; D544-R547 IonicContact OD1-CZ 3.08Å; D544-R547 IonicContact OD1-NH1 3.56Å; D544-R547 PolarHBondContact OD1-NH1 2.96Å; D544-R547 IonicContact OD1-NH2 2.73Å; D544-R547 PolarHBondContact OD1-NH2 3.39Å; L545-R547 PolarHBondContact O-N 3Å; R547-R569 HydrophobicContact CG-CG 4.4Å
548	H	86.8	Confident	83.7	Confident	29 Å²	29	66.6 Å²	66.6	13%	0.134	37%	0.367	C	S	.	.	H	α-helix	trans	-70.6	-38.5	177.8	178.2	44.2	0	0	0	113	C535 F539 D544 L545 R550 T551 H552	C535-H548 PolarHBondContact SG-NE2 3.44Å; F539-H548 HydrophobicContact CE1-CB 4.17Å; F539-H548 HydrophobicContact CE2-CB 3.85Å; F539-H548 AromaticContact CE2-CD2 3.36Å; F539-H548 WeakPolarHBondContact CE2-CD2 3.37Å; F539-H548 AromaticContact CE2-CG 3.8Å; F539-H548 HydrophobicContact CZ-CB 3.51Å; F539-H548 AromaticContact CZ-CD2 3.43Å; F539-H548 VanDerWaalsContact CZ-CD2 3.43Å; F539-H548 WeakPolarHBondContact CZ-CD2 3.3Å; F539-H548 AromaticContact CZ-CG 3.47Å; F539-H548 VanDerWaalsContact CZ-CG 3.47Å; D544-H548 PolarHBondContact O-N 2.93Å; L545-H548 CarbonylContact O-C 3.56Å; L545-H548 WeakPolarHBondContact O-CA 3.44Å; L545-H548 WeakPolarHBondContact O-CB 3.18Å; L545-H548 PolarHBondContact O-N 3.41Å; H548-R550 PolarHBondContact O-N 3.34Å; H548-R550 VanDerWaalsContact O-N 3.1Å; H548-T551 PolarHBondContact CE1-OG1 3.15Å; H548-T551 PolarHBondContact ND1-OG1 2.9Å; H548-T551 VanDerWaalsContact ND1-OG1 3.08Å; H548-T551 WeakPolarHBondContact O-CB 3.41Å; H548-T551 PolarHBondContact O-N 2.86Å; H548-T551 PolarHBondContact O-OG1 3.18Å; H548-H552 AromaticContact CD2-NE2 3.82Å; H548-H552 AromaticContact CE1-CE1 3.64Å; H548-H552 AromaticContact CE1-NE2 3.24Å; H548-H552 PolarHBondContact CE1-NE2 3.15Å; H548-H552 AromaticContact NE2-CE1 3.76Å; H548-H552 AromaticContact NE2-NE2 3.03Å; H548-H552 PolarHBondContact NE2-NE2 2.99Å
549	V	85.4	Confident	83.9	Confident	52 Å²	52	67.6 Å²	67.6	32%	0.315	37%	0.374	S	S	.	.	H	α-helix	trans	-55.9	-32.4	176.7	171	0	0	0	0	112	L545 T551 H552 T553	L545-V549 HydrophobicContact CD1-CG2 3.99Å; L545-V549 HydrophobicContact CG-CG2 4.42Å; L545-V549 WeakPolarHBondContact O-CG2 3.29Å; L545-V549 PolarHBondContact O-N 3.31Å; V549-T551 VanDerWaalsContact C-N 3.25Å; V549-T551 PolarHBondContact O-N 2.92Å; V549-H552 WeakPolarHBondContact O-CB 3.17Å; V549-H552 PolarHBondContact O-N 3Å; V549-T553 HydrophobicContact CG1-CG2 4.26Å; V549-T553 PolarHBondContact O-N 3.45Å
550	R	86.8	Confident	84.3	Confident	55 Å²	55	65.9 Å²	65.9	21%	0.208	37%	0.366	C	S	.	.	H	α-helix	trans	-68.2	-14.8	173.6	-61.1	-165	-167.2	97.3	-3.5	115.4	H548 H552 G554 E555	H548-R550 PolarHBondContact O-N 3.34Å; H548-R550 VanDerWaalsContact O-N 3.1Å; R550-H552 VanDerWaalsContact C-N 3.28Å; R550-G554 PolarHBondContact O-N 2.91Å; R550-E555 HydrophobicContact CB-CB 4.23Å; R550-E555 HydrophobicContact CG-CB 4.07Å; R550-E555 IonicContact NE-OE2 3.63Å
551	T	84	Confident	84.7	Confident	89 Å²	89	70.7 Å²	70.7	55%	0.546	38%	0.378	S	S	.	.	H	α-helix	trans	-76.7	-20.8	169.9	68.5	0	0	0	0	111.7	H548 V549	H548-T551 PolarHBondContact CE1-OG1 3.15Å; H548-T551 PolarHBondContact ND1-OG1 2.9Å; H548-T551 VanDerWaalsContact ND1-OG1 3.08Å; H548-T551 WeakPolarHBondContact O-CB 3.41Å; H548-T551 PolarHBondContact O-N 2.86Å; H548-T551 PolarHBondContact O-OG1 3.18Å; V549-T551 VanDerWaalsContact C-N 3.25Å; V549-T551 PolarHBondContact O-N 2.92Å
552	H	83.8	Confident	85	Confident	86 Å²	86	74.9 Å²	74.9	40%	0.398	40%	0.395	S	S	.	.	H	α-helix	trans	-90.1	-41.3	174.2	-56	-55	0	0	0	112	C535 H548 V549 R550 G554	C535-H552 PolarHBondContact SG-NE2 3.01Å; H548-H552 AromaticContact CD2-NE2 3.82Å; H548-H552 AromaticContact CE1-CE1 3.64Å; H548-H552 AromaticContact CE1-NE2 3.24Å; H548-H552 PolarHBondContact CE1-NE2 3.15Å; H548-H552 AromaticContact NE2-CE1 3.76Å; H548-H552 AromaticContact NE2-NE2 3.03Å; H548-H552 PolarHBondContact NE2-NE2 2.99Å; V549-H552 WeakPolarHBondContact O-CB 3.17Å; V549-H552 PolarHBondContact O-N 3Å; R550-H552 VanDerWaalsContact C-N 3.28Å; H552-G554 VanDerWaalsContact C-N 3.27Å; H552-G554 PolarHBondContact O-N 3.04Å
553	T	82.3	Confident	85.3	Confident	75 Å²	75	74.1 Å²	74.1	46%	0.46	39%	0.389	S	S	.	.	S	Bend	trans	-79.4	-5.4	178.9	64.1	0	0	0	0	114.1	V549 E555	V549-T553 HydrophobicContact CG1-CG2 4.26Å; V549-T553 PolarHBondContact O-N 3.45Å; T553-E555 WeakPolarHBondContact CB-OE1 3.41Å; T553-E555 PolarHBondContact O-N 3.45Å; T553-E555 VanDerWaalsContact OG1-CD 3.24Å; T553-E555 WeakPolarHBondContact OG1-CG 3.33Å; T553-E555 PolarHBondContact OG1-OE1 3.1Å
554	G	82.1	Confident	85.3	Confident	46 Å²	46	76.7 Å²	76.7	47%	0.474	40%	0.4	S	S	.	.			trans	67	-0.7	-177.4	0	0	0	0	0	115.1	R550 H552 K556	R550-G554 PolarHBondContact O-N 2.91Å; H552-G554 VanDerWaalsContact C-N 3.27Å; H552-G554 PolarHBondContact O-N 3.04Å; G554-K556 WeakPolarHBondContact O-CG 3.32Å; G554-K556 PolarHBondContact O-N 3.46Å
555	E	83.5	Confident	85.4	Confident	91 Å²	91	79.9 Å²	79.9	43%	0.425	41%	0.411	S	S	.	.			trans	-53.8	120.1	-176.8	-81.6	168.1	-122.4	0	0	112.4	R550 T553 P557 T568	R550-E555 HydrophobicContact CB-CB 4.23Å; R550-E555 HydrophobicContact CG-CB 4.07Å; R550-E555 IonicContact NE-OE2 3.63Å; T553-E555 WeakPolarHBondContact CB-OE1 3.41Å; T553-E555 PolarHBondContact O-N 3.45Å; T553-E555 VanDerWaalsContact OG1-CD 3.24Å; T553-E555 WeakPolarHBondContact OG1-CG 3.33Å; T553-E555 PolarHBondContact OG1-OE1 3.1Å; E555-P557 HydrophobicContact CB-CG 4.42Å; E555-P557 WeakPolarHBondContact O-CD 3.45Å; E555-T568 WeakPolarHBondContact O-CG2 3.46Å
556	K	84.2	Confident	85.4	Confident	124 Å²	124	81.3 Å²	81.3	54%	0.539	42%	0.423	S	S	.	.			trans	-120.1	71.8	176.1	-71.1	159.6	177.1	177.8	0	110.8	G554 Y558 C566 F567 T568	G554-K556 WeakPolarHBondContact O-CG 3.32Å; G554-K556 PolarHBondContact O-N 3.46Å; K556-Y558 PolarHBondContact O-N 2.93Å; K556-C566 HydrophobicContact CB-CB 3.66Å; K556-C566 HydrophobicContact CD-CB 4.35Å; K556-C566 WeakPolarHBondContact CD-O 3.46Å; K556-F567 CarbonylContact C-O 3.53Å; K556-F567 VanDerWaalsContact CA-O 3.27Å; K556-F567 WeakPolarHBondContact CA-O 3.34Å; K556-T568 HydrophobicContact CG-CG2 3.8Å
557	P	84.9	Confident	85.4	Confident	72 Å²	72	75.2 Å²	75.2	47%	0.468	40%	0.401	S	S	.	.			trans	-73.4	8	-169.2	-15.7	32.5	0	0	0	115.3	E555	E555-P557 HydrophobicContact CB-CG 4.42Å; E555-P557 WeakPolarHBondContact O-CD 3.45Å
558	Y	85.4	Confident	85.4	Confident	79 Å²	79	72.9 Å²	72.9	31%	0.31	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	84.1	-173.1	-57.1	-69.4	0	0	0	109.5	K556 F567 R569 S570	K556-Y558 PolarHBondContact O-N 2.93Å; Y558-F567 WeakPolarHBondContact CB-O 3.49Å; Y558-F567 WeakPolarHBondContact CD2-O 3.37Å; Y558-F567 PolarHBondContact N-O 2.81Å; Y558-F567 WeakPolarHBondContact O-CD2 3.39Å; Y558-F567 PolarHBondContact O-N 3.25Å; Y558-R569 VanDerWaalsContact CD2-C 3.49Å; Y558-S570 VanDerWaalsContact CD2-N 3.28Å
559	S	86.6	Confident	85.3	Confident	64 Å²	64	77.2 Å²	77.2	45%	0.448	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	155.7	170.9	48.5	0	0	0	0	111.7	K565 L573	S559-K565 CarbonylContact C-O 3.59Å; S559-L573 WeakPolarHBondContact O-CD1 3.41Å; S559-L573 WeakPolarHBondContact O-CD2 3.33Å
560	C	89.9	Confident	85.4	Confident	1 Å²	1	77.5 Å²	77.5	1%	0.007	42%	0.417	C	S	.	.			trans	-103.8	116.8	169.4	-174.5	0	0	0	0	109.7	I562 C563 S564 K565 F567 L573	C560-I562 PolarHBondContact O-N 3.1Å; C560-I562 VanDerWaalsContact O-N 3.11Å; C560-C563 PolarHBondContact O-N 3.1Å; C560-S564 VanDerWaalsContact O-CA 3.25Å; C560-S564 WeakPolarHBondContact O-CA 3.13Å; C560-S564 PolarHBondContact O-N 3.36Å; C560-K565 PolarHBondContact N-O 3.32Å; C560-F567 HydrophobicContact CB-CE2 4.4Å; C560-L573 HydrophobicContact CB-CD1 3.55Å
561	E	87	Confident	85.4	Confident	143 Å²	143	76.7 Å²	76.7	67%	0.668	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-32.6	178.3	-56.4	92.5	-102.2	0	0	113.5	K577	E561-K577 WeakPolarHBondContact OE1-CE 3.34Å; E561-K577 IonicContact OE1-NZ 2.69Å; E561-K577 PolarHBondContact OE1-NZ 3.25Å; E561-K577 IonicContact OE2-NZ 2.7Å; E561-K577 PolarHBondContact OE2-NZ 3.21Å
562	I	86.5	Confident	85.5	Confident	104 Å²	104	75.3 Å²	75.3	53%	0.533	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-29.8	-172.3	-57.4	169.3	0	0	0	113.3	C560 H580	C560-I562 PolarHBondContact O-N 3.1Å; C560-I562 VanDerWaalsContact O-N 3.11Å; I562-H580 HydrophobicContact CD1-CB 3.71Å; I562-H580 HydrophobicContact CG2-CB 4.02Å
563	C	88.4	Confident	85.8	Confident	45 Å²	45	72.2 Å²	72.2	30%	0.304	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147.9	18.8	-175.9	80.2	0	0	0	0	114.1	C560 K565 H576 H580	C560-C563 PolarHBondContact O-N 3.1Å; C563-K565 PolarHBondContact O-N 3.01Å; C563-H576 PolarHBondContact SG-NE2 3.09Å; C563-H580 PolarHBondContact SG-CE1 3.22Å; C563-H580 PolarHBondContact SG-NE2 3.45Å; C563-H580 VanDerWaalsContact SG-NE2 3.36Å
564	S	84.5	Confident	86	Confident	96 Å²	96	76.8 Å²	76.8	67%	0.671	41%	0.409	S	S	*	.			trans	54.5	6.1	178.6	-58.8	0	0	0	0	117.6	C560 C566	C560-S564 VanDerWaalsContact O-CA 3.25Å; C560-S564 WeakPolarHBondContact O-CA 3.13Å; C560-S564 PolarHBondContact O-N 3.36Å; S564-C566 PolarHBondContact O-N 3.31Å; S564-C566 PolarHBondContact O-SG 3.25Å; S564-C566 VanDerWaalsContact O-SG 3.4Å
565	K	84.5	Confident	86.3	Confident	130 Å²	130	84.1 Å²	84.1	57%	0.565	42%	0.422	S	S	*	.			trans	-68	126.9	179.3	-72	177.7	-175.4	176.5	0	110.5	S559 C560 C563 F567	S559-K565 CarbonylContact C-O 3.59Å; C560-K565 PolarHBondContact N-O 3.32Å; C563-K565 PolarHBondContact O-N 3.01Å; K565-F567 HydrophobicContact CB-CE2 3.88Å; K565-F567 HydrophobicContact CB-CZ 3.91Å; K565-F567 WeakPolarHBondContact O-CD2 3.45Å; K565-F567 WeakPolarHBondContact O-CE2 3.4Å
566	C	86.3	Confident	86.6	Confident	60 Å²	60	80.6 Å²	80.6	41%	0.405	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	136	-176.2	-62.4	0	0	0	0	112.5	K556 S564	K556-C566 HydrophobicContact CB-CB 3.66Å; K556-C566 HydrophobicContact CD-CB 4.35Å; K556-C566 WeakPolarHBondContact CD-O 3.46Å; S564-C566 PolarHBondContact O-N 3.31Å; S564-C566 PolarHBondContact O-SG 3.25Å; S564-C566 VanDerWaalsContact O-SG 3.4Å
567	F	85.4	Confident	86.7	Confident	41 Å²	41	78 Å²	78	18%	0.18	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	150.7	-174.8	-58.5	-85.6	0	0	0	112.6	K556 Y558 C560 K565 R569 V572 L573 H576	K556-F567 CarbonylContact C-O 3.53Å; K556-F567 VanDerWaalsContact CA-O 3.27Å; K556-F567 WeakPolarHBondContact CA-O 3.34Å; Y558-F567 WeakPolarHBondContact CB-O 3.49Å; Y558-F567 WeakPolarHBondContact CD2-O 3.37Å; Y558-F567 PolarHBondContact N-O 2.81Å; Y558-F567 WeakPolarHBondContact O-CD2 3.39Å; Y558-F567 PolarHBondContact O-N 3.25Å; C560-F567 HydrophobicContact CB-CE2 4.4Å; K565-F567 HydrophobicContact CB-CE2 3.88Å; K565-F567 HydrophobicContact CB-CZ 3.91Å; K565-F567 WeakPolarHBondContact O-CD2 3.45Å; K565-F567 WeakPolarHBondContact O-CE2 3.4Å; F567-R569 VanDerWaalsContact C-N 3.3Å; F567-R569 PolarHBondContact O-N 3.27Å; F567-V572 HydrophobicContact CD1-CB 4.3Å; F567-V572 HydrophobicContact CD1-CG1 3.51Å; F567-V572 HydrophobicContact CE1-CG1 3.99Å; F567-V572 HydrophobicContact CG-CG1 4.24Å; F567-L573 HydrophobicContact CD2-CB 4.11Å; F567-L573 HydrophobicContact CD2-CD1 3.97Å; F567-L573 HydrophobicContact CE2-CD1 4.19Å; F567-H576 HydrophobicContact CE1-CB 4.39Å; F567-H576 HydrophobicContact CE2-CB 4.08Å; F567-H576 AromaticContact CE2-CD2 3.25Å; F567-H576 WeakPolarHBondContact CE2-CD2 3.12Å; F567-H576 AromaticContact CE2-CG 3.73Å; F567-H576 AromaticContact CE2-NE2 3.9Å; F567-H576 HydrophobicContact CZ-CB 3.79Å; F567-H576 AromaticContact CZ-CD2 3.35Å; F567-H576 WeakPolarHBondContact CZ-CD2 3.2Å; F567-H576 AromaticContact CZ-CG 3.4Å; F567-H576 AromaticContact CZ-ND1 3.93Å; F567-H576 AromaticContact CZ-NE2 3.83Å
568	T	84.9	Confident	86.8	Confident	49 Å²	49	81.7 Å²	81.7	30%	0.301	40%	0.403	S	S	.	.	S	Bend	trans	-78.5	-11.5	176.9	61.4	0	0	0	0	113.5	E555 K556	E555-T568 WeakPolarHBondContact O-CG2 3.46Å; K556-T568 HydrophobicContact CG-CG2 3.8Å
569	R	85.1	Confident	86.8	Confident	120 Å²	120	83.4 Å²	83.4	45%	0.453	42%	0.415	S	S	.	.			trans	-141.6	127.5	-174.5	-65.7	172.6	70.9	176.8	0.1	111.5	R547 Y558 F567 A571 V572 L573	R547-R569 HydrophobicContact CG-CG 4.4Å; Y558-R569 VanDerWaalsContact CD2-C 3.49Å; F567-R569 VanDerWaalsContact C-N 3.3Å; F567-R569 PolarHBondContact O-N 3.27Å; R569-A571 PolarHBondContact O-N 3.45Å; R569-V572 HydrophobicContact CB-CB 4.4Å; R569-V572 HydrophobicContact CB-CG2 3.94Å; R569-V572 WeakPolarHBondContact O-CB 3.36Å; R569-V572 PolarHBondContact O-N 3.38Å; R569-L573 PolarHBondContact O-N 2.93Å; R569-L573 VanDerWaalsContact O-N 3.15Å
570	S	86.8	Confident	86.6	Confident	57 Å²	57	81.9 Å²	81.9	40%	0.399	40%	0.401	S	S	.	.	H	α-helix	trans	-57.9	-30.2	174.9	58	0	0	0	0	114.1	Y558 V572 L573 R574	Y558-S570 VanDerWaalsContact CD2-N 3.28Å; S570-V572 VanDerWaalsContact C-N 3.33Å; S570-L573 PolarHBondContact O-N 3.35Å; S570-R574 WeakPolarHBondContact O-CG 3.41Å; S570-R574 PolarHBondContact O-N 3.03Å
571	A	86.7	Confident	85.5	Confident	39 Å²	39	84.5 Å²	84.5	32%	0.322	43%	0.428	S	S	.	.	H	α-helix	trans	-66	-34.1	174.4	0	0	0	0	0	112.9	R569 R575	R569-A571 PolarHBondContact O-N 3.45Å; A571-R575 PolarHBondContact O-N 2.69Å; A571-R575 VanDerWaalsContact O-N 3.12Å
572	V	86.8	Confident	84.2	Confident	59 Å²	59	86.3 Å²	86.3	36%	0.358	43%	0.429	S	S	.	.	H	α-helix	trans	-73.8	-42.6	175.1	-177.8	0	0	0	0	109.5	F567 R569 S570 R574 R575 H576	F567-V572 HydrophobicContact CD1-CB 4.3Å; F567-V572 HydrophobicContact CD1-CG1 3.51Å; F567-V572 HydrophobicContact CE1-CG1 3.99Å; F567-V572 HydrophobicContact CG-CG1 4.24Å; R569-V572 HydrophobicContact CB-CB 4.4Å; R569-V572 HydrophobicContact CB-CG2 3.94Å; R569-V572 WeakPolarHBondContact O-CB 3.36Å; R569-V572 PolarHBondContact O-N 3.38Å; S570-V572 VanDerWaalsContact C-N 3.33Å; V572-R574 VanDerWaalsContact C-N 3.32Å; V572-R574 PolarHBondContact O-N 3.49Å; V572-R575 PolarHBondContact O-N 2.98Å; V572-H576 WeakPolarHBondContact O-CB 3.42Å; V572-H576 PolarHBondContact O-N 2.92Å
573	L	89.9	Confident	82.6	Confident	21 Å²	21	84.2 Å²	84.2	11%	0.11	43%	0.428	C	S	.	.	H	α-helix	trans	-55.7	-43.9	170.9	174.2	62.6	0	0	0	112.1	S559 C560 F567 R569 S570 H576 K577	S559-L573 WeakPolarHBondContact O-CD1 3.41Å; S559-L573 WeakPolarHBondContact O-CD2 3.33Å; C560-L573 HydrophobicContact CB-CD1 3.55Å; F567-L573 HydrophobicContact CD2-CB 4.11Å; F567-L573 HydrophobicContact CD2-CD1 3.97Å; F567-L573 HydrophobicContact CE2-CD1 4.19Å; R569-L573 PolarHBondContact O-N 2.93Å; R569-L573 VanDerWaalsContact O-N 3.15Å; S570-L573 PolarHBondContact O-N 3.35Å; L573-H576 PolarHBondContact O-N 3.39Å; L573-K577 HydrophobicContact CD1-CG 4.07Å; L573-K577 HydrophobicContact CG-CG 4.49Å; L573-K577 PolarHBondContact O-N 3.17Å
574	R	87.4	Confident	80.7	Confident	171 Å²	171	88.7 Å²	88.7	65%	0.645	45%	0.448	S	S	*	.	H	α-helix	trans	-62.9	-42.1	176.3	-75.6	-170.1	-62.4	102.7	-4.7	112.8	S570 V572 H576 K578	S570-R574 WeakPolarHBondContact O-CG 3.41Å; S570-R574 PolarHBondContact O-N 3.03Å; V572-R574 VanDerWaalsContact C-N 3.32Å; V572-R574 PolarHBondContact O-N 3.49Å; R574-H576 VanDerWaalsContact C-N 3.3Å; R574-H576 PolarHBondContact O-N 3.47Å; R574-K578 PolarHBondContact O-N 3.29Å
575	R	87.8	Confident	78.7	Confident	201 Å²	201	88.2 Å²	88.2	76%	0.758	45%	0.45	S	S	*	.	H	α-helix	trans	-61.5	-41.5	174.2	-175.8	179.6	-70.9	179.6	-4.3	110.8	A571 V572 K578 M579	A571-R575 PolarHBondContact O-N 2.69Å; A571-R575 VanDerWaalsContact O-N 3.12Å; V572-R575 PolarHBondContact O-N 2.98Å; R575-K578 PolarHBondContact O-N 3.4Å; R575-M579 PolarHBondContact O-N 3.3Å
576	H	88.6	Confident	76.8	Confident	17 Å²	17	92.1 Å²	92.1	8%	0.079	46%	0.462	C	S	.	.	H	α-helix	trans	-69.5	-41.7	178.9	176.3	62.3	0	0	0	113.6	C563 F567 V572 L573 R574 K578 M579 H580	C563-H576 PolarHBondContact SG-NE2 3.09Å; F567-H576 HydrophobicContact CE1-CB 4.39Å; F567-H576 HydrophobicContact CE2-CB 4.08Å; F567-H576 AromaticContact CE2-CD2 3.25Å; F567-H576 WeakPolarHBondContact CE2-CD2 3.12Å; F567-H576 AromaticContact CE2-CG 3.73Å; F567-H576 AromaticContact CE2-NE2 3.9Å; F567-H576 HydrophobicContact CZ-CB 3.79Å; F567-H576 AromaticContact CZ-CD2 3.35Å; F567-H576 WeakPolarHBondContact CZ-CD2 3.2Å; F567-H576 AromaticContact CZ-CG 3.4Å; F567-H576 AromaticContact CZ-ND1 3.93Å; F567-H576 AromaticContact CZ-NE2 3.83Å; V572-H576 WeakPolarHBondContact O-CB 3.42Å; V572-H576 PolarHBondContact O-N 2.92Å; L573-H576 PolarHBondContact O-N 3.39Å; R574-H576 VanDerWaalsContact C-N 3.3Å; R574-H576 PolarHBondContact O-N 3.47Å; H576-K578 PolarHBondContact O-N 3.47Å; H576-M579 HydrophobicContact CB-SD 4.46Å; H576-M579 WeakPolarHBondContact O-CA 3.17Å; H576-M579 VanDerWaalsContact O-CB 3.27Å; H576-M579 WeakPolarHBondContact O-CB 3.41Å; H576-M579 PolarHBondContact O-N 2.73Å; H576-H580 AromaticContact CD2-NE2 3.72Å; H576-H580 AromaticContact CE1-CE1 3.65Å; H576-H580 AromaticContact CE1-NE2 3.27Å; H576-H580 PolarHBondContact CE1-NE2 2.92Å; H576-H580 VanDerWaalsContact CE1-NE2 3.27Å; H576-H580 AromaticContact NE2-CD2 3.98Å; H576-H580 AromaticContact NE2-CE1 3.76Å; H576-H580 AromaticContact NE2-NE2 3Å; H576-H580 PolarHBondContact NE2-NE2 3.25Å; H576-H580 PolarHBondContact O-N 3.45Å
577	K	87.4	Confident	74.4	Confident	70 Å²	70	93.5 Å²	93.5	30%	0.304	47%	0.472	S	S	.	.	H	α-helix	trans	-59.5	-32.6	171.4	-74.9	-165.2	-179.3	-172.8	0	112.3	E561 L573 M579 H580 G581	E561-K577 WeakPolarHBondContact OE1-CE 3.34Å; E561-K577 IonicContact OE1-NZ 2.69Å; E561-K577 PolarHBondContact OE1-NZ 3.25Å; E561-K577 IonicContact OE2-NZ 2.7Å; E561-K577 PolarHBondContact OE2-NZ 3.21Å; L573-K577 HydrophobicContact CD1-CG 4.07Å; L573-K577 HydrophobicContact CG-CG 4.49Å; L573-K577 PolarHBondContact O-N 3.17Å; K577-M579 PolarHBondContact O-N 3.5Å; K577-H580 PolarHBondContact O-N 3.45Å; K577-G581 PolarHBondContact O-N 2.85Å
578	K	87.6	Confident	72.6	Confident	148 Å²	148	97.5 Å²	97.5	64%	0.643	50%	0.502	S	S	*	.	H	α-helix	trans	-70.9	-12	172.1	-170.2	168.6	-179.1	176.9	0	113.8	R574 R575 H576	R574-K578 PolarHBondContact O-N 3.29Å; R575-K578 PolarHBondContact O-N 3.4Å; H576-K578 PolarHBondContact O-N 3.47Å
579	M	84.8	Confident	70.2	Confident	116 Å²	116	99 Å²	99	57%	0.571	52%	0.519	S	S	*	.	H	α-helix	trans	-81.4	-37.3	171.6	-61.4	162.5	58.3	0	0	111.7	R575 H576 K577 R582 A583	R575-M579 PolarHBondContact O-N 3.3Å; H576-M579 HydrophobicContact CB-SD 4.46Å; H576-M579 WeakPolarHBondContact O-CA 3.17Å; H576-M579 VanDerWaalsContact O-CB 3.27Å; H576-M579 WeakPolarHBondContact O-CB 3.41Å; H576-M579 PolarHBondContact O-N 2.73Å; K577-M579 PolarHBondContact O-N 3.5Å; M579-R582 WeakPolarHBondContact O-CB 3.34Å; M579-R582 PolarHBondContact O-N 2.96Å; M579-R582 VanDerWaalsContact O-N 3.07Å; M579-A583 PolarHBondContact O-N 3.49Å
580	H	82.3	Confident	67.9	Low	32 Å²	32	99 Å²	99	15%	0.148	53%	0.533	C	S	.	.	H	α-helix	trans	-62.6	-48.5	176.5	-63.9	-52.1	0	0	0	111.4	I562 C563 H576 K577 R582 A583 D584	I562-H580 HydrophobicContact CD1-CB 3.71Å; I562-H580 HydrophobicContact CG2-CB 4.02Å; C563-H580 PolarHBondContact SG-CE1 3.22Å; C563-H580 PolarHBondContact SG-NE2 3.45Å; C563-H580 VanDerWaalsContact SG-NE2 3.36Å; H576-H580 AromaticContact CD2-NE2 3.72Å; H576-H580 AromaticContact CE1-CE1 3.65Å; H576-H580 AromaticContact CE1-NE2 3.27Å; H576-H580 PolarHBondContact CE1-NE2 2.92Å; H576-H580 VanDerWaalsContact CE1-NE2 3.27Å; H576-H580 AromaticContact NE2-CD2 3.98Å; H576-H580 AromaticContact NE2-CE1 3.76Å; H576-H580 AromaticContact NE2-NE2 3Å; H576-H580 PolarHBondContact NE2-NE2 3.25Å; H576-H580 PolarHBondContact O-N 3.45Å; K577-H580 PolarHBondContact O-N 3.45Å; H580-R582 PolarHBondContact O-N 2.73Å; H580-A583 WeakPolarHBondContact O-CB 3.04Å; H580-A583 PolarHBondContact O-N 2.98Å; H580-D584 PolarHBondContact O-N 3.28Å
581	G	67.8	Low	65.9	Low	56 Å²	56	103.7 Å²	103.7	58%	0.577	55%	0.552	S	S	*	*	H	α-helix	trans	-67.8	20.4	169.9	0	0	0	0	0	115.7	K577	K577-G581 PolarHBondContact O-N 2.85Å
582	R	59.8	Low	63.5	Low	180 Å²	180	109.1 Å²	109.1	68%	0.679	58%	0.576	S	S	*	*	H	α-helix	trans	-121.1	-12.8	161.7	-71.8	-169.4	176.5	-74.1	16.4	113.1	M579 H580	M579-R582 WeakPolarHBondContact O-CB 3.34Å; M579-R582 PolarHBondContact O-N 2.96Å; M579-R582 VanDerWaalsContact O-N 3.07Å; H580-R582 PolarHBondContact O-N 2.73Å
583	A	52.5	Low	61.2	Low	61 Å²	61	114.7 Å²	114.7	50%	0.504	60%	0.598	S	S	.	*	H	α-helix	trans	-81.2	-43.7	172.9	0	0	0	0	0	110.8	M579 H580 A585 R586	M579-A583 PolarHBondContact O-N 3.49Å; H580-A583 WeakPolarHBondContact O-CB 3.04Å; H580-A583 PolarHBondContact O-N 2.98Å; A583-A585 PolarHBondContact O-N 3.32Å; A583-R586 PolarHBondContact O-N 3.02Å
584	D	47.6	Very low	58.6	Low	139 Å²	139	120.7 Å²	120.7	74%	0.743	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-7.6	-179	-47.5	-41	0	0	0	114	H580	H580-D584 PolarHBondContact O-N 3.28Å
585	A	42.4	Very low	56.2	Low	86 Å²	86	117.4 Å²	117.4	71%	0.711	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	4.8	175.1	0	0	0	0	0	113.8	A583	A583-A585 PolarHBondContact O-N 3.32Å
586	R	45.2	Very low	53.9	Low	212 Å²	212	116.4 Å²	116.4	80%	0.8	64%	0.637	S	S	*	*			trans	-104.2	89.3	173	-79.6	-173.4	166.3	-175.3	-6.7	111	A583	A583-R586 PolarHBondContact O-N 3.02Å
587	S	36.5	Very low	51.1	Low	89 Å²	89	120.7 Å²	120.7	62%	0.622	66%	0.664	S	S	*	*			trans	-59.2	139.3	154.9	-176.6	0	0	0	0	109.2	A589	S587-A589 PolarHBondContact O-N 3.49Å
588	P	45.9	Very low	48.5	Very low	124 Å²	124	125 Å²	125	81%	0.805	69%	0.689	S	S	*	*	S	Bend	trans	-78.7	55.8	-175.5	34.4	-37.6	0	0	0	112.4
589	A	34.9	Very low	45.6	Very low	81 Å²	81	126.2 Å²	126.2	67%	0.669	70%	0.696	S	S	*	*	S	Bend	trans	-123.3	3.7	-172.2	0	0	0	0	0	114.7	S587	S587-A589 PolarHBondContact O-N 3.49Å
590	V	38.3	Very low	42.9	Very low	121 Å²	121	126.9 Å²	126.9	73%	0.733	71%	0.707	S	S	*	*			trans	-143.7	70.8	175.5	-84.5	0	0	0	0	109.6
591	L	43	Very low	40.5	Very low	155 Å²	155	130.8 Å²	130.8	81%	0.812	74%	0.738	S	S	*	*	S	Bend	trans	-124.5	23.9	178.9	-117.8	175.5	0	0	0	113.1
592	D	37.1	Very low	38.7	Very low	153 Å²	153	135.3 Å²	135.3	82%	0.818	75%	0.749	S	S	*	*	S	Bend	trans	-127	-19.9	-178.1	-149.2	31.7	0	0	0	113.5
593	E	37.6	Very low	37.2	Very low	175 Å²	175	134.6 Å²	134.6	82%	0.818	76%	0.758	S	S	*	*	S	Bend	trans	-106.9	14.8	-170.7	-145.6	-167.9	155.5	0	0	115.1
594	L	36	Very low	35.9	Very low	147 Å²	147	138.1 Å²	138.1	77%	0.77	77%	0.768	S	S	*	*	S	Bend	trans	-127.3	17.2	177.2	-77.5	173.5	0	0	0	113.8	Q596	L594-Q596 VanDerWaalsContact C-N 3.33Å
595	S	37.3	Very low	34.9	Very low	102 Å²	102	141.6 Å²	141.6	71%	0.713	77%	0.771	S	S	*	*	S	Bend	trans	-86.8	-0.2	175.1	-56.2	0	0	0	0	113.3
596	Q	39.9	Very low	34.3	Very low	181 Å²	181	142.4 Å²	142.4	85%	0.846	77%	0.771	S	S	*	*	S	Bend	trans	-136.4	62.6	-175.4	-63.2	-171.8	17.8	0	0	112.8	L594	L594-Q596 VanDerWaalsContact C-N 3.33Å
597	T	28.8	Very low	33.5	Very low	106 Å²	106	140.1 Å²	140.1	65%	0.65	77%	0.77	S	S	*	*	S	Bend	trans	-154.8	80.4	157.3	7.6	0	0	0	0	111.9
598	I	32.2	Very low	33.1	Very low	162 Å²	162	141.8 Å²	141.8	83%	0.831	78%	0.782	S	S	*	*			trans	55.7	119.4	132.8	-62.9	167	0	0	0	118.3
599	E	28.3	Very low	32.1	Very low	172 Å²	172	141.4 Å²	141.4	80%	0.804	78%	0.782	S	S	*	*			trans	-65.8	152	166	-52.9	159	113	0	0	112
600	T	28.3	Very low	31.7	Very low	130 Å²	130	145.4 Å²	145.4	80%	0.798	79%	0.792	S	S	*	*				173.9	145.6	120.7	29.7	0	0	0	0	115
601	S	30.7	Very low	31.4	Very low	114 Å²	114	145.5 Å²	145.5	80%	0.797	80%	0.798	S	S	*	*			trans	56.4	119.9	153.1	57.3	0	0	0	0	122.4
602	D	30.4	Very low	30.5	Very low	152 Å²	152	146.7 Å²	146.7	81%	0.813	80%	0.797	S	S	*	*			trans	-70.8	155.1	152	-66.4	-88.7	0	0	0	112.5
603	L	28.4	Very low	30.2	Very low	164 Å²	164	144.7 Å²	144.7	86%	0.859	80%	0.795	S	S	*	*				179.6	157.2	106.7	-95.6	169.8	0	0	0	114.8
604	D	26.1	Very low	29.8	Very low	135 Å²	135	144.4 Å²	144.4	72%	0.722	79%	0.793	S	S	*	*			trans	29.5	121.1	166.5	-106.5	-53.6	0	0	0	121.6
605	R	25.9	Very low	29.3	Very low	213 Å²	213	144.5 Å²	144.5	80%	0.804	79%	0.794	S	S	*	*				-162.4	134.2	84.4	-167.9	159.6	64.9	-176.3	-1.5	113.5
606	S	29.2	Very low	29	Very low	102 Å²	102	145.9 Å²	145.9	71%	0.713	80%	0.799	S	S	*	*			trans	-72.7	127.9	172.8	60	0	0	0	0	113.1
607	Q	27.8	Very low	28.4	Very low	164 Å²	164	142.8 Å²	142.8	77%	0.766	80%	0.797	S	S	*	*			trans	-156	148.4	162.2	-119	166.4	63.8	0	0	112.4
608	S	29	Very low	28.2	Very low	125 Å²	125	144.3 Å²	144.3	87%	0.874	81%	0.806	S	S	*	*			trans	-90.9	113.3	-167.3	48.4	0	0	0	0	113.3
609	S	25.7	Very low	27.9	Very low	115 Å²	115	142.6 Å²	142.6	80%	0.804	80%	0.803	S	S	*	*			trans	-110.8	105.2	178	45.4	0	0	0	0	112.4
610	D	24.8	Very low	27.7	Very low	166 Å²	166	142.4 Å²	142.4	89%	0.888	81%	0.806	S	S	*	*			trans	-154.1	57.7	162.2	-127.2	-11.3	0	0	0	109
611	S	33.8	Very low	28.1	Very low	122 Å²	122	141.1 Å²	141.1	85%	0.853	80%	0.801	S	S	*	*			trans	-147	110.3	173.4	-73.5	0	0	0	0	109
612	F	23.9	Very low	27.8	Very low	181 Å²	181	142.6 Å²	142.6	79%	0.794	80%	0.804	S	S	*	*			trans	-147.4	95.4	172.9	-152.1	-108.2	0	0	0	108.9	Q614	F612-Q614 HydrophobicContact CD1-CG 3.86Å; F612-Q614 HydrophobicContact CE1-CG 3.46Å; F612-Q614 VanDerWaalsContact CE1-CG 3.46Å; F612-Q614 HydrophobicContact CZ-CG 4.41Å
613	S	29.8	Very low	27.5	Very low	110 Å²	110	140.7 Å²	140.7	77%	0.769	80%	0.803	S	S	*	*			trans	-87.8	137.6	152	-66.3	0	0	0	0	106.6
614	Q	29.1	Very low	27.4	Very low	169 Å²	169	139.9 Å²	139.9	79%	0.79	80%	0.804	S	S	*	*			trans	-91.6	132.4	165.4	-69.1	175	-77.5	0	0	107.8	F612	F612-Q614 HydrophobicContact CD1-CG 3.86Å; F612-Q614 HydrophobicContact CE1-CG 3.46Å; F612-Q614 VanDerWaalsContact CE1-CG 3.46Å; F612-Q614 HydrophobicContact CZ-CG 4.41Å
615	D	26.9	Very low	27.3	Very low	149 Å²	149	142.1 Å²	142.1	80%	0.797	81%	0.808	S	S	*	*			trans	-130.3	164.4	164.5	-94.2	-58.1	0	0	0	109.4
616	V	29.7	Very low	27.1	Very low	132 Å²	132	139.5 Å²	139.5	80%	0.8	81%	0.809	S	S	*	*			trans	-77.5	139.6	-161.9	-178.7	0	0	0	0	112.4
617	S	27.1	Very low	27.4	Very low	116 Å²	116	139.5 Å²	139.5	81%	0.811	81%	0.807	S	S	*	*			trans	-100.1	126.8	168.3	-58.9	0	0	0	0	110.9
618	V	25.5	Very low	27.2	Very low	137 Å²	137	137.3 Å²	137.3	83%	0.83	80%	0.804	S	S	*	*			trans	-111.4	136.2	163	175.9	0	0	0	0	107.8
619	T	25.9	Very low	27	Very low	126 Å²	126	139.6 Å²	139.6	77%	0.773	80%	0.801	S	S	*	*			trans	-85	146.1	-174.5	-27	0	0	0	0	112
620	L	24.1	Very low	27.3	Very low	168 Å²	168	139.3 Å²	139.3	88%	0.88	80%	0.796	S	S	*	*				-176.2	156.7	124.8	-94.3	173.7	0	0	0	110.2
621	P	35.4	Very low	27.4	Very low	104 Å²	104	137.1 Å²	137.1	68%	0.675	79%	0.788	S	S	*	*			trans	-119.3	162.8	-167.5	41.8	-31.9	0	0	0	115.8
622	V	24.5	Very low	26.9	Very low	145 Å²	145	139.8 Å²	139.8	88%	0.879	79%	0.787	S	S	*	*			trans	-142.9	143.8	157	-178.7	0	0	0	0	109.3
623	S	25.5	Very low	26.9	Very low	111 Å²	111	136.4 Å²	136.4	78%	0.776	79%	0.786	S	S	*	*			trans	-121.7	140.3	-176.8	-55.1	0	0	0	0	112.5
624	V	24.7	Very low	26.7	Very low	147 Å²	147	136 Å²	136	89%	0.891	78%	0.783	S	S	*	*			trans	-139.9	155.8	161.8	-174.4	0	0	0	0	110.1
625	K	24.6	Very low	26.4	Very low	183 Å²	183	134.4 Å²	134.4	80%	0.796	78%	0.784	S	S	*	*			trans	-95.4	143.6	-167.8	-80.7	176.9	174.3	176.5	0	114.5
626	L	22.2	Very low	26.5	Very low	157 Å²	157	132.3 Å²	132.3	82%	0.822	79%	0.788	S	S	*	*				39.4	175.1	122.8	-69.3	169.7	0	0	0	121.7
627	P	34.4	Very low	26.1	Very low	103 Å²	103	130.4 Å²	130.4	67%	0.669	79%	0.786	S	S	*	*			cis	-136.2	-164.6	-8.7	21.6	6	0	0	0	115.5
628	V	23.9	Very low	26	Very low	118 Å²	118	134.5 Å²	134.5	72%	0.715	79%	0.79	S	S	*	*			trans	81.3	113	156.6	-167.1	0	0	0	0	116.3
629	H	25.3	Very low	25.8	Very low	173 Å²	173	136 Å²	136	80%	0.801	79%	0.787	S	S	*	*				82.1	154.5	53.7	-79.3	-77.2	0	0	0	114.9
630	P	33.1	Very low	25.8	Very low	108 Å²	108	133.7 Å²	133.7	70%	0.701	79%	0.789	S	S	*	*			cis	-138.9	-132.5	-38.4	41.7	-22.2	0	0	0	112.3
631	V	25.3	Very low	25.9	Very low	120 Å²	120	133.9 Å²	133.9	73%	0.727	79%	0.785	S	S	*	*			trans	91.3	107.5	-178.5	-179.4	0	0	0	0	113.2
632	E	24	Very low	25.3	Very low	179 Å²	179	133.9 Å²	133.9	84%	0.836	79%	0.786	S	S	*	*				76.7	143	56.1	-70.4	-172.4	177.2	0	0	114.4
633	S	24	Very low	25.4	Very low	109 Å²	109	133.5 Å²	133.5	76%	0.762	78%	0.784	S	S	*	*			cis	-166.9	-173.7	-17.6	-169	0	0	0	0	109.4
634	S	25.8	Very low	25.4	Very low	102 Å²	102	131.3 Å²	131.3	71%	0.713	78%	0.78	S	S	*	*			trans	69.2	116.7	174.8	-146.6	0	0	0	0	115.9
635	V	23.3	Very low	25.6	Very low	135 Å²	135	130.1 Å²	130.1	82%	0.818	78%	0.778	S	S	*	*			cis	77.6	107.4	40.6	-174.6	0	0	0	0	114.1
636	A	27.3	Very low	25.8	Very low	105 Å²	105	130.8 Å²	130.8	87%	0.868	78%	0.777	S	S	*	*			trans	-163.9	139	139.6	0	0	0	0	0	108.3
637	A	22.2	Very low	26.1	Very low	92 Å²	92	129.4 Å²	129.4	76%	0.76	78%	0.779	S	S	*	*			trans	-130.9	153.7	177.2	0	0	0	0	0	110.1
638	F	24.2	Very low	25.7	Very low	203 Å²	203	133.7 Å²	133.7	89%	0.89	79%	0.787	S	S	*	*			trans	-157.7	155.6	155.9	-117.1	-74.6	0	0	0	111.4
639	E	22.7	Very low	25.9	Very low	167 Å²	167	135.8 Å²	135.8	78%	0.78	79%	0.793	S	S	*	*			trans	-86.1	164.4	-169.1	-60.2	164.3	104.6	0	0	114.2
640	G	25.9	Very low	25.8	Very low	79 Å²	79	139.8 Å²	139.8	81%	0.814	80%	0.801	S	S	*	*			trans	-175.4	106.8	171.8	0	0	0	0	0	112.9
641	H	25.4	Very low	25.4	Very low	172 Å²	172	140.3 Å²	140.3	80%	0.796	81%	0.807	S	S	*	*			trans	-88.2	162.2	-174.3	-88.6	-93.9	0	0	0	114.9
642	C	23.8	Very low	25.6	Very low	103 Å²	103	142.6 Å²	142.6	70%	0.696	81%	0.812	S	S	*	*			trans	90	127.1	145.4	-81	0	0	0	0	122.7
643	T	26.2	Very low	25.5	Very low	137 Å²	137	144 Å²	144	84%	0.84	82%	0.816	S	S	*	*			trans	68.1	137.5	137.4	57.5	0	0	0	0	122.3
644	G	25.5	Very low	25.6	Very low	66 Å²	66	147.3 Å²	147.3	68%	0.68	82%	0.819	S	S	*	*				106.6	105	118.8	0	0	0	0	0	117
645	S	28.6	Very low	26.8	Very low	121 Å²	121	147.4 Å²	147.4	85%	0.846	82%	0.817	S	S	*	*			trans	-52.4	143.4	173.3	56.2	0	0	0	0	115.5
646	Y	28	Very low	27.3	Very low	198 Å²	198	147.1 Å²	147.1	78%	0.776	82%	0.818	S	S	*	*			trans	-153.4	142.6	140.5	51.2	-91.4	0	0	0	112.6
647	C	28.4	Very low	27.3	Very low	127 Å²	127	147 Å²	147	86%	0.858	81%	0.811	S	S	*	*			trans	-87.9	149.5	164.7	-63.7	0	0	0	0	109.6
648	K	26.7	Very low	27.6	Very low	193 Å²	193	151.6 Å²	151.6	84%	0.839	82%	0.819	S	S	*	*			trans	-147.4	131	166.5	-124.6	167.3	-174.3	169.7	0	112
649	L	27.6	Very low	27.6	Very low	162 Å²	162	147.9 Å²	147.9	85%	0.848	82%	0.818	S	S	*	*			trans	-86.3	160.6	172.2	-69.9	76.2	0	0	0	110.1
650	R	24.4	Very low	27.9	Very low	258 Å²	258	146 Å²	146	97%	0.974	81%	0.813	S	S	*	*			trans	-148.6	166.1	135.9	-123.5	176.4	-179.1	177.2	-0.7	111.7
651	S	24.7	Very low	28.1	Very low	118 Å²	118	150.3 Å²	150.3	83%	0.825	81%	0.812	S	S	*	*			trans	-122.8	176	-166.2	-162.5	0	0	0	0	112.6
652	M	30	Very low	28.1	Very low	168 Å²	168	147.8 Å²	147.8	83%	0.828	81%	0.805	S	S	*	*			trans	-66.3	162.6	-176.7	-61.2	176.2	167.7	0	0	115.1
653	F	21.3	Very low	28.4	Very low	210 Å²	210	150.4 Å²	150.4	92%	0.921	80%	0.804	S	S	*	*			trans	-152.7	154.4	148.6	-101	-72.5	0	0	0	112.4
654	H	25.8	Very low	28.4	Very low	178 Å²	178	151.9 Å²	151.9	82%	0.824	81%	0.806	S	S	*	*			trans	-168.7	169	179.3	-123.1	-18.7	0	0	0	106.4
655	P	50.1	Low	28.5	Very low	104 Å²	104	151.5 Å²	151.5	68%	0.675	80%	0.802	S	S	*	*			cis	-118.3	-153.5	-24	35.3	-14.8	0	0	0	110.4
656	P	35.6	Very low	28.5	Very low	129 Å²	129	154.5 Å²	154.5	84%	0.838	81%	0.808	S	S	*	*				-144.6	-163.4	97.5	39.7	-22.7	0	0	0	114.2
657	S	25.9	Very low	28.3	Very low	103 Å²	103	152.2 Å²	152.2	72%	0.72	81%	0.809	S	S	*	*			trans	-148.6	144.4	-155.1	58.7	0	0	0	0	117.9
658	M	29.2	Very low	28.9	Very low	187 Å²	187	151.5 Å²	151.5	92%	0.921	80%	0.803	S	S	*	*			trans	56.6	138.5	150.5	-55.3	-50	-175.7	0	0	123.6
659	S	23.7	Very low	29	Very low	125 Å²	125	146.2 Å²	146.2	87%	0.874	80%	0.795	S	S	*	*			trans	-160.2	172.8	140.6	-162	0	0	0	0	110
660	D	30	Very low	29.3	Very low	128 Å²	128	148 Å²	148	68%	0.684	80%	0.796	S	S	*	*			trans	-106.9	157.1	-152.1	-98.1	-72.3	0	0	0	119.6
661	Q	28.6	Very low	29.2	Very low	170 Å²	170	143.5 Å²	143.5	79%	0.794	79%	0.79	S	S	*	*			trans	15.6	139	148.7	-65.5	168.1	70.7	0	0	122.9
662	D	26.6	Very low	29.1	Very low	118 Å²	118	143.9 Å²	143.9	63%	0.631	79%	0.788	S	S	*	*				-162.4	164.4	100.3	-145.5	-6.8	0	0	0	114.5
663	K	28.8	Very low	29	Very low	159 Å²	159	143.7 Å²	143.7	69%	0.691	78%	0.782	S	S	*	*			trans	-0.5	141.1	164.2	-69.1	154.2	-163.9	82.1	0	119
664	L	28.2	Very low	29.5	Very low	167 Å²	167	139.1 Å²	139.1	87%	0.874	77%	0.773	S	S	*	*			cis	-165	-178.4	9.1	-105.9	164.1	0	0	0	107.9
665	G	26.3	Very low	29.4	Very low	58 Å²	58	137.4 Å²	137.4	60%	0.598	77%	0.766	S	S	*	*			cis	164.2	-175.9	2	0	0	0	0	0	112.8
666	L	28.1	Very low	28.2	Very low	184 Å²	184	139.3 Å²	139.3	96%	0.963	77%	0.766	S	S	*	*			trans	69.1	143.4	-177.6	-69.6	172.5	0	0	0	118.2
667	D	25.4	Very low	27.7	Very low	150 Å²	150	139.7 Å²	139.7	80%	0.802	76%	0.76	S	S	*	*			trans	-159	171.5	-170.5	-145.7	5.3	0	0	0	106.3
668	P	41.1	Very low	27.7	Very low	113 Å²	113	143.1 Å²	143.1	73%	0.734	77%	0.765	S	S	*	*			cis	-135.5	-163.5	-6.2	44	-25.3	0	0	0	115.3
669	A	28.4	Very low	27.3	Very low	81 Å²	81	139 Å²	139	67%	0.669	75%	0.754	S	S	*	*			trans	-80.3	163.1	-162.4	0	0	0	0	0	120.6
670	K	32.6	Very low	27.4	Very low	201 Å²	201	140.3 Å²	140.3	87%	0.874	75%	0.747	S	S	*	*			trans	72.9	124.5	139.9	-80.1	170.7	179.9	178.3	0	123.1
671	L	23.6	Very low	27.6	Very low	162 Å²	162	139.8 Å²	139.8	85%	0.848	75%	0.75	S	S	*	*			trans	-162.2	166.1	147.5	-132.9	68	0	0	0	107.4
672	T	22.8	Very low	27.5	Very low	127 Å²	127	137.8 Å²	137.8	78%	0.779	74%	0.74	S	S	*	*			cis	-144.4	-134.3	3.5	-37.4	0	0	0	0	110
673	K	27.8	Very low	27.4	Very low	164 Å²	164	137.9 Å²	137.9	71%	0.713	75%	0.746	S	S	*	*			trans	-157.1	160.8	174.8	-143.6	-175.4	-176.7	-173.1	0	107.2
674	P	30.4	Very low	27.1	Very low	113 Å²	113	141.8 Å²	141.8	73%	0.734	76%	0.758	S	S	*	*				-139.1	168.1	83.9	20.1	4.6	0	0	0	113.1
675	Q	24.7	Very low	27.1	Very low	142 Å²	142	138 Å²	138	66%	0.664	75%	0.75	S	S	*	*				65.1	135.6	58.9	-96.9	176.2	-100.1	0	0	113.4
676	E	25	Very low	27.1	Very low	144 Å²	144	146 Å²	146	67%	0.673	76%	0.764	S	S	*	*			cis	-157.1	-178.4	25.7	-123.3	175.9	-133.2	0	0	111.3
677	L	23.9	Very low	27.1	Very low	138 Å²	138	141.8 Å²	141.8	72%	0.723	75%	0.75	S	S	*	*			cis	-160.3	-174.8	-7.7	-172.8	47.7	0	0	0	109.3
678	Q	25.9	Very low	27.2	Very low	175 Å²	175	142.5 Å²	142.5	82%	0.818	75%	0.754	S	S	*	*			trans	78.1	140.4	161.9	-64.9	-169.1	-16.9	0	0	119.8
679	S	22.4	Very low	26.6	Very low	100 Å²	100	141.9 Å²	141.9	70%	0.699	76%	0.758	S	S	*	*			cis	-167.1	123.2	-18	51.7	0	0	0	0	113.9
680	Q	25.4	Very low	26.5	Very low	153 Å²	153	145.2 Å²	145.2	72%	0.715	77%	0.765	S	S	*	*			trans	46.1	161.5	135.2	-82.3	-165.6	-10.6	0	0	123.5	H682	Q680-H682 VanDerWaalsContact CD-CD2 3.4Å; Q680-H682 PolarHBondContact NE2-CD2 2.82Å; Q680-H682 VanDerWaalsContact NE2-CD2 3.31Å; Q680-H682 PolarHBondContact NE2-NE2 2.91Å; Q680-H682 PolarHBondContact OE1-CD2 3.4Å; Q680-H682 VanDerWaalsContact OE1-CD2 3.26Å
681	P	33.3	Very low	26.2	Very low	116 Å²	116	141.8 Å²	141.8	75%	0.753	76%	0.761	S	S	*	*			cis	-116.7	157.3	29.7	20.8	3.4	0	0	0	116
682	H	27.5	Very low	26.4	Very low	128 Å²	128	139.9 Å²	139.9	59%	0.593	76%	0.761	S	S	*	*				54.6	123.4	76.9	-75	-57.8	0	0	0	115.1	Q680	Q680-H682 VanDerWaalsContact CD-CD2 3.4Å; Q680-H682 PolarHBondContact NE2-CD2 2.82Å; Q680-H682 VanDerWaalsContact NE2-CD2 3.31Å; Q680-H682 PolarHBondContact NE2-NE2 2.91Å; Q680-H682 PolarHBondContact OE1-CD2 3.4Å; Q680-H682 VanDerWaalsContact OE1-CD2 3.26Å
683	T	23.1	Very low	26.6	Very low	121 Å²	121	138.3 Å²	138.3	74%	0.742	76%	0.761	S	S	*	*			cis	77.1	131.6	18.5	68	0	0	0	0	120
684	Y	23.9	Very low	26.5	Very low	241 Å²	241	135.1 Å²	135.1	95%	0.945	77%	0.765	S	S	*	*			trans	-147.7	157.5	165	-111.6	-88.4	0	0	0	109.6
685	A	27	Very low	26.3	Very low	86 Å²	86	134.4 Å²	134.4	71%	0.711	77%	0.769	S	S	*	*			trans	-158.4	-162.7	-172.1	0	0	0	0	0	112.8
686	Y	27.4	Very low	26.2	Very low	226 Å²	226	135 Å²	135	89%	0.886	77%	0.771	S	S	*	*			trans	84.1	144.1	178.3	-84.1	-120.4	0	0	0	116.6
687	S	28.1	Very low	26.3	Very low	97 Å²	97	136.2 Å²	136.2	68%	0.678	78%	0.777	S	S	*	*			cis	-169.6	169.1	-10.2	44.3	0	0	0	0	113.9
688	D	26.7	Very low	26.3	Very low	165 Å²	165	134 Å²	134	88%	0.882	77%	0.773	S	S	*	*			trans	-85.5	167.1	177.6	-47.1	-90.1	0	0	0	116
689	A	28.7	Very low	26.3	Very low	99 Å²	99	134.1 Å²	134.1	82%	0.818	77%	0.774	S	S	*	*			trans	-165.9	153.1	155.3	0	0	0	0	0	112.7
690	D	25.9	Very low	26.4	Very low	151 Å²	151	133.5 Å²	133.5	81%	0.807	77%	0.774	S	S	*	*			trans	-95.3	164.3	-167.1	-57.4	-90.1	0	0	0	117.7
691	T	25.9	Very low	26.4	Very low	130 Å²	130	134.1 Å²	134.1	80%	0.798	78%	0.783	S	S	*	*				174.1	121.5	109.7	29.7	0	0	0	0	117.3
692	S	28.7	Very low	26	Very low	121 Å²	121	130.9 Å²	130.9	85%	0.846	77%	0.77	S	S	*	*			trans	60.2	153	144.7	78	0	0	0	0	121.1
693	A	27	Very low	26	Very low	95 Å²	95	133.6 Å²	133.6	79%	0.785	79%	0.785	S	S	*	*			cis	-159.5	175.4	8.6	0	0	0	0	0	112.9
694	A	25.4	Very low	26.1	Very low	97 Å²	97	132.2 Å²	132.2	80%	0.802	79%	0.786	S	S	*	*			trans	68	126.8	176	0	0	0	0	0	117.1
695	A	26.7	Very low	26.3	Very low	97 Å²	97	127 Å²	127	80%	0.802	78%	0.779	S	S	*	*			cis	84.1	123.7	40.8	0	0	0	0	0	112.6
696	E	23.3	Very low	26.2	Very low	155 Å²	155	130 Å²	130	72%	0.724	79%	0.789	S	S	*	*			cis	-137.3	174.4	14.5	-79.1	-128.6	78.6	0	0	111.8
697	Q	25.6	Very low	26.1	Very low	170 Å²	170	130.3 Å²	130.3	79%	0.794	79%	0.788	S	S	*	*			cis	75.7	146	33.9	-64.2	-167	143.3	0	0	115.4
698	S	25.5	Very low	25.9	Very low	90 Å²	90	131.1 Å²	131.1	63%	0.629	79%	0.794	S	S	*	*			cis	-160.7	152.5	0.9	50.7	0	0	0	0	114.3
699	Q	24.4	Very low	25.9	Very low	179 Å²	179	128.3 Å²	128.3	84%	0.836	79%	0.787	S	S	*	*			trans	59.5	158.6	149.3	-70.4	178	-103.1	0	0	120.3
700	A	24.9	Very low	25.8	Very low	86 Å²	86	130.8 Å²	130.8	71%	0.711	79%	0.786	S	S	*	*			cis	87.3	133.1	9.4	0	0	0	0	0	117.7
701	D	25.5	Very low	25.8	Very low	167 Å²	167	127.5 Å²	127.5	89%	0.893	78%	0.78	S	S	*	*			cis	-142.1	-151.9	-0.8	-156.2	-139	0	0	0	108.3
702	G	24.8	Very low	25.8	Very low	47 Å²	47	127.2 Å²	127.2	49%	0.485	78%	0.778	S	S	.	*			cis	169.5	-176.3	5.7	0	0	0	0	0	113.5
703	M	27.3	Very low	25.7	Very low	185 Å²	185	129.8 Å²	129.8	91%	0.911	78%	0.781	S	S	*	*			trans	70.2	144.3	173.6	-48.5	-167.7	-172.1	0	0	116.4
704	A	25.5	Very low	25.6	Very low	93 Å²	93	131.8 Å²	131.8	77%	0.769	78%	0.779	S	S	*	*			cis	75.2	139.2	34.3	0	0	0	0	0	113
705	V	27.3	Very low	25.7	Very low	130 Å²	130	133 Å²	133	79%	0.788	77%	0.772	S	S	*	*			cis	-152	154.5	24.7	-170.8	0	0	0	0	110.4
706	T	26.1	Very low	25.7	Very low	149 Å²	149	136.6 Å²	136.6	91%	0.914	77%	0.772	S	S	*	*			trans	-176.1	171	136.3	21.9	0	0	0	0	110.7
707	R	24.4	Very low	26.1	Very low	233 Å²	233	135.1 Å²	135.1	88%	0.879	78%	0.777	S	S	*	*			trans	-167.5	113.2	-157.6	164.1	-168.5	170.7	-166.7	-1	113.8
708	S	24	Very low	26.5	Very low	114 Å²	114	132.9 Å²	132.9	80%	0.797	78%	0.777	S	S	*	*			trans	-172.1	141	157.9	-78.4	0	0	0	0	109.4
709	S	26.9	Very low	26.7	Very low	106 Å²	106	136.9 Å²	136.9	74%	0.741	79%	0.786	S	S	*	*			cis	74.2	135.7	36.4	-53.3	0	0	0	0	113.1
710	L	26.3	Very low	27.5	Very low	152 Å²	152	134.3 Å²	134.3	80%	0.796	79%	0.785	S	S	*	*			cis	-149.5	153.4	1.6	-150	87.5	0	0	0	108.2
711	A	26.2	Very low	27.7	Very low	81 Å²	81	138.2 Å²	138.2	67%	0.669	79%	0.793	S	S	*	*				151.9	126	104.5	0	0	0	0	0	106.8
712	T	26.7	Very low	27.7	Very low	125 Å²	125	133.7 Å²	133.7	77%	0.767	79%	0.786	S	S	*	*				58.7	111.6	73.3	62.9	0	0	0	0	116.9
713	L	26.3	Very low	27.8	Very low	175 Å²	175	137.1 Å²	137.1	92%	0.916	80%	0.802	S	S	*	*			trans	-164.4	146.5	137.6	-110.3	170	0	0	0	111.6
714	D	24.4	Very low	27.7	Very low	136 Å²	136	140.4 Å²	140.4	73%	0.727	80%	0.804	S	S	*	*			trans	-96.7	156.1	177.6	-76.9	-76.4	0	0	0	112.3
715	N	27.7	Very low	27.8	Very low	124 Å²	124	140 Å²	140	66%	0.663	80%	0.801	S	S	*	*				155.8	143	112.5	-85.4	-59.8	0	0	0	116.9
716	H	27.5	Very low	28.4	Very low	172 Å²	172	139.8 Å²	139.8	80%	0.796	80%	0.802	S	S	*	*			trans	53	132	146.5	-58.9	-41.5	0	0	0	123.9
717	C	30.1	Very low	28.4	Very low	123 Å²	123	137.1 Å²	137.1	83%	0.831	79%	0.79	S	S	*	*			trans	-77.3	166.7	155.6	-50.3	0	0	0	0	111.2
718	P	35.3	Very low	28.4	Very low	124 Å²	124	133.2 Å²	133.2	81%	0.805	79%	0.792	S	S	*	*				-143.4	167.9	97.9	39.2	-26.4	0	0	0	115.4
719	E	30.3	Very low	28.6	Very low	173 Å²	173	132.9 Å²	132.9	81%	0.808	79%	0.785	S	S	*	*			trans	-72.6	165	160.3	-71.6	-170.7	120.1	0	0	111.4
720	P	40.7	Very low	28.5	Very low	125 Å²	125	136.9 Å²	136.9	81%	0.812	79%	0.785	S	S	*	*				-138.1	157.3	114.7	37.8	-27.9	0	0	0	116.8
721	L	28.4	Very low	28.4	Very low	169 Å²	169	138.5 Å²	138.5	89%	0.885	78%	0.781	S	S	*	*			trans	-58	163.5	173.3	-55.6	156	0	0	0	114
722	G	25.1	Very low	28.5	Very low	72 Å²	72	142.5 Å²	142.5	74%	0.742	79%	0.791	S	S	*	*			trans	163.4	46.7	158.3	0	0	0	0	0	123.3
723	S	27.8	Very low	28.7	Very low	119 Å²	119	142.1 Å²	142.1	83%	0.832	79%	0.793	S	S	*	*			trans	19.9	126.1	149.8	60.6	0	0	0	0	122.7
724	R	25.7	Very low	29.1	Very low	253 Å²	253	143.5 Å²	143.5	96%	0.955	80%	0.795	S	S	*	*				-163.5	154.8	113.9	-129.6	173.8	177.9	153.3	-0.5	113.6
725	A	27.4	Very low	29.3	Very low	84 Å²	84	140 Å²	140	69%	0.694	79%	0.791	S	S	*	*			trans	-118.1	177.2	168.8	0	0	0	0	0	108.8
726	P	38.8	Very low	29.6	Very low	126 Å²	126	142.6 Å²	142.6	82%	0.818	80%	0.799	S	S	*	*				-144.3	179	63.7	38.9	-18.5	0	0	0	117
727	S	26.6	Very low	29.7	Very low	93 Å²	93	144.3 Å²	144.3	65%	0.65	81%	0.805	S	S	*	*			trans	-71.8	161.7	-175.1	53.3	0	0	0	0	118
728	V	25.3	Very low	29.7	Very low	152 Å²	152	147.1 Å²	147.1	92%	0.921	80%	0.803	S	S	*	*			trans	-123.1	145.1	139.2	177.7	0	0	0	0	108.5
729	T	28.3	Very low	29.8	Very low	107 Å²	107	144.9 Å²	144.9	66%	0.656	79%	0.791	S	S	*	*			trans	-124.8	137.5	-170.5	47	0	0	0	0	112.8
730	Y	23.1	Very low	30.3	Very low	189 Å²	189	141.7 Å²	141.7	74%	0.741	79%	0.787	S	S	*	*			trans	170.1	151	151.4	-110.3	-139.9	0	0	0	108.5
731	R	25.8	Very low	30.1	Very low	187 Å²	187	143.2 Å²	143.2	71%	0.706	79%	0.785	S	S	*	*			cis	-153.7	142.2	-11.9	-153.7	-171.7	-145.9	177.6	11.9	107
732	N	27.8	Very low	31.2	Very low	164 Å²	164	139.2 Å²	139.2	88%	0.877	77%	0.768	S	S	*	*			trans	-78.4	143.2	170.2	-75.3	-8.7	0	0	0	110.6
733	S	29.5	Very low	31.8	Very low	117 Å²	117	141.9 Å²	141.9	82%	0.818	77%	0.765	S	S	*	*			trans	-140.5	122.6	162	59.6	0	0	0	0	108.5
734	E	35.6	Very low	32.4	Very low	204 Å²	204	145.7 Å²	145.7	95%	0.953	76%	0.761	S	S	*	*			trans	-75.7	142.4	-176.5	-59.6	179	129.3	0	0	111.7
735	G	29.2	Very low	33.1	Very low	63 Å²	63	136 Å²	136	65%	0.649	74%	0.74	S	S	*	*			trans	-135.5	116.4	174.8	0	0	0	0	0	109.9	F737	G735-F737 PolarHBondContact O-N 3.02Å
736	Q	33.2	Very low	33.7	Very low	178 Å²	178	137.5 Å²	137.5	83%	0.832	74%	0.736	S	S	*	*			trans	-71.4	121.2	-173.8	-69.1	175.2	-18.5	0	0	111.5	F738	Q736-F738 PolarHBondContact O-N 3.12Å
737	F	29.2	Very low	33.7	Very low	209 Å²	209	133.7 Å²	133.7	92%	0.917	72%	0.715	S	S	*	*			trans	-69.2	101.7	170.8	-86.1	-93.2	0	0	0	110.5	G735 S739	G735-F737 PolarHBondContact O-N 3.02Å; F737-S739 PolarHBondContact O-N 2.79Å
738	F	30.9	Very low	34.5	Very low	182 Å²	182	134.8 Å²	134.8	80%	0.798	71%	0.711	S	S	*	*			trans	-64.7	119.4	166.3	-98.5	-93.4	0	0	0	110.2	Q736 S740	Q736-F738 PolarHBondContact O-N 3.12Å; F738-S740 PolarHBondContact O-N 2.89Å
739	S	37	Very low	35.1	Very low	77 Å²	77	134.5 Å²	134.5	54%	0.538	70%	0.697	S	S	.	*			trans	-65.6	125.9	176.8	-179.9	0	0	0	0	110.7	F737 M741	F737-S739 PolarHBondContact O-N 2.79Å; S739-M741 PolarHBondContact O-N 2.97Å
740	S	40	Very low	35.9	Very low	105 Å²	105	133.1 Å²	133.1	73%	0.734	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	0.9	-179.4	53.6	0	0	0	0	114.8	F738 T742	F738-S740 PolarHBondContact O-N 2.89Å; S740-T742 PolarHBondContact O-N 2.66Å
741	M	36.9	Very low	36.7	Very low	157 Å²	157	128.7 Å²	128.7	77%	0.773	68%	0.677	S	S	*	*	H	α-helix	trans	-75.7	-16.8	-175	-159.5	167.8	69	0	0	114	S739	S739-M741 PolarHBondContact O-N 2.97Å
742	T	51.9	Low	37.2	Very low	85 Å²	85	121.9 Å²	121.9	52%	0.521	65%	0.654	S	S	.	*	H	α-helix	trans	-86.3	-37.2	-176.8	49.5	0	0	0	0	114.3	S740 W744 G745 L746	S740-T742 PolarHBondContact O-N 2.66Å; T742-W744 PolarHBondContact O-N 2.8Å; T742-G745 PolarHBondContact O-N 3.22Å; T742-G745 VanDerWaalsContact O-N 3.14Å; T742-L746 PolarHBondContact O-N 3.27Å
743	L	38.6	Very low	37.9	Very low	129 Å²	129	119 Å²	119	68%	0.675	64%	0.638	S	S	*	*	H	α-helix	trans	-60	-44.4	-178	-102	77.5	0	0	0	112.5	G745 L746 A747	L743-G745 VanDerWaalsContact C-N 3.29Å; L743-G745 PolarHBondContact O-N 3.04Å; L743-L746 PolarHBondContact O-N 2.84Å; L743-A747 PolarHBondContact O-N 2.92Å
744	W	40	Very low	38.6	Very low	198 Å²	198	119 Å²	119	75%	0.75	63%	0.625	S	S	*	*	H	α-helix	trans	-65.3	-31.6	177.6	-89.9	82.9	0	0	0	112.9	T742 L746 M748	T742-W744 PolarHBondContact O-N 2.8Å; W744-L746 VanDerWaalsContact C-N 3.35Å; W744-M748 WeakPolarHBondContact O-CB 2.98Å; W744-M748 WeakPolarHBondContact O-CG 3.35Å; W744-M748 PolarHBondContact O-N 2.86Å
745	G	39.9	Very low	38.8	Very low	50 Å²	50	114.8 Å²	114.8	52%	0.515	61%	0.605	S	S	.	*	H	α-helix	trans	-66.4	-35.1	173.9	0	0	0	0	0	113.1	T742 L743 K749	T742-G745 PolarHBondContact O-N 3.22Å; T742-G745 VanDerWaalsContact O-N 3.14Å; L743-G745 VanDerWaalsContact C-N 3.29Å; L743-G745 PolarHBondContact O-N 3.04Å; G745-K749 PolarHBondContact O-N 2.91Å
746	L	39.8	Very low	39.3	Very low	116 Å²	116	117.3 Å²	117.3	61%	0.607	60%	0.6	S	S	*	*	H	α-helix	trans	-75	-45.7	176.2	-75	162.6	0	0	0	112.1	T742 L743 W744 M748 K749 T750	T742-L746 PolarHBondContact O-N 3.27Å; L743-L746 PolarHBondContact O-N 2.84Å; W744-L746 VanDerWaalsContact C-N 3.35Å; L746-M748 VanDerWaalsContact C-N 3.32Å; L746-M748 PolarHBondContact O-N 3.39Å; L746-K749 WeakPolarHBondContact O-CA 3.4Å; L746-K749 WeakPolarHBondContact O-CB 3.32Å; L746-K749 PolarHBondContact O-N 3.2Å; L746-T750 PolarHBondContact O-N 3.43Å; L746-T750 PolarHBondContact O-OG1 2.7Å
747	A	38.5	Very low	39.5	Very low	45 Å²	45	116.2 Å²	116.2	37%	0.372	60%	0.599	S	S	.	*	H	α-helix	trans	-59.7	-39.6	178.8	0	0	0	0	0	113	L743 K749 T750 L751	L743-A747 PolarHBondContact O-N 2.92Å; A747-K749 PolarHBondContact O-N 3.25Å; A747-T750 PolarHBondContact O-N 3.39Å; A747-T750 PolarHBondContact O-OG1 3.34Å; A747-L751 PolarHBondContact O-N 3.02Å
748	M	43.5	Very low	40	Very low	116 Å²	116	114.1 Å²	114.1	57%	0.571	59%	0.592	S	S	*	*	H	α-helix	trans	-74.7	-9.7	175	-67	-63.4	-67.7	0	0	113.7	W744 L746	W744-M748 WeakPolarHBondContact O-CB 2.98Å; W744-M748 WeakPolarHBondContact O-CG 3.35Å; W744-M748 PolarHBondContact O-N 2.86Å; L746-M748 VanDerWaalsContact C-N 3.32Å; L746-M748 PolarHBondContact O-N 3.39Å
749	K	39.3	Very low	40	Very low	147 Å²	147	116.8 Å²	116.8	64%	0.639	61%	0.607	S	S	*	*	H	α-helix	trans	-89.9	-39.4	171.9	-161	174.2	-178.2	-176.6	0	111.2	G745 L746 A747 Q752	G745-K749 PolarHBondContact O-N 2.91Å; L746-K749 WeakPolarHBondContact O-CA 3.4Å; L746-K749 WeakPolarHBondContact O-CB 3.32Å; L746-K749 PolarHBondContact O-N 3.2Å; A747-K749 PolarHBondContact O-N 3.25Å; K749-Q752 WeakPolarHBondContact O-CB 3.44Å; K749-Q752 PolarHBondContact O-N 3.39Å
750	T	43.3	Very low	40.2	Very low	77 Å²	77	118.8 Å²	118.8	47%	0.472	61%	0.611	S	S	.	*	H	α-helix	trans	-64.5	-44.5	174.7	45.4	0	0	0	0	112.5	L746 A747 Q752 N753	L746-T750 PolarHBondContact O-N 3.43Å; L746-T750 PolarHBondContact O-OG1 2.7Å; A747-T750 PolarHBondContact O-N 3.39Å; A747-T750 PolarHBondContact O-OG1 3.34Å; T750-Q752 PolarHBondContact O-N 2.85Å; T750-N753 PolarHBondContact O-N 3.23Å; T750-N753 VanDerWaalsContact O-N 3.09Å
751	L	40.4	Very low	40.2	Very low	96 Å²	96	119.5 Å²	119.5	50%	0.503	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.2	-3	176.6	-72.1	171	0	0	0	114.3	A747	A747-L751 PolarHBondContact O-N 3.02Å
752	Q	37.8	Very low	40.4	Very low	44 Å²	44	117.4 Å²	117.4	21%	0.206	60%	0.595	C	S	.	*	T	Hydrogen-bonded Turn	trans	-86.2	-26.3	173.5	-154.6	74	85.1	0	0	113	K749 T750	K749-Q752 WeakPolarHBondContact O-CB 3.44Å; K749-Q752 PolarHBondContact O-N 3.39Å; T750-Q752 PolarHBondContact O-N 2.85Å
753	N	40.6	Very low	39.7	Very low	103 Å²	103	119.3 Å²	119.3	55%	0.551	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-29	-169.2	-70.8	24.1	0	0	0	113.2	T750 H755 E756	T750-N753 PolarHBondContact O-N 3.23Å; T750-N753 VanDerWaalsContact O-N 3.09Å; N753-H755 PolarHBondContact O-N 3.32Å; N753-E756 PolarHBondContact O-N 2.83Å
754	E	44.3	Very low	39.8	Very low	119 Å²	119	118.7 Å²	118.7	56%	0.556	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-61.5	-29.2	-179.7	-67.2	177.9	161.7	0	0	112.1	E756 L757	E754-E756 PolarHBondContact O-N 2.9Å; E754-L757 PolarHBondContact O-N 3.31Å
755	H	40.9	Very low	39.8	Very low	115 Å²	115	113.4 Å²	113.4	53%	0.532	58%	0.584	S	S	.	*	G	3₁₀ helix	trans	-83.6	15.3	175.7	-151.7	42.8	0	0	0	114.1	N753	N753-H755 PolarHBondContact O-N 3.32Å
756	E	39.2	Very low	39.7	Very low	115 Å²	115	117.9 Å²	117.9	54%	0.537	59%	0.589	S	S	.	*	G	3₁₀ helix	trans	-121.7	14.6	166.3	-72.2	170.7	-174.9	0	0	111	R299 N753 E754	R299-E756 IonicContact CZ-OE1 2.59Å; R299-E756 IonicContact NH1-OE1 3.16Å; R299-E756 PolarHBondContact NH1-OE1 3.14Å; R299-E756 IonicContact NH2-OE1 3.96Å; R299-E756 PolarHBondContact NH2-OE1 3.24Å; N753-E756 PolarHBondContact O-N 2.83Å; E754-E756 PolarHBondContact O-N 2.9Å
757	L	37.7	Very low	39.7	Very low	155 Å²	155	118.1 Å²	118.1	81%	0.812	59%	0.587	S	S	*	*	S	Bend	trans	-117.9	-0.9	175.8	-156.2	70	0	0	0	113.1	E754	E754-L757 PolarHBondContact O-N 3.31Å
758	E	39.3	Very low	39.9	Very low	166 Å²	166	124.2 Å²	124.2	78%	0.776	61%	0.605	S	S	*	*			trans	-109.7	23.3	171.6	-66.6	-173.5	129.4	0	0	112.2
759	Q	32.1	Very low	39.5	Very low	237 Å²	237	124.9 Å²	124.9	100%	1.107	61%	0.608	S	S	*	*			trans	-128.2	0	168.1	-78	-149.8	-104	0	0	110

Retrieved 759 of 759 residues in 540.7 ms (Link to these results)

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